A0A3Q0KT57_SCHMA Loading...

Putative cement protein 3B variant 3 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KT57, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 796 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	38.9	Very low	36.2	Very low	245 Å²	245	128 Å²	128	100%	1.207	70%	0.695	S	S	*	*				0	61.9	0	-62.8	-165.9	-70	0	0	111
2	G	39.6	Very low	35.8	Very low	36 Å²	36	130.4 Å²	130.4	37%	0.371	71%	0.708	S	S	.	*			trans	-148.1	8.2	-173.7	0	0	0	0	0	116.4
3	L	36.5	Very low	35.4	Very low	143 Å²	143	137.5 Å²	137.5	75%	0.749	73%	0.727	S	S	*	*	S	Bend	trans	-83.1	-27.1	177.1	-97.8	153.2	0	0	0	112.5	S6	L3-S6 WeakPolarHBondContact O-CB 3.46Å; L3-S6 PolarHBondContact O-N 2.93Å
4	E	34.4	Very low	34.9	Very low	135 Å²	135	133.5 Å²	133.5	63%	0.631	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-75	-33.6	179.6	-70.5	-70	126	0	0	112.3	S6 K7	E4-S6 PolarHBondContact O-N 3.43Å; E4-S6 VanDerWaalsContact O-N 3.07Å; E4-K7 PolarHBondContact O-N 3.11Å; E4-K7 IonicContact OE1-NZ 3.97Å; E4-K7 PolarHBondContact OE1-NZ 3.39Å; E4-K7 IonicContact OE2-NZ 3.35Å
5	E	37.1	Very low	34.5	Very low	169 Å²	169	135.7 Å²	135.7	79%	0.79	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-68.8	-7.9	175.5	-65.3	-177	174.8	0	0	113.6	K7	E5-K7 VanDerWaalsContact C-N 3.34Å
6	S	42.8	Very low	34.2	Very low	70 Å²	70	134.3 Å²	134.3	49%	0.49	74%	0.737	S	S	.	*	G	3₁₀ helix	trans	-84.2	-9.6	174	-52	0	0	0	0	112.9	L3 E4 L8	L3-S6 WeakPolarHBondContact O-CB 3.46Å; L3-S6 PolarHBondContact O-N 2.93Å; E4-S6 PolarHBondContact O-N 3.43Å; E4-S6 VanDerWaalsContact O-N 3.07Å; S6-L8 PolarHBondContact O-N 3.49Å
7	K	36	Very low	34.1	Very low	133 Å²	133	136.8 Å²	136.8	58%	0.578	75%	0.749	S	S	*	*	S	Bend	trans	-92.5	96	179.2	-68.7	175.4	-178.5	164.2	0	110	E4 E5	E4-K7 PolarHBondContact O-N 3.11Å; E4-K7 IonicContact OE1-NZ 3.97Å; E4-K7 PolarHBondContact OE1-NZ 3.39Å; E4-K7 IonicContact OE2-NZ 3.35Å; E5-K7 VanDerWaalsContact C-N 3.34Å
8	L	37.5	Very low	34.1	Very low	146 Å²	146	137.8 Å²	137.8	76%	0.764	74%	0.74	S	S	*	*			trans	49.1	100.7	151.7	-69.1	105.8	0	0	0	118.2	S6 Q10	S6-L8 PolarHBondContact O-N 3.49Å; L8-Q10 PolarHBondContact O-N 3.44Å
9	G	30.2	Very low	34.3	Very low	72 Å²	72	134.3 Å²	134.3	74%	0.742	73%	0.725	S	S	*	*			trans	-63.4	107.9	134.5	0	0	0	0	0	108.3	T11	G9-T11 VanDerWaalsContact C-N 3.3Å; G9-T11 PolarHBondContact O-N 3.03Å
10	Q	30.2	Very low	34.2	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	73%	0.733	S	S	*	*			trans	-60.7	94.6	166.6	-79.8	177.7	-10.7	0	0	108.2	L8	L8-Q10 PolarHBondContact O-N 3.44Å
11	T	34.6	Very low	34.3	Very low	81 Å²	81	130.9 Å²	130.9	50%	0.497	71%	0.706	S	S	.	*			trans	-74.1	126.2	168.2	54.8	0	0	0	0	108.6	G9 K13 R18	G9-T11 VanDerWaalsContact C-N 3.3Å; G9-T11 PolarHBondContact O-N 3.03Å; T11-K13 PolarHBondContact O-N 3.32Å; T11-R18 PolarHBondContact OG1-NH2 3.25Å
12	N	32.1	Very low	33.9	Very low	157 Å²	157	124.5 Å²	124.5	84%	0.84	68%	0.684	S	S	*	*			trans	-42.9	127.2	173.1	-75.6	-25.7	0	0	0	111.8	A14	N12-A14 VanDerWaalsContact C-N 3.26Å; N12-A14 PolarHBondContact O-N 3Å
13	K	29.8	Very low	33.8	Very low	222 Å²	222	128.5 Å²	128.5	97%	0.965	69%	0.692	S	S	*	*	S	Bend	trans	-69.8	77.5	174.8	-71.3	177.3	176.6	176	0	109.7	T11	T11-K13 PolarHBondContact O-N 3.32Å
14	A	29.2	Very low	33.6	Very low	82 Å²	82	131.2 Å²	131.2	68%	0.678	70%	0.698	S	S	*	*	S	Bend	trans	-155.7	120.3	163.8	0	0	0	0	0	109.6	N12	N12-A14 VanDerWaalsContact C-N 3.26Å; N12-A14 PolarHBondContact O-N 3Å
15	N	28.5	Very low	33.4	Very low	166 Å²	166	127.6 Å²	127.6	89%	0.888	69%	0.691	S	S	*	*	S	Bend	trans	59.7	72.1	167.5	-77.8	-4.7	0	0	0	119.1
16	C	29.3	Very low	33.5	Very low	114 Å²	114	125.4 Å²	125.4	77%	0.77	69%	0.691	S	S	*	*			trans	-150.4	122.1	152.2	-115.7	0	0	0	0	111.2	R18	C16-R18 PolarHBondContact O-N 3.09Å
17	N	33.2	Very low	33.9	Very low	176 Å²	176	125.5 Å²	125.5	94%	0.941	69%	0.689	S	S	*	*			trans	-59.2	84.4	164.6	-76.6	-15.6	0	0	0	108.6
18	R	34.7	Very low	34.9	Very low	156 Å²	156	120.9 Å²	120.9	59%	0.589	67%	0.674	S	S	*	*			trans	-77.5	125.1	179.5	-95.7	-175.2	171.4	165	0.2	109.1	T11 C16	T11-R18 PolarHBondContact OG1-NH2 3.25Å; C16-R18 PolarHBondContact O-N 3.09Å
19	P	36.5	Very low	36.1	Very low	70 Å²	70	117 Å²	117	46%	0.455	66%	0.657	S	S	.	*			trans	-59.8	142.4	164.2	25.3	-30.4	0	0	0	108.5	L21	P19-L21 HydrophobicContact CG-CD1 4.24Å; P19-L21 PolarHBondContact O-N 3.49Å
20	N	32.8	Very low	37.8	Very low	166 Å²	166	113.9 Å²	113.9	89%	0.888	63%	0.625	S	S	*	*			trans	-59.2	78.4	175	-81.3	-35.2	0	0	0	110.5	C22	N20-C22 PolarHBondContact O-N 2.8Å
21	L	37.2	Very low	40.1	Very low	31 Å²	31	113.1 Å²	113.1	16%	0.162	61%	0.614	C	S	.	*			trans	-69.4	112.2	169.6	-81.2	128.8	0	0	0	106.9	P19 F23 F49	P19-L21 HydrophobicContact CG-CD1 4.24Å; P19-L21 PolarHBondContact O-N 3.49Å; L21-F23 HydrophobicContact CB-CD2 3.37Å; L21-F23 HydrophobicContact CB-CE2 3.1Å; L21-F23 HydrophobicContact CB-CG 4.28Å; L21-F23 HydrophobicContact CB-CZ 3.81Å; L21-F23 HydrophobicContact CD1-CE2 3.82Å; L21-F23 HydrophobicContact CD1-CZ 4.21Å; L21-F23 HydrophobicContact CD2-CE1 4.36Å; L21-F23 HydrophobicContact CD2-CE2 3.84Å; L21-F23 HydrophobicContact CD2-CZ 3.64Å; L21-F23 HydrophobicContact CG-CD2 4.47Å; L21-F23 HydrophobicContact CG-CE2 3.76Å; L21-F23 HydrophobicContact CG-CZ 4.1Å; L21-F23 WeakPolarHBondContact O-CD2 3.45Å; L21-F23 PolarHBondContact O-N 3.35Å; L21-F49 HydrophobicContact CD2-CE1 3.98Å; L21-F49 HydrophobicContact CD2-CE2 3.99Å; L21-F49 HydrophobicContact CD2-CZ 3.27Å
22	C	30.3	Very low	42.5	Very low	111 Å²	111	111.8 Å²	111.8	75%	0.75	60%	0.604	S	S	*	*			trans	-68.3	74.1	174	-71.7	0	0	0	0	109.9	N20 F24	N20-C22 PolarHBondContact O-N 2.8Å; C22-F24 PolarHBondContact O-N 3.15Å
23	F	36.9	Very low	45.1	Very low	121 Å²	121	106.7 Å²	106.7	53%	0.531	58%	0.576	S	S	.	*			trans	-77.9	-4.6	175.6	-74.2	-69.5	0	0	0	113.2	L21	L21-F23 HydrophobicContact CB-CD2 3.37Å; L21-F23 HydrophobicContact CB-CE2 3.1Å; L21-F23 HydrophobicContact CB-CG 4.28Å; L21-F23 HydrophobicContact CB-CZ 3.81Å; L21-F23 HydrophobicContact CD1-CE2 3.82Å; L21-F23 HydrophobicContact CD1-CZ 4.21Å; L21-F23 HydrophobicContact CD2-CE1 4.36Å; L21-F23 HydrophobicContact CD2-CE2 3.84Å; L21-F23 HydrophobicContact CD2-CZ 3.64Å; L21-F23 HydrophobicContact CG-CD2 4.47Å; L21-F23 HydrophobicContact CG-CE2 3.76Å; L21-F23 HydrophobicContact CG-CZ 4.1Å; L21-F23 WeakPolarHBondContact O-CD2 3.45Å; L21-F23 PolarHBondContact O-N 3.35Å
24	F	31.8	Very low	47.9	Very low	199 Å²	199	97.3 Å²	97.3	87%	0.873	54%	0.535	S	S	*	.	S	Bend	trans	-113	-3.2	-169.8	-65	-76	0	0	0	115.5	C22	C22-F24 PolarHBondContact O-N 3.15Å
25	A	30.3	Very low	50.7	Low	60 Å²	60	95.9 Å²	95.9	50%	0.496	52%	0.515	S	S	.	.	S	Bend	trans	-84.7	137	172.2	0	0	0	0	0	109.9	V27	A25-V27 WeakPolarHBondContact O-CG2 3.41Å; A25-V27 PolarHBondContact O-N 2.76Å
26	P	40	Very low	53.6	Low	122 Å²	122	88.1 Å²	88.1	79%	0.792	47%	0.473	S	S	*	.			trans	-56.7	110.7	173.2	21.2	-29.9	0	0	0	108.6	S28	P26-S28 PolarHBondContact O-N 2.96Å
27	V	51.1	Low	56.3	Low	73 Å²	73	83.9 Å²	83.9	44%	0.442	44%	0.444	S	S	.	.			trans	-72.8	96.8	-173.9	-170.6	0	0	0	0	108.2	A25 I33 Q729	A25-V27 WeakPolarHBondContact O-CG2 3.41Å; A25-V27 PolarHBondContact O-N 2.76Å; V27-I33 HydrophobicContact CG1-CG2 3.37Å; V27-Q729 HydrophobicContact CB-CG 4.3Å; V27-Q729 HydrophobicContact CG1-CB 3.41Å; V27-Q729 VanDerWaalsContact CG1-CB 3.41Å; V27-Q729 HydrophobicContact CG1-CG 3.42Å; V27-Q729 VanDerWaalsContact CG1-CG 3.42Å
28	S	56.1	Low	58.7	Low	36 Å²	36	76 Å²	76	25%	0.252	40%	0.402	S	S	.	.			trans	-67.6	134.7	176.4	59.3	0	0	0	0	110	P26 G30 R31	P26-S28 PolarHBondContact O-N 2.96Å; S28-G30 PolarHBondContact O-N 2.84Å; S28-R31 PolarHBondContact O-N 3.48Å; S28-R31 WeakPolarHBondContact OG-CD 3.4Å; S28-R31 WeakPolarHBondContact OG-CG 3.34Å; S28-R31 VanDerWaalsContact OG-CZ 3.25Å; S28-R31 PolarHBondContact OG-NE 2.99Å; S28-R31 PolarHBondContact OG-NH1 3.11Å
29	P	62.9	Low	61	Low	65 Å²	65	73.4 Å²	73.4	42%	0.422	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	135.7	178.4	-32.9	37.7	0	0	0	115	R31 R504 P731	P29-R31 VanDerWaalsContact C-N 3.27Å; P29-R31 PolarHBondContact O-N 2.71Å; P29-R504 PolarHBondContact O-NH1 3.44Å; P29-P731 HydrophobicContact CB-CB 3.92Å; P29-P731 HydrophobicContact CB-CG 4.04Å; P29-P731 HydrophobicContact CG-CB 4.31Å
30	G	67.2	Low	63.4	Low	6 Å²	6	73.7 Å²	73.7	6%	0.062	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	15.7	178.3	0	0	0	0	0	116.1	S28 R504 Y728 Q729	S28-G30 PolarHBondContact O-N 2.84Å; G30-R504 VanDerWaalsContact C-CZ 3.47Å; G30-R504 PolarHBondContact O-NH1 3.27Å; G30-R504 PolarHBondContact O-NH2 3.36Å; G30-Y728 WeakPolarHBondContact O-CD1 3.39Å; G30-Q729 WeakPolarHBondContact CA-O 3.43Å; G30-Q729 PolarHBondContact N-O 3.19Å
31	R	78.5	Confident	66	Low	162 Å²	162	65.8 Å²	65.8	61%	0.611	35%	0.351	S	S	*	.			trans	-77.1	152.3	164.1	-75.8	-165.8	-172.7	155.4	1.3	111.5	S28 P29 I33 Y728 Q729	S28-R31 PolarHBondContact O-N 3.48Å; S28-R31 WeakPolarHBondContact OG-CD 3.4Å; S28-R31 WeakPolarHBondContact OG-CG 3.34Å; S28-R31 VanDerWaalsContact OG-CZ 3.25Å; S28-R31 PolarHBondContact OG-NE 2.99Å; S28-R31 PolarHBondContact OG-NH1 3.11Å; P29-R31 VanDerWaalsContact C-N 3.27Å; P29-R31 PolarHBondContact O-N 2.71Å; R31-I33 PolarHBondContact O-N 3.32Å; R31-Y728 WeakPolarHBondContact O-CA 3.37Å; R31-Q729 PolarHBondContact O-N 3.37Å
32	I	84.6	Confident	68.1	Low	53 Å²	53	68.8 Å²	68.8	27%	0.272	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122.6	165.8	-58.7	169.8	0	0	0	107.2	H34 L726 V727 Y728	I32-H34 WeakPolarHBondContact CG2-O 3.39Å; I32-L726 HydrophobicContact CD1-CD1 4.19Å; I32-L726 HydrophobicContact CD1-CD2 4.41Å; I32-L726 HydrophobicContact CG2-CD2 4.49Å; I32-V727 CarbonylContact C-O 3.54Å; I32-V727 WeakPolarHBondContact CA-O 3.46Å; I32-Y728 HydrophobicContact CD1-CE1 4.19Å; I32-Y728 HydrophobicContact CG1-CD1 3.92Å; I32-Y728 HydrophobicContact CG1-CE1 3.38Å; I32-Y728 HydrophobicContact CG1-CE2 4.11Å; I32-Y728 HydrophobicContact CG1-CG 4.49Å; I32-Y728 VanDerWaalsContact CG1-CZ 3.5Å
33	I	86.8	Confident	70.6	Confident	49 Å²	49	71.7 Å²	71.7	25%	0.251	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-16.7	176.6	59.8	170.7	0	0	0	112.5	V27 R31 F49 R532 V727 Q729	V27-I33 HydrophobicContact CG1-CG2 3.37Å; R31-I33 PolarHBondContact O-N 3.32Å; I33-F49 HydrophobicContact CD1-CD1 4.2Å; I33-F49 HydrophobicContact CD1-CE1 4.28Å; I33-R532 HydrophobicContact CD1-CG 4.01Å; I33-V727 HydrophobicContact CD1-CG1 3.84Å; I33-V727 HydrophobicContact CG1-CB 4Å; I33-V727 HydrophobicContact CG1-CG1 3.76Å; I33-V727 WeakPolarHBondContact CG1-O 3.35Å; I33-V727 PolarHBondContact N-O 2.82Å; I33-Q729 HydrophobicContact CG2-CB 3.81Å
34	H	88.3	Confident	72.7	Confident	26 Å²	26	68.8 Å²	68.8	12%	0.12	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	146.1	178.8	-167.5	59	0	0	0	111.6	I32 H45 F49 V727	I32-H34 WeakPolarHBondContact CG2-O 3.39Å; H34-H45 AromaticContact CE1-ND1 3.82Å; H34-H45 AromaticContact NE2-CE1 3.7Å; H34-H45 AromaticContact NE2-CG 3.68Å; H34-H45 AromaticContact NE2-ND1 3.09Å; H34-H45 PolarHBondContact NE2-ND1 2.85Å; H34-F49 HydrophobicContact CB-CE1 3.74Å; H34-F49 HydrophobicContact CB-CE2 3.83Å; H34-F49 HydrophobicContact CB-CZ 3.31Å; H34-F49 AromaticContact CD2-CD2 4Å; H34-F49 AromaticContact CD2-CE2 3.24Å; H34-F49 WeakPolarHBondContact CD2-CE2 3.46Å; H34-F49 AromaticContact CD2-CZ 3.65Å; H34-F49 AromaticContact CE1-CE2 3.9Å; H34-F49 AromaticContact CG-CE2 3.34Å; H34-F49 AromaticContact CG-CZ 3.2Å; H34-F49 AromaticContact ND1-CE2 3.79Å; H34-F49 AromaticContact ND1-CZ 3.52Å; H34-F49 AromaticContact NE2-CE2 3.59Å; H34-V727 HydrophobicContact CB-CB 3.96Å; H34-V727 HydrophobicContact CB-CG2 3.98Å; H34-V727 PolarHBondContact N-O 3.44Å; H34-V727 PolarHBondContact O-N 3.07Å
35	Q	88.7	Confident	75.3	Confident	51 Å²	51	60.1 Å²	60.1	24%	0.238	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	129.9	174	173.7	171	-18	0	0	108.6	V724 L725 L726	Q35-V724 HydrophobicContact CG-CG1 3.45Å; Q35-V724 VanDerWaalsContact CG-CG1 3.45Å; Q35-L725 WeakPolarHBondContact CA-O 3.46Å; Q35-L726 HydrophobicContact CB-CD2 3.97Å; Q35-L726 HydrophobicContact CG-CD2 3.73Å
36	C	88.3	Confident	77.9	Confident	3 Å²	3	59 Å²	59	2%	0.02	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	169.9	173.7	67.5	0	0	0	0	112	L40 H45 L725	C36-L40 HydrophobicContact CB-CB 4.09Å; C36-L40 HydrophobicContact CB-CD1 4.28Å; C36-H45 WeakPolarHBondContact CB-ND1 3.39Å; C36-H45 PolarHBondContact SG-ND1 3.44Å; C36-H45 VanDerWaalsContact SG-ND1 3.44Å; C36-L725 PolarHBondContact N-O 3.38Å; C36-L725 PolarHBondContact O-N 3.38Å
37	T	87.1	Confident	80	Confident	25 Å²	25	59 Å²	59	15%	0.153	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	162.2	168	60.5	0	0	0	0	111.2	E39 L40 W41 F561	T37-E39 PolarHBondContact O-N 3.36Å; T37-L40 PolarHBondContact O-N 2.87Å; T37-L40 WeakPolarHBondContact OG1-CG 3.4Å; T37-L40 PolarHBondContact OG1-N 2.91Å; T37-W41 PolarHBondContact O-N 3.46Å; T37-W41 VanDerWaalsContact O-N 3.07Å; T37-F561 HydrophobicContact CG2-CE2 3.71Å; T37-F561 HydrophobicContact CG2-CZ 3.67Å
38	L	83.5	Confident	81.6	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-30.5	176.8	-175.2	61.1	0	0	0	112.1	W41 K42 M56 V57 I536	L38-W41 WeakPolarHBondContact O-CB 3.49Å; L38-W41 PolarHBondContact O-N 2.84Å; L38-K42 HydrophobicContact CG-CD 4.32Å; L38-K42 WeakPolarHBondContact O-CB 3.29Å; L38-K42 VanDerWaalsContact O-CG 3.29Å; L38-K42 WeakPolarHBondContact O-CG 3.33Å; L38-K42 PolarHBondContact O-N 3.08Å; L38-M56 HydrophobicContact CD1-CB 4.36Å; L38-V57 HydrophobicContact CD1-CG2 4.3Å; L38-V57 HydrophobicContact CD2-CB 4.46Å; L38-V57 HydrophobicContact CD2-CG2 3.64Å; L38-I536 HydrophobicContact CD1-CD1 3.78Å
39	E	83.1	Confident	82.9	Confident	102 Å²	102	58 Å²	58	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-70.8	-46.4	-178.1	-69.6	57.5	-135.7	0	0	109.7	T37 W41 K42 K43	T37-E39 PolarHBondContact O-N 3.36Å; E39-W41 VanDerWaalsContact C-N 3.3Å; E39-W41 PolarHBondContact O-N 3.3Å; E39-K42 PolarHBondContact O-N 3.23Å; E39-K43 WeakPolarHBondContact O-CB 3.3Å; E39-K43 VanDerWaalsContact O-CG 3.31Å; E39-K43 WeakPolarHBondContact O-CG 3.4Å; E39-K43 PolarHBondContact O-N 3.02Å
40	L	85.9	Confident	84	Confident	75 Å²	75	57.4 Å²	57.4	39%	0.393	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-37.7	173.3	-72.4	171	0	0	0	111.5	C36 T37 K43 S44 H45	C36-L40 HydrophobicContact CB-CB 4.09Å; C36-L40 HydrophobicContact CB-CD1 4.28Å; T37-L40 PolarHBondContact O-N 2.87Å; T37-L40 WeakPolarHBondContact OG1-CG 3.4Å; T37-L40 PolarHBondContact OG1-N 2.91Å; L40-K43 PolarHBondContact O-N 2.81Å; L40-S44 PolarHBondContact O-N 3Å; L40-S44 VanDerWaalsContact O-N 3.11Å; L40-H45 PolarHBondContact O-N 3.37Å; L40-H45 VanDerWaalsContact O-N 3.14Å
41	W	87.1	Confident	85	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	27%	0.271	C	S	.	.	I	π-helix	trans	-60.3	-49.4	174.4	-176.1	-103.9	0	0	0	112.7	T37 L38 E39 H45 R46 F49 F51 A534 L725 V727	T37-W41 PolarHBondContact O-N 3.46Å; T37-W41 VanDerWaalsContact O-N 3.07Å; L38-W41 WeakPolarHBondContact O-CB 3.49Å; L38-W41 PolarHBondContact O-N 2.84Å; E39-W41 VanDerWaalsContact C-N 3.3Å; E39-W41 PolarHBondContact O-N 3.3Å; W41-H45 HydrophobicContact CE3-CB 3.96Å; W41-H45 HydrophobicContact CZ3-CB 4.5Å; W41-R46 HydrophobicContact CD2-CB 4.09Å; W41-R46 HydrophobicContact CZ2-CB 3.97Å; W41-R46 PolarHBondContact O-N 3.44Å; W41-F49 HydrophobicContact CH2-CB 4.33Å; W41-F49 HydrophobicContact CZ3-CB 4.42Å; W41-F49 HydrophobicContact CZ3-CD2 4.08Å; W41-F51 HydrophobicContact CH2-CB 4.35Å; W41-F51 HydrophobicContact CH2-CD1 4.29Å; W41-F51 AromaticContact CH2-CD2 3.44Å; W41-F51 HydrophobicContact CH2-CD2 3.44Å; W41-F51 VanDerWaalsContact CH2-CD2 3.44Å; W41-F51 HydrophobicContact CH2-CE1 4.5Å; W41-F51 AromaticContact CH2-CE2 3.71Å; W41-F51 HydrophobicContact CH2-CE2 3.71Å; W41-F51 AromaticContact CH2-CG 3.77Å; W41-F51 HydrophobicContact CH2-CG 3.77Å; W41-F51 HydrophobicContact CH2-CZ 4.25Å; W41-F51 HydrophobicContact CZ2-CB 3.89Å; W41-F51 AromaticContact CZ2-CD1 3.93Å; W41-F51 HydrophobicContact CZ2-CD1 3.93Å; W41-F51 AromaticContact CZ2-CD2 3.8Å; W41-F51 HydrophobicContact CZ2-CD2 3.8Å; W41-F51 HydrophobicContact CZ2-CE1 4.42Å; W41-F51 HydrophobicContact CZ2-CE2 4.32Å; W41-F51 AromaticContact CZ2-CG 3.59Å; W41-F51 HydrophobicContact CZ2-CG 3.59Å; W41-A534 HydrophobicContact CH2-CB 4.19Å; W41-A534 HydrophobicContact CZ2-CB 4.16Å; W41-L725 HydrophobicContact CB-CD1 4.02Å; W41-L725 HydrophobicContact CD2-CD1 3.47Å; W41-L725 VanDerWaalsContact CD2-CD1 3.47Å; W41-L725 HydrophobicContact CD2-CD2 3.74Å; W41-L725 HydrophobicContact CD2-CG 4.22Å; W41-L725 HydrophobicContact CE3-CD1 4.07Å; W41-L725 HydrophobicContact CE3-CD2 3.38Å; W41-L725 HydrophobicContact CE3-CG 4.33Å; W41-L725 HydrophobicContact CG-CD1 3.44Å; W41-L725 VanDerWaalsContact CG-CD1 3.44Å; W41-L725 HydrophobicContact CG-CD2 4.38Å; W41-L725 HydrophobicContact CG-CG 4.44Å; W41-L725 HydrophobicContact CH2-CD2 4.06Å; W41-L725 HydrophobicContact CZ2-CD1 4.3Å; W41-L725 HydrophobicContact CZ2-CD2 4.39Å; W41-L725 HydrophobicContact CZ3-CD2 3.57Å; W41-V727 HydrophobicContact CH2-CG2 3.93Å; W41-V727 HydrophobicContact CZ3-CG2 3.64Å
42	K	82.6	Confident	84.9	Confident	93 Å²	93	53 Å²	53	40%	0.404	27%	0.267	S	S	.	.	I	π-helix	trans	-65.2	-35.8	179.2	-75.3	171.9	178.7	174	0	112.6	L38 E39 R46	L38-K42 HydrophobicContact CG-CD 4.32Å; L38-K42 WeakPolarHBondContact O-CB 3.29Å; L38-K42 VanDerWaalsContact O-CG 3.29Å; L38-K42 WeakPolarHBondContact O-CG 3.33Å; L38-K42 PolarHBondContact O-N 3.08Å; E39-K42 PolarHBondContact O-N 3.23Å; K42-R46 PolarHBondContact O-NH1 3.23Å
43	K	82	Confident	84.2	Confident	173 Å²	173	52.3 Å²	52.3	75%	0.752	26%	0.264	S	S	*	.	I	π-helix	trans	-75.4	-52.5	-177.3	-75.1	-179.5	179.2	-173.2	0	112.9	E39 L40	E39-K43 WeakPolarHBondContact O-CB 3.3Å; E39-K43 VanDerWaalsContact O-CG 3.31Å; E39-K43 WeakPolarHBondContact O-CG 3.4Å; E39-K43 PolarHBondContact O-N 3.02Å; L40-K43 PolarHBondContact O-N 2.81Å
44	S	80.8	Confident	83.2	Confident	59 Å²	59	54.4 Å²	54.4	41%	0.413	27%	0.271	S	S	.	.	I	π-helix	trans	-144.7	-29.1	-168.5	60.9	0	0	0	0	115.6	L40 R46	L40-S44 PolarHBondContact O-N 3Å; L40-S44 VanDerWaalsContact O-N 3.11Å; S44-R46 PolarHBondContact O-N 2.91Å
45	H	85.8	Confident	82.2	Confident	17 Å²	17	54.8 Å²	54.8	8%	0.079	28%	0.275	C	S	.	.	I	π-helix	trans	-75.8	-30	-168.5	-62.7	169.9	0	0	0	114.2	H34 C36 L40 W41 E47 L48 F49	H34-H45 AromaticContact CE1-ND1 3.82Å; H34-H45 AromaticContact NE2-CE1 3.7Å; H34-H45 AromaticContact NE2-CG 3.68Å; H34-H45 AromaticContact NE2-ND1 3.09Å; H34-H45 PolarHBondContact NE2-ND1 2.85Å; C36-H45 WeakPolarHBondContact CB-ND1 3.39Å; C36-H45 PolarHBondContact SG-ND1 3.44Å; C36-H45 VanDerWaalsContact SG-ND1 3.44Å; L40-H45 PolarHBondContact O-N 3.37Å; L40-H45 VanDerWaalsContact O-N 3.14Å; W41-H45 HydrophobicContact CE3-CB 3.96Å; W41-H45 HydrophobicContact CZ3-CB 4.5Å; H45-E47 VanDerWaalsContact C-N 3.27Å; H45-E47 PolarHBondContact O-N 3.38Å; H45-L48 WeakPolarHBondContact O-CB 3.26Å; H45-L48 PolarHBondContact O-N 2.84Å; H45-F49 HydrophobicContact CB-CD2 4.46Å; H45-F49 HydrophobicContact CB-CE2 4.46Å; H45-F49 VanDerWaalsContact O-CD2 3.28Å; H45-F49 WeakPolarHBondContact O-CD2 3.43Å; H45-F49 PolarHBondContact O-N 3.26Å
46	R	85.2	Confident	81.6	Confident	37 Å²	37	52.6 Å²	52.6	14%	0.14	27%	0.265	C	S	.	.	H	α-helix	trans	-54.6	-40.5	-176.7	60.1	158.2	-168.2	-91.7	-16.3	113.8	W41 K42 S44 F49 N50 F51	W41-R46 HydrophobicContact CD2-CB 4.09Å; W41-R46 HydrophobicContact CZ2-CB 3.97Å; W41-R46 PolarHBondContact O-N 3.44Å; K42-R46 PolarHBondContact O-NH1 3.23Å; S44-R46 PolarHBondContact O-N 2.91Å; R46-F49 PolarHBondContact O-N 2.86Å; R46-N50 PolarHBondContact O-N 3.39Å; R46-F51 HydrophobicContact CB-CB 4.36Å; R46-F51 PolarHBondContact O-N 3.03Å
47	E	84.6	Confident	81.2	Confident	123 Å²	123	54.3 Å²	54.3	58%	0.575	28%	0.275	S	S	*	.	H	α-helix	trans	-75.3	-37.4	-176	-78.8	162.9	-144.5	0	0	110.7	H45 F49 N50	H45-E47 VanDerWaalsContact C-N 3.27Å; H45-E47 PolarHBondContact O-N 3.38Å; E47-F49 PolarHBondContact O-N 2.75Å; E47-N50 PolarHBondContact O-N 3.47Å
48	L	84.8	Confident	80.8	Confident	82 Å²	82	53.2 Å²	53.2	43%	0.429	27%	0.269	S	S	.	.	H	α-helix	trans	-58.1	-33.7	173.9	-64.5	173.9	0	0	0	112.4	H45	H45-L48 WeakPolarHBondContact O-CB 3.26Å; H45-L48 PolarHBondContact O-N 2.84Å
49	F	84.4	Confident	80.2	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.022	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	8.3	179.1	-67.3	-79.2	0	0	0	114.4	L21 I33 H34 W41 H45 R46 E47 F51 R532	L21-F49 HydrophobicContact CD2-CE1 3.98Å; L21-F49 HydrophobicContact CD2-CE2 3.99Å; L21-F49 HydrophobicContact CD2-CZ 3.27Å; I33-F49 HydrophobicContact CD1-CD1 4.2Å; I33-F49 HydrophobicContact CD1-CE1 4.28Å; H34-F49 HydrophobicContact CB-CE1 3.74Å; H34-F49 HydrophobicContact CB-CE2 3.83Å; H34-F49 HydrophobicContact CB-CZ 3.31Å; H34-F49 AromaticContact CD2-CD2 4Å; H34-F49 AromaticContact CD2-CE2 3.24Å; H34-F49 WeakPolarHBondContact CD2-CE2 3.46Å; H34-F49 AromaticContact CD2-CZ 3.65Å; H34-F49 AromaticContact CE1-CE2 3.9Å; H34-F49 AromaticContact CG-CE2 3.34Å; H34-F49 AromaticContact CG-CZ 3.2Å; H34-F49 AromaticContact ND1-CE2 3.79Å; H34-F49 AromaticContact ND1-CZ 3.52Å; H34-F49 AromaticContact NE2-CE2 3.59Å; W41-F49 HydrophobicContact CH2-CB 4.33Å; W41-F49 HydrophobicContact CZ3-CB 4.42Å; W41-F49 HydrophobicContact CZ3-CD2 4.08Å; H45-F49 HydrophobicContact CB-CD2 4.46Å; H45-F49 HydrophobicContact CB-CE2 4.46Å; H45-F49 VanDerWaalsContact O-CD2 3.28Å; H45-F49 WeakPolarHBondContact O-CD2 3.43Å; H45-F49 PolarHBondContact O-N 3.26Å; R46-F49 PolarHBondContact O-N 2.86Å; E47-F49 PolarHBondContact O-N 2.75Å; F49-F51 HydrophobicContact CB-CD2 3.74Å; F49-F51 HydrophobicContact CB-CE2 3.78Å; F49-F51 WeakPolarHBondContact O-CD2 3.24Å; F49-F51 WeakPolarHBondContact O-CE2 3.34Å; F49-R532 PolarHBondContact O-NH1 2.92Å; F49-R532 VanDerWaalsContact O-NH1 3.07Å
50	N	85.4	Confident	79.2	Confident	52 Å²	52	55.7 Å²	55.7	28%	0.278	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	43.7	178.4	-164.4	22.5	0	0	0	114.2	R46 E47 S527 R528	R46-N50 PolarHBondContact O-N 3.39Å; E47-N50 PolarHBondContact O-N 3.47Å; N50-S527 CarbonylContact O-C 3.56Å; N50-S527 WeakPolarHBondContact O-CA 3.2Å; N50-S527 WeakPolarHBondContact O-CB 3.14Å; N50-R528 WeakPolarHBondContact O-CG 3.31Å; N50-R528 PolarHBondContact O-N 3.26Å; N50-R528 WeakPolarHBondContact OD1-CD 3.47Å
51	F	88.2	Confident	77.8	Confident	1 Å²	1	56.7 Å²	56.7	0%	0.004	29%	0.288	C	S	.	.			trans	-98.5	138.5	173.8	-74.5	-103.7	0	0	0	111.3	W41 R46 F49 V525 M526 S527 R532 A534 V727	W41-F51 HydrophobicContact CH2-CB 4.35Å; W41-F51 HydrophobicContact CH2-CD1 4.29Å; W41-F51 AromaticContact CH2-CD2 3.44Å; W41-F51 HydrophobicContact CH2-CD2 3.44Å; W41-F51 VanDerWaalsContact CH2-CD2 3.44Å; W41-F51 HydrophobicContact CH2-CE1 4.5Å; W41-F51 AromaticContact CH2-CE2 3.71Å; W41-F51 HydrophobicContact CH2-CE2 3.71Å; W41-F51 AromaticContact CH2-CG 3.77Å; W41-F51 HydrophobicContact CH2-CG 3.77Å; W41-F51 HydrophobicContact CH2-CZ 4.25Å; W41-F51 HydrophobicContact CZ2-CB 3.89Å; W41-F51 AromaticContact CZ2-CD1 3.93Å; W41-F51 HydrophobicContact CZ2-CD1 3.93Å; W41-F51 AromaticContact CZ2-CD2 3.8Å; W41-F51 HydrophobicContact CZ2-CD2 3.8Å; W41-F51 HydrophobicContact CZ2-CE1 4.42Å; W41-F51 HydrophobicContact CZ2-CE2 4.32Å; W41-F51 AromaticContact CZ2-CG 3.59Å; W41-F51 HydrophobicContact CZ2-CG 3.59Å; R46-F51 HydrophobicContact CB-CB 4.36Å; R46-F51 PolarHBondContact O-N 3.03Å; F49-F51 HydrophobicContact CB-CD2 3.74Å; F49-F51 HydrophobicContact CB-CE2 3.78Å; F49-F51 WeakPolarHBondContact O-CD2 3.24Å; F49-F51 WeakPolarHBondContact O-CE2 3.34Å; F51-V525 HydrophobicContact CD1-CB 4.48Å; F51-V525 HydrophobicContact CD1-CG1 3.95Å; F51-V525 HydrophobicContact CE1-CG1 4.39Å; F51-V525 WeakPolarHBondContact CE1-O 3.34Å; F51-M526 WeakPolarHBondContact CD1-O 3.4Å; F51-S527 VanDerWaalsContact CE1-N 3.31Å; F51-R532 HydrophobicContact CE2-CB 4.24Å; F51-R532 HydrophobicContact CZ-CB 4.06Å; F51-A534 HydrophobicContact CD1-CB 4.27Å; F51-A534 HydrophobicContact CE1-CB 3.47Å; F51-A534 VanDerWaalsContact CE1-CB 3.47Å; F51-A534 HydrophobicContact CZ-CB 3.62Å; F51-V727 HydrophobicContact CE2-CG1 4.16Å; F51-V727 HydrophobicContact CZ-CG1 4.26Å
52	S	75.7	Confident	76.2	Confident	75 Å²	75	61.2 Å²	61.2	52%	0.524	31%	0.312	S	S	.	.			trans	-88.9	-29.6	177.3	48.2	0	0	0	0	113.9
53	D	69.2	Low	74.7	Confident	39 Å²	39	58.4 Å²	58.4	21%	0.209	30%	0.303	C	S	.	.			trans	-79.3	128.5	-172.1	-162.4	-7	0	0	0	111.3	V55 R74 V525	D53-V55 PolarHBondContact OD1-N 3.26Å; D53-R74 IonicContact OD2-CZ 3.38Å; D53-R74 IonicContact OD2-NE 3.28Å; D53-R74 PolarHBondContact OD2-NE 2.64Å; D53-R74 IonicContact OD2-NH2 2.66Å; D53-V525 HydrophobicContact CB-CG1 3.9Å
54	K	66	Low	73.2	Confident	93 Å²	93	55 Å²	55	40%	0.404	29%	0.29	S	S	.	.	S	Bend	trans	-85.5	-20.4	173.8	-67.7	-174.8	178.5	-178.6	0	111.7
55	V	68.7	Low	71.9	Confident	34 Å²	34	53.8 Å²	53.8	21%	0.206	28%	0.279	C	S	.	.			trans	-121.7	92.9	-166.5	-177	0	0	0	0	110.6	D53 V57 T73 R74	D53-V55 PolarHBondContact OD1-N 3.26Å; V55-V57 WeakPolarHBondContact CG1-O 3.28Å; V55-T73 HydrophobicContact CG1-CG2 3.42Å; V55-T73 VanDerWaalsContact CG1-CG2 3.42Å; V55-R74 HydrophobicContact CB-CG 4.23Å; V55-R74 HydrophobicContact CG1-CG 4.16Å; V55-R74 PolarHBondContact O-NE 3.42Å
56	M	75.1	Confident	70.6	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.025	28%	0.276	C	S	.	.	S	Bend	trans	-87.1	-10.3	173.8	-60.3	-72	-60.8	0	0	113.3	L38 V525 A534 I536 L725	L38-M56 HydrophobicContact CD1-CB 4.36Å; M56-V525 HydrophobicContact CE-CB 3.81Å; M56-V525 HydrophobicContact CE-CG2 3.64Å; M56-V525 HydrophobicContact SD-CB 3.51Å; M56-V525 VanDerWaalsContact SD-CB 3.51Å; M56-V525 HydrophobicContact SD-CG1 4.17Å; M56-V525 HydrophobicContact SD-CG2 3.23Å; M56-V525 WeakPolarHBondContact SD-CG2 3.3Å; M56-A534 HydrophobicContact CE-CB 4.12Å; M56-I536 HydrophobicContact CB-CD1 3.54Å; M56-L725 HydrophobicContact CE-CD1 4.23Å; M56-L725 HydrophobicContact CG-CD1 4.36Å
57	V	79.4	Confident	69.4	Low	38 Å²	38	53.8 Å²	53.8	23%	0.23	28%	0.284	C	S	.	.			trans	-135.6	132.7	-175.2	-178.3	0	0	0	0	108.9	L38 V55 N521 I536	L38-V57 HydrophobicContact CD1-CG2 4.3Å; L38-V57 HydrophobicContact CD2-CB 4.46Å; L38-V57 HydrophobicContact CD2-CG2 3.64Å; V55-V57 WeakPolarHBondContact CG1-O 3.28Å; V57-N521 WeakPolarHBondContact CG1-OD1 3.36Å; V57-I536 HydrophobicContact CG2-CD1 3.48Å; V57-I536 VanDerWaalsContact CG2-CD1 3.48Å
58	C	79	Confident	68	Low	3 Å²	3	50.2 Å²	50.2	2%	0.02	27%	0.272	C	S	.	.			trans	-98.7	126.1	173.8	175.3	0	0	0	0	109.4	Y60 C66 T73 C518 T520 N521	C58-Y60 PolarHBondContact O-N 3.32Å; C58-Y60 PolarHBondContact SG-N 3.21Å; C58-Y60 VanDerWaalsContact SG-N 3.43Å; C58-Y60 PolarHBondContact SG-O 3.41Å; C58-Y60 VanDerWaalsContact SG-O 3.41Å; C58-C66 VanDerWaalsContact SG-SG 3.67Å; C58-T73 WeakPolarHBondContact CA-OG1 3.27Å; C58-T73 PolarHBondContact SG-OG1 3.18Å; C58-T73 VanDerWaalsContact SG-OG1 3.38Å; C58-C518 HydrophobicContact CB-CB 4.12Å; C58-T520 HydrophobicContact CB-CG2 3.82Å; C58-N521 PolarHBondContact N-OD1 3.33Å; C58-N521 PolarHBondContact O-ND2 3.07Å; C58-N521 PolarHBondContact O-OD1 2.89Å
59	T	71.6	Confident	66.7	Low	107 Å²	107	46.8 Å²	46.8	66%	0.656	26%	0.256	S	S	*	.	S	Bend	trans	-67.8	-24.4	178.1	46.7	0	0	0	0	112.5	Q61 T73	T59-Q61 PolarHBondContact O-N 2.92Å; T59-T73 PolarHBondContact N-OG1 3.44Å; T59-T73 PolarHBondContact OG1-OG1 2.89Å
60	Y	62.8	Low	65.8	Low	58 Å²	58	47.2 Å²	47.2	23%	0.227	26%	0.258	C	S	.	.			trans	-80.8	116.6	177.2	-57.6	-83.7	0	0	0	110.5	C58 L72 E94	C58-Y60 PolarHBondContact O-N 3.32Å; C58-Y60 PolarHBondContact SG-N 3.21Å; C58-Y60 VanDerWaalsContact SG-N 3.43Å; C58-Y60 PolarHBondContact SG-O 3.41Å; C58-Y60 VanDerWaalsContact SG-O 3.41Å; Y60-L72 HydrophobicContact CD1-CD1 4.11Å; Y60-L72 HydrophobicContact CD2-CB 3.73Å; Y60-L72 HydrophobicContact CD2-CD1 3.85Å; Y60-L72 HydrophobicContact CD2-CG 4.16Å; Y60-L72 HydrophobicContact CE1-CD1 3.98Å; Y60-L72 HydrophobicContact CE2-CB 3.54Å; Y60-L72 HydrophobicContact CE2-CD1 3.71Å; Y60-L72 HydrophobicContact CE2-CG 4.18Å; Y60-L72 HydrophobicContact CG-CD1 4.04Å; Y60-E94 VanDerWaalsContact CE1-OE2 3.25Å; Y60-E94 WeakPolarHBondContact CE1-OE2 3.22Å; Y60-E94 PolarHBondContact OH-OE2 3.42Å
61	Q	55.5	Low	65.1	Low	96 Å²	96	44.9 Å²	44.9	45%	0.449	25%	0.246	S	C	.	.			trans	-94.1	-7.6	-177.1	-70.1	-174.1	4.5	0	0	114.3	T59 N416	T59-Q61 PolarHBondContact O-N 2.92Å; Q61-N416 PolarHBondContact NE2-ND2 2.79Å
62	L	53.7	Low	64.1	Low	95 Å²	95	46.3 Å²	46.3	50%	0.497	25%	0.253	S	S	.	.	S	Bend	trans	-106.4	142.2	-179.4	-74.6	153.6	0	0	0	110.6	H64 H516	L62-H64 VanDerWaalsContact C-N 3.35Å; L62-H64 PolarHBondContact O-N 3.07Å; L62-H516 CarbonylContact C-O 2.8Å; L62-H516 WeakPolarHBondContact CA-O 3.39Å
63	P	50.2	Low	63.8	Low	34 Å²	34	44.5 Å²	44.5	22%	0.221	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-81.9	-18.3	-164.8	36.2	-35.3	0	0	0	111.9	D65 C66 H516	P63-D65 PolarHBondContact O-N 2.92Å; P63-C66 PolarHBondContact O-N 2.8Å; P63-C66 VanDerWaalsContact O-O 3.08Å; P63-H516 WeakPolarHBondContact CA-O 3.37Å; P63-H516 WeakPolarHBondContact CB-O 3.34Å; P63-H516 WeakPolarHBondContact CD-O 3.3Å; P63-H516 HydrophobicContact CG-CB 4.15Å
64	H	51.4	Low	63.5	Low	102 Å²	102	46.1 Å²	46.1	47%	0.472	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-65.5	-21	-179.3	-51.3	-61	0	0	0	111.7	L62 Y95 E166	L62-H64 VanDerWaalsContact C-N 3.35Å; L62-H64 PolarHBondContact O-N 3.07Å; H64-Y95 WeakPolarHBondContact O-CD2 3.47Å; H64-Y95 WeakPolarHBondContact O-CE2 3.15Å; H64-E166 IonicContact CE1-OE1 3.36Å; H64-E166 PolarHBondContact CE1-OE1 3Å; H64-E166 IonicContact ND1-OE1 3.07Å; H64-E166 PolarHBondContact ND1-OE1 2.81Å
65	D	52.4	Low	63.2	Low	34 Å²	34	43.6 Å²	43.6	18%	0.182	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-94.4	-16.9	-176.3	-60.7	-30.5	0	0	0	113.2	P63 L72 Y95	P63-D65 PolarHBondContact O-N 2.92Å; D65-L72 HydrophobicContact CB-CD1 4.01Å; D65-L72 WeakPolarHBondContact O-CD2 3.19Å; D65-L72 VanDerWaalsContact O-CG 3.29Å; D65-L72 WeakPolarHBondContact O-CG 3.31Å; D65-Y95 WeakPolarHBondContact OD1-CB 3.14Å
66	C	59.7	Low	62.4	Low	4 Å²	4	48.9 Å²	48.9	3%	0.027	26%	0.259	C	S	.	.			trans	-144.6	120.5	-175.1	-67.9	0	0	0	0	111.4	C58 P63 F70 C71 L72 C518	C58-C66 VanDerWaalsContact SG-SG 3.67Å; P63-C66 PolarHBondContact O-N 2.8Å; P63-C66 VanDerWaalsContact O-O 3.08Å; C66-F70 CarbonylContact C-O 3.56Å; C66-F70 WeakPolarHBondContact CA-O 3.25Å; C66-C71 HydrophobicContact CB-CB 4.37Å; C66-L72 PolarHBondContact SG-N 3.41Å; C66-L72 VanDerWaalsContact SG-N 3.37Å; C66-C518 HydrophobicContact CB-CB 3.95Å; C66-C518 WeakPolarHBondContact CB-SG 3.25Å
67	T	59.1	Low	61.2	Low	49 Å²	49	50.9 Å²	50.9	30%	0.301	27%	0.269	S	S	.	.			trans	-87.9	167.4	166.1	69.1	0	0	0	0	110.1	A69 F70 V122	T67-A69 PolarHBondContact O-N 3.22Å; T67-A69 VanDerWaalsContact O-N 3.17Å; T67-A69 PolarHBondContact OG1-N 2.85Å; T67-F70 PolarHBondContact N-O 3.08Å; T67-F70 CarbonylContact O-C 3.57Å; T67-F70 PolarHBondContact O-N 3.37Å; T67-F70 VanDerWaalsContact O-O 3.05Å; T67-F70 WeakPolarHBondContact OG1-CB 3.42Å; T67-F70 PolarHBondContact OG1-N 3.42Å; T67-V122 PolarHBondContact OG1-O 2.88Å; T67-V122 VanDerWaalsContact OG1-O 3.07Å
68	S	56.2	Low	59.7	Low	48 Å²	48	50.5 Å²	50.5	34%	0.336	27%	0.267	S	S	.	.	S	Bend	trans	-58.6	-26.9	172.8	60.1	0	0	0	0	112.5
69	A	56.1	Low	57.6	Low	11 Å²	11	56.3 Å²	56.3	9%	0.091	30%	0.298	C	S	.	.	S	Bend	trans	-87.6	-25.2	178.3	0	0	0	0	0	114.6	T67 Q75 L123 D124	T67-A69 PolarHBondContact O-N 3.22Å; T67-A69 VanDerWaalsContact O-N 3.17Å; T67-A69 PolarHBondContact OG1-N 2.85Å; A69-Q75 PolarHBondContact O-NE2 3.35Å; A69-L123 WeakPolarHBondContact CB-O 3.1Å; A69-D124 VanDerWaalsContact CB-CA 3.45Å; A69-D124 HydrophobicContact CB-CB 4.4Å
70	F	66.6	Low	56	Low	13 Å²	13	58 Å²	58	6%	0.057	30%	0.296	C	S	.	.			trans	-139.9	103.7	-172.8	-177.8	-82.8	0	0	0	109.3	C66 T67 L72 Q75 I77 M98 V122 I125	C66-F70 CarbonylContact C-O 3.56Å; C66-F70 WeakPolarHBondContact CA-O 3.25Å; T67-F70 PolarHBondContact N-O 3.08Å; T67-F70 CarbonylContact O-C 3.57Å; T67-F70 PolarHBondContact O-N 3.37Å; T67-F70 VanDerWaalsContact O-O 3.05Å; T67-F70 WeakPolarHBondContact OG1-CB 3.42Å; T67-F70 PolarHBondContact OG1-N 3.42Å; F70-L72 HydrophobicContact CD1-CD2 4.04Å; F70-L72 HydrophobicContact CE1-CD2 3.32Å; F70-L72 HydrophobicContact CZ-CD2 4.14Å; F70-Q75 VanDerWaalsContact CG-OE1 3.31Å; F70-I77 HydrophobicContact CD2-CD1 4.07Å; F70-I77 HydrophobicContact CE2-CD1 3.59Å; F70-M98 HydrophobicContact CE1-SD 3.4Å; F70-M98 WeakPolarHBondContact CE1-SD 3.48Å; F70-M98 HydrophobicContact CZ-CG 4.44Å; F70-M98 HydrophobicContact CZ-SD 3.78Å; F70-V122 HydrophobicContact CB-CB 3.7Å; F70-V122 HydrophobicContact CB-CG1 4.16Å; F70-V122 HydrophobicContact CB-CG2 4.16Å; F70-V122 HydrophobicContact CD2-CB 3.94Å; F70-V122 HydrophobicContact CD2-CG1 4.3Å; F70-V122 HydrophobicContact CD2-CG2 3.46Å; F70-V122 VanDerWaalsContact CD2-CG2 3.46Å; F70-V122 HydrophobicContact CE2-CG2 4.01Å; F70-V122 HydrophobicContact CG-CB 3.98Å; F70-V122 HydrophobicContact CG-CG2 3.85Å; F70-I125 HydrophobicContact CD2-CD1 3.86Å
71	C	70.9	Confident	54.4	Low	4 Å²	4	62.5 Å²	62.5	3%	0.027	31%	0.313	C	S	.	.			trans	-116.7	127	177.3	168.2	0	0	0	0	108.9	C66 T73 R74 Q75 T520	C66-C71 HydrophobicContact CB-CB 4.37Å; C71-T73 PolarHBondContact O-N 3.14Å; C71-R74 HydrophobicContact CB-CB 4.07Å; C71-R74 HydrophobicContact CB-CG 4.24Å; C71-R74 PolarHBondContact O-N 2.63Å; C71-Q75 PolarHBondContact O-N 2.9Å; C71-T520 WeakPolarHBondContact CB-OG1 3.23Å; C71-T520 PolarHBondContact SG-OG1 3.3Å
72	L	67.4	Low	53.3	Low	30 Å²	30	66.9 Å²	66.9	16%	0.157	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.7	-175.3	-52.3	-172.7	0	0	0	113	Y60 D65 C66 F70 R74 M98	Y60-L72 HydrophobicContact CD1-CD1 4.11Å; Y60-L72 HydrophobicContact CD2-CB 3.73Å; Y60-L72 HydrophobicContact CD2-CD1 3.85Å; Y60-L72 HydrophobicContact CD2-CG 4.16Å; Y60-L72 HydrophobicContact CE1-CD1 3.98Å; Y60-L72 HydrophobicContact CE2-CB 3.54Å; Y60-L72 HydrophobicContact CE2-CD1 3.71Å; Y60-L72 HydrophobicContact CE2-CG 4.18Å; Y60-L72 HydrophobicContact CG-CD1 4.04Å; D65-L72 HydrophobicContact CB-CD1 4.01Å; D65-L72 WeakPolarHBondContact O-CD2 3.19Å; D65-L72 VanDerWaalsContact O-CG 3.29Å; D65-L72 WeakPolarHBondContact O-CG 3.31Å; C66-L72 PolarHBondContact SG-N 3.41Å; C66-L72 VanDerWaalsContact SG-N 3.37Å; F70-L72 HydrophobicContact CD1-CD2 4.04Å; F70-L72 HydrophobicContact CE1-CD2 3.32Å; F70-L72 HydrophobicContact CZ-CD2 4.14Å; L72-R74 VanDerWaalsContact C-N 3.35Å; L72-M98 HydrophobicContact CD1-CE 3.31Å; L72-M98 HydrophobicContact CD2-CE 3.01Å; L72-M98 HydrophobicContact CD2-SD 3.3Å; L72-M98 WeakPolarHBondContact CD2-SD 3.25Å; L72-M98 HydrophobicContact CG-CE 3.72Å
73	T	68.6	Low	52.1	Low	37 Å²	37	68.2 Å²	68.2	23%	0.227	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-26	178.8	-37.9	0	0	0	0	111.8	V55 C58 T59 C71	V55-T73 HydrophobicContact CG1-CG2 3.42Å; V55-T73 VanDerWaalsContact CG1-CG2 3.42Å; C58-T73 WeakPolarHBondContact CA-OG1 3.27Å; C58-T73 PolarHBondContact SG-OG1 3.18Å; C58-T73 VanDerWaalsContact SG-OG1 3.38Å; T59-T73 PolarHBondContact N-OG1 3.44Å; T59-T73 PolarHBondContact OG1-OG1 2.89Å; C71-T73 PolarHBondContact O-N 3.14Å
74	R	62.1	Low	51.1	Low	73 Å²	73	72 Å²	72	28%	0.275	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-34.7	-179.1	-74.9	-173.5	165.6	166.5	0.6	113.2	D53 V55 C71 L72 T520	D53-R74 IonicContact OD2-CZ 3.38Å; D53-R74 IonicContact OD2-NE 3.28Å; D53-R74 PolarHBondContact OD2-NE 2.64Å; D53-R74 IonicContact OD2-NH2 2.66Å; V55-R74 HydrophobicContact CB-CG 4.23Å; V55-R74 HydrophobicContact CG1-CG 4.16Å; V55-R74 PolarHBondContact O-NE 3.42Å; C71-R74 HydrophobicContact CB-CB 4.07Å; C71-R74 HydrophobicContact CB-CG 4.24Å; C71-R74 PolarHBondContact O-N 2.63Å; L72-R74 VanDerWaalsContact C-N 3.35Å; R74-T520 HydrophobicContact CG-CG2 4.18Å
75	Q	59.9	Low	50.1	Low	41 Å²	41	72 Å²	72	19%	0.192	39%	0.385	C	S	.	.			trans	-103.8	103.2	-170.9	-67.8	-175	-7.1	0	0	109.7	A69 F70 C71 I77	A69-Q75 PolarHBondContact O-NE2 3.35Å; F70-Q75 VanDerWaalsContact CG-OE1 3.31Å; C71-Q75 PolarHBondContact O-N 2.9Å; Q75-I77 HydrophobicContact CB-CD1 3.93Å; Q75-I77 HydrophobicContact CB-CG1 4.11Å; Q75-I77 HydrophobicContact CG-CD1 4.47Å; Q75-I77 PolarHBondContact O-N 2.84Å
76	N	52.8	Low	49.1	Very low	145 Å²	145	76.2 Å²	76.2	78%	0.775	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	29.4	171	-77.3	-22.6	0	0	0	112.9	V78	N76-V78 PolarHBondContact O-N 2.82Å
77	I	50.4	Low	47.9	Very low	46 Å²	46	85 Å²	85	24%	0.236	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.1	177.5	-64.9	167.6	0	0	0	109.3	F70 Q75 I125 L147	F70-I77 HydrophobicContact CD2-CD1 4.07Å; F70-I77 HydrophobicContact CE2-CD1 3.59Å; Q75-I77 HydrophobicContact CB-CD1 3.93Å; Q75-I77 HydrophobicContact CB-CG1 4.11Å; Q75-I77 HydrophobicContact CG-CD1 4.47Å; Q75-I77 PolarHBondContact O-N 2.84Å; I77-I125 HydrophobicContact CD1-CD1 3.89Å; I77-L147 HydrophobicContact CD1-CD1 3.77Å; I77-L147 HydrophobicContact CG1-CD1 4.46Å
78	V	47.7	Very low	46.4	Very low	30 Å²	30	88.8 Å²	88.8	18%	0.182	48%	0.478	C	S	.	.			trans	-115.1	101.7	178.6	-163.9	0	0	0	0	110.6	N76 F80 M98	N76-V78 PolarHBondContact O-N 2.82Å; V78-F80 HydrophobicContact CB-CD2 4.23Å; V78-F80 HydrophobicContact CB-CE2 3.9Å; V78-F80 HydrophobicContact CB-CZ 4.24Å; V78-F80 HydrophobicContact CG1-CD1 3.91Å; V78-F80 HydrophobicContact CG1-CD2 3.72Å; V78-F80 HydrophobicContact CG1-CE1 3.67Å; V78-F80 HydrophobicContact CG1-CE2 3.47Å; V78-F80 VanDerWaalsContact CG1-CE2 3.47Å; V78-F80 HydrophobicContact CG1-CG 3.95Å; V78-F80 HydrophobicContact CG1-CZ 3.46Å; V78-F80 VanDerWaalsContact CG1-CZ 3.46Å; V78-F80 PolarHBondContact O-N 2.88Å; V78-M98 HydrophobicContact CG2-CG 4.23Å
79	N	35.3	Very low	45.4	Very low	125 Å²	125	92 Å²	92	67%	0.668	49%	0.492	S	S	*	.			trans	-83.7	92.6	166.8	-155.1	-4.5	0	0	0	107.7	R81	N79-R81 PolarHBondContact O-N 3.49Å; N79-R81 WeakPolarHBondContact OD1-CG 3.33Å
80	F	36.7	Very low	44.5	Very low	142 Å²	142	102.4 Å²	102.4	62%	0.623	53%	0.528	S	S	*	.			trans	-69.7	36.6	174.2	-70.3	-75.3	0	0	0	113	V78	V78-F80 HydrophobicContact CB-CD2 4.23Å; V78-F80 HydrophobicContact CB-CE2 3.9Å; V78-F80 HydrophobicContact CB-CZ 4.24Å; V78-F80 HydrophobicContact CG1-CD1 3.91Å; V78-F80 HydrophobicContact CG1-CD2 3.72Å; V78-F80 HydrophobicContact CG1-CE1 3.67Å; V78-F80 HydrophobicContact CG1-CE2 3.47Å; V78-F80 VanDerWaalsContact CG1-CE2 3.47Å; V78-F80 HydrophobicContact CG1-CG 3.95Å; V78-F80 HydrophobicContact CG1-CZ 3.46Å; V78-F80 VanDerWaalsContact CG1-CZ 3.46Å; V78-F80 PolarHBondContact O-N 2.88Å
81	R	29.9	Very low	43.3	Very low	153 Å²	153	112.3 Å²	112.3	58%	0.577	57%	0.571	S	S	*	*			trans	-106.8	57.4	178.8	-69.8	-168.9	-179.9	-161.4	1.5	111.4	N79	N79-R81 PolarHBondContact O-N 3.49Å; N79-R81 WeakPolarHBondContact OD1-CG 3.33Å
82	K	31.8	Very low	41.8	Very low	188 Å²	188	118.7 Å²	118.7	82%	0.817	60%	0.595	S	S	*	*			trans	-145.1	112.3	153.3	-74.6	-166	179.6	177.1	0	109.3	C84	K82-C84 PolarHBondContact O-N 3.02Å
83	S	28.5	Very low	41.1	Very low	124 Å²	124	127.1 Å²	127.1	87%	0.867	63%	0.625	S	S	*	*			trans	-61.2	92.7	164.1	46.9	0	0	0	0	110
84	C	29.6	Very low	40.3	Very low	113 Å²	113	130.8 Å²	130.8	76%	0.764	64%	0.639	S	S	*	*			trans	-109.4	89.4	159.7	-63	0	0	0	0	105.3	K82	K82-C84 PolarHBondContact O-N 3.02Å
85	S	30.6	Very low	39.8	Very low	101 Å²	101	130.7 Å²	130.7	71%	0.706	64%	0.639	S	S	*	*				57.4	109.7	74.1	-160.5	0	0	0	0	112.4
86	V	31.4	Very low	39.8	Very low	123 Å²	123	131.2 Å²	131.2	75%	0.745	65%	0.645	S	S	*	*			trans	71.8	42.4	159	-134	0	0	0	0	121.3
87	F	33.6	Very low	40.4	Very low	190 Å²	190	129.7 Å²	129.7	83%	0.833	63%	0.632	S	S	*	*			trans	-141.5	120.6	149	-75.8	-74.3	0	0	0	111.8	L89	F87-L89 VanDerWaalsContact C-N 3.34Å; F87-L89 HydrophobicContact CB-CD1 4.43Å; F87-L89 PolarHBondContact O-N 3.2Å
88	S	29.5	Very low	41.1	Very low	127 Å²	127	128.1 Å²	128.1	89%	0.888	62%	0.623	S	S	*	*			trans	-65.5	88.7	171	171.7	0	0	0	0	109.7
89	L	33.5	Very low	42.2	Very low	117 Å²	117	127.2 Å²	127.2	61%	0.613	62%	0.619	S	S	*	*			trans	-100.4	103.8	174.4	-83.1	155.6	0	0	0	108.9	F87 K91	F87-L89 VanDerWaalsContact C-N 3.34Å; F87-L89 HydrophobicContact CB-CD1 4.43Å; F87-L89 PolarHBondContact O-N 3.2Å; L89-K91 PolarHBondContact O-N 2.9Å
90	R	38.4	Very low	44	Very low	229 Å²	229	125.3 Å²	125.3	86%	0.864	61%	0.606	S	S	*	*			trans	-30.6	134.5	164.3	-66.9	174.1	178.6	161.1	-0.7	110.9	R92	R90-R92 VanDerWaalsContact C-N 3.29Å; R90-R92 PolarHBondContact O-N 3.21Å
91	K	40.1	Very low	45.9	Very low	220 Å²	220	121.7 Å²	121.7	96%	0.957	59%	0.591	S	S	*	*			trans	-28.3	73.4	178.3	-67.2	178.5	177	176.4	0	115.5	L89	L89-K91 PolarHBondContact O-N 2.9Å
92	R	39.6	Very low	48	Very low	138 Å²	138	114.6 Å²	114.6	52%	0.521	57%	0.565	S	S	.	*			trans	-83.1	133.1	171.3	-77.2	-170.4	-179.1	177	3.9	108.4	R90 E100	R90-R92 VanDerWaalsContact C-N 3.29Å; R90-R92 PolarHBondContact O-N 3.21Å; R92-E100 IonicContact NH1-OE1 3.92Å; R92-E100 PolarHBondContact NH1-OE1 2.63Å
93	R	53	Low	50.4	Low	208 Å²	208	107 Å²	107	79%	0.785	53%	0.532	S	S	*	.			trans	-56.7	139.2	177.1	-68.7	-178.4	177.9	-178.5	-0.7	109.6	Y95 T96	R93-Y95 PolarHBondContact O-N 3.41Å; R93-Y95 VanDerWaalsContact O-N 3.09Å; R93-T96 PolarHBondContact O-N 2.99Å
94	E	53	Low	52.9	Low	114 Å²	114	110.3 Å²	110.3	53%	0.533	53%	0.527	S	S	.	.	H	α-helix	trans	-54.7	-30.8	-175.1	-65	-177.3	177.4	0	0	113.5	Y60 T96 K97 M98	Y60-E94 VanDerWaalsContact CE1-OE2 3.25Å; Y60-E94 WeakPolarHBondContact CE1-OE2 3.22Å; Y60-E94 PolarHBondContact OH-OE2 3.42Å; E94-T96 VanDerWaalsContact C-N 3.31Å; E94-T96 PolarHBondContact O-N 3.17Å; E94-K97 PolarHBondContact O-N 2.9Å; E94-M98 PolarHBondContact O-N 2.96Å
95	Y	51.6	Low	55.4	Low	71 Å²	71	108.4 Å²	108.4	28%	0.278	51%	0.509	S	S	.	.	H	α-helix	trans	-48.8	-47.1	171.4	178.4	-97.1	0	0	0	113.9	H64 D65 R93 K97 M98 A99 K120	H64-Y95 WeakPolarHBondContact O-CD2 3.47Å; H64-Y95 WeakPolarHBondContact O-CE2 3.15Å; D65-Y95 WeakPolarHBondContact OD1-CB 3.14Å; R93-Y95 PolarHBondContact O-N 3.41Å; R93-Y95 VanDerWaalsContact O-N 3.09Å; Y95-K97 VanDerWaalsContact C-N 3.27Å; Y95-K97 PolarHBondContact O-N 3.49Å; Y95-M98 PolarHBondContact O-N 2.91Å; Y95-A99 PolarHBondContact O-N 3.41Å; Y95-K120 PolarHBondContact OH-O 3.47Å
96	T	59.5	Low	57.9	Low	51 Å²	51	104.3 Å²	104.3	31%	0.313	48%	0.478	S	S	.	.	H	α-helix	trans	-63.9	-38.2	-175	-53.1	0	0	0	0	110.5	R93 E94 M98 A99 E100	R93-T96 PolarHBondContact O-N 2.99Å; E94-T96 VanDerWaalsContact C-N 3.31Å; E94-T96 PolarHBondContact O-N 3.17Å; T96-M98 VanDerWaalsContact C-N 3.28Å; T96-M98 PolarHBondContact O-N 2.79Å; T96-A99 PolarHBondContact O-N 2.79Å; T96-E100 HydrophobicContact CG2-CG 4.38Å; T96-E100 WeakPolarHBondContact CG2-OE1 3.4Å; T96-E100 VanDerWaalsContact O-CB 3.28Å; T96-E100 WeakPolarHBondContact O-CB 3.44Å; T96-E100 WeakPolarHBondContact O-CG 3.39Å; T96-E100 PolarHBondContact O-N 3.36Å
97	K	65.2	Low	60.5	Low	113 Å²	113	98.8 Å²	98.8	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-65.5	-32.1	-179.9	-64.3	-175.9	177.8	-179.3	0	112.7	E94 Y95 H101	E94-K97 PolarHBondContact O-N 2.9Å; Y95-K97 VanDerWaalsContact C-N 3.27Å; Y95-K97 PolarHBondContact O-N 3.49Å; K97-H101 WeakPolarHBondContact O-CB 3.38Å; K97-H101 PolarHBondContact O-N 2.73Å
98	M	64.9	Low	63.2	Low	13 Å²	13	92.1 Å²	92.1	6%	0.064	42%	0.421	C	S	.	.	H	α-helix	trans	-84	-38.1	-179	-179.6	-158.2	-41.5	0	0	112.5	F70 L72 V78 E94 Y95 T96 E100 H101 F102	F70-M98 HydrophobicContact CE1-SD 3.4Å; F70-M98 WeakPolarHBondContact CE1-SD 3.48Å; F70-M98 HydrophobicContact CZ-CG 4.44Å; F70-M98 HydrophobicContact CZ-SD 3.78Å; L72-M98 HydrophobicContact CD1-CE 3.31Å; L72-M98 HydrophobicContact CD2-CE 3.01Å; L72-M98 HydrophobicContact CD2-SD 3.3Å; L72-M98 WeakPolarHBondContact CD2-SD 3.25Å; L72-M98 HydrophobicContact CG-CE 3.72Å; V78-M98 HydrophobicContact CG2-CG 4.23Å; E94-M98 PolarHBondContact O-N 2.96Å; Y95-M98 PolarHBondContact O-N 2.91Å; T96-M98 VanDerWaalsContact C-N 3.28Å; T96-M98 PolarHBondContact O-N 2.79Å; M98-E100 VanDerWaalsContact C-N 3.29Å; M98-H101 PolarHBondContact O-N 2.84Å; M98-F102 WeakPolarHBondContact O-CB 3.26Å; M98-F102 PolarHBondContact O-N 2.82Å
99	A	71.1	Confident	65.8	Low	11 Å²	11	89.3 Å²	89.3	9%	0.091	41%	0.405	C	S	.	.	H	α-helix	trans	-57.7	-48.3	168.9	0	0	0	0	0	109.9	Y95 T96 H101 F102 E103 F119	Y95-A99 PolarHBondContact O-N 3.41Å; T96-A99 PolarHBondContact O-N 2.79Å; A99-H101 PolarHBondContact O-N 3.09Å; A99-F102 PolarHBondContact O-N 2.94Å; A99-E103 WeakPolarHBondContact O-CB 3.41Å; A99-E103 PolarHBondContact O-N 2.84Å; A99-F119 HydrophobicContact CB-CD1 3.78Å; A99-F119 HydrophobicContact CB-CE1 4.44Å
100	E	73.3	Confident	68.3	Low	86 Å²	86	88.5 Å²	88.5	40%	0.402	40%	0.398	S	S	.	.	H	α-helix	trans	-58.4	-45	173.5	-73.1	169.2	176.1	0	0	111.7	R92 T96 M98 E103 Y104	R92-E100 IonicContact NH1-OE1 3.92Å; R92-E100 PolarHBondContact NH1-OE1 2.63Å; T96-E100 HydrophobicContact CG2-CG 4.38Å; T96-E100 WeakPolarHBondContact CG2-OE1 3.4Å; T96-E100 VanDerWaalsContact O-CB 3.28Å; T96-E100 WeakPolarHBondContact O-CB 3.44Å; T96-E100 WeakPolarHBondContact O-CG 3.39Å; T96-E100 PolarHBondContact O-N 3.36Å; M98-E100 VanDerWaalsContact C-N 3.29Å; E100-E103 PolarHBondContact O-N 3.34Å; E100-Y104 VanDerWaalsContact O-CB 3.29Å; E100-Y104 WeakPolarHBondContact O-CB 3.12Å; E100-Y104 PolarHBondContact O-N 3.48Å
101	H	75.1	Confident	70.5	Confident	66 Å²	66	78.3 Å²	78.3	31%	0.306	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-43.6	178.4	-178.4	83.2	0	0	0	112.5	K97 M98 A99 Y104 N105	K97-H101 WeakPolarHBondContact O-CB 3.38Å; K97-H101 PolarHBondContact O-N 2.73Å; M98-H101 PolarHBondContact O-N 2.84Å; A99-H101 PolarHBondContact O-N 3.09Å; H101-Y104 PolarHBondContact O-N 2.98Å; H101-N105 PolarHBondContact CE1-ND2 2.99Å; H101-N105 PolarHBondContact ND1-ND2 3.36Å; H101-N105 PolarHBondContact NE2-ND2 3.32Å; H101-N105 WeakPolarHBondContact O-CB 3.37Å; H101-N105 PolarHBondContact O-N 2.95Å; H101-N105 PolarHBondContact O-ND2 2.77Å
102	F	75.9	Confident	72.7	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-42.5	179.1	-159.7	-77.2	0	0	0	110.5	M98 A99 N105 H106 I107 F119 V122 V132 V145 L147	M98-F102 WeakPolarHBondContact O-CB 3.26Å; M98-F102 PolarHBondContact O-N 2.82Å; A99-F102 PolarHBondContact O-N 2.94Å; F102-N105 PolarHBondContact O-N 3.4Å; F102-H106 HydrophobicContact CD1-CB 3.94Å; F102-H106 AromaticContact CD2-CD2 3.55Å; F102-H106 HydrophobicContact CE1-CB 3.69Å; F102-H106 AromaticContact CE2-CD2 3.58Å; F102-H106 AromaticContact CG-CD2 3.77Å; F102-H106 HydrophobicContact CZ-CB 4.11Å; F102-H106 AromaticContact CZ-CD2 3.82Å; F102-H106 WeakPolarHBondContact O-CB 3.32Å; F102-H106 PolarHBondContact O-N 2.95Å; F102-I107 HydrophobicContact CD1-CD1 4.35Å; F102-I107 HydrophobicContact CD1-CG1 4.35Å; F102-I107 HydrophobicContact CE1-CD1 4.19Å; F102-F119 HydrophobicContact CB-CD1 4.38Å; F102-F119 HydrophobicContact CB-CD2 4.19Å; F102-F119 HydrophobicContact CB-CE1 4.43Å; F102-F119 HydrophobicContact CB-CE2 4.24Å; F102-F119 HydrophobicContact CB-CG 4.23Å; F102-F119 HydrophobicContact CB-CZ 4.34Å; F102-F119 AromaticContact CD1-CD2 3.36Å; F102-F119 HydrophobicContact CD1-CD2 3.36Å; F102-F119 AromaticContact CD1-CE2 3.41Å; F102-F119 HydrophobicContact CD1-CE2 3.41Å; F102-F119 VanDerWaalsContact CD1-CE2 3.41Å; F102-F119 HydrophobicContact CD1-CG 4.17Å; F102-F119 HydrophobicContact CD1-CZ 4.26Å; F102-F119 HydrophobicContact CD2-CE2 4.22Å; F102-F119 HydrophobicContact CD2-CZ 4.39Å; F102-F119 AromaticContact CE1-CD2 3.95Å; F102-F119 HydrophobicContact CE1-CD2 3.95Å; F102-F119 AromaticContact CE1-CE2 3.76Å; F102-F119 HydrophobicContact CE1-CE2 3.76Å; F102-F119 AromaticContact CG-CD2 3.88Å; F102-F119 HydrophobicContact CG-CD2 3.88Å; F102-F119 AromaticContact CG-CE2 3.67Å; F102-F119 HydrophobicContact CG-CE2 3.67Å; F102-F119 HydrophobicContact CG-CG 4.43Å; F102-F119 HydrophobicContact CG-CZ 4.06Å; F102-F119 HydrophobicContact CZ-CE2 4.3Å; F102-V122 HydrophobicContact CE2-CG2 4.47Å; F102-V132 HydrophobicContact CE1-CG1 3.75Å; F102-V132 HydrophobicContact CZ-CG1 3.74Å; F102-V145 HydrophobicContact CE1-CG2 4.41Å; F102-L147 HydrophobicContact CE2-CD2 4.14Å; F102-L147 HydrophobicContact CZ-CD2 4.11Å
103	E	81.1	Confident	74.8	Confident	28 Å²	28	65.6 Å²	65.6	13%	0.131	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-46.3	176	-168.7	166	155	0	0	111.3	A99 E100 I107 H118 F119	A99-E103 WeakPolarHBondContact O-CB 3.41Å; A99-E103 PolarHBondContact O-N 2.84Å; E100-E103 PolarHBondContact O-N 3.34Å; E103-I107 WeakPolarHBondContact O-CB 3.12Å; E103-I107 PolarHBondContact O-N 2.9Å; E103-H118 IonicContact OE1-CE1 2.87Å; E103-H118 IonicContact OE1-CG 2.79Å; E103-H118 IonicContact OE1-ND1 3.13Å; E103-H118 PolarHBondContact OE1-ND1 3.1Å; E103-H118 WeakPolarHBondContact OE2-CA 3.35Å; E103-H118 IonicContact OE2-CG 3.43Å; E103-H118 IonicContact OE2-ND1 3.59Å; E103-H118 PolarHBondContact OE2-ND1 2.83Å; E103-F119 HydrophobicContact CB-CB 4.22Å; E103-F119 PolarHBondContact OE2-N 3.07Å; E103-F119 VanDerWaalsContact OE2-N 3.11Å
104	Y	81.3	Confident	76.2	Confident	194 Å²	194	61.2 Å²	61.2	76%	0.761	31%	0.311	S	S	*	.	H	α-helix	trans	-67.7	-38.9	179.4	-174.2	-97.1	0	0	0	113.7	E100 H101	E100-Y104 VanDerWaalsContact O-CB 3.29Å; E100-Y104 WeakPolarHBondContact O-CB 3.12Å; E100-Y104 PolarHBondContact O-N 3.48Å; H101-Y104 PolarHBondContact O-N 2.98Å
105	N	81.6	Confident	77.6	Confident	73 Å²	73	58.9 Å²	58.9	39%	0.39	30%	0.301	S	S	.	.	H	α-helix	trans	-95.5	-24.3	-171.5	-68.4	-67	0	0	0	114.9	H101 F102	H101-N105 PolarHBondContact CE1-ND2 2.99Å; H101-N105 PolarHBondContact ND1-ND2 3.36Å; H101-N105 PolarHBondContact NE2-ND2 3.32Å; H101-N105 WeakPolarHBondContact O-CB 3.37Å; H101-N105 PolarHBondContact O-N 2.95Å; H101-N105 PolarHBondContact O-ND2 2.77Å; F102-N105 PolarHBondContact O-N 3.4Å
106	H	84.3	Confident	79.2	Confident	14 Å²	14	58.2 Å²	58.2	7%	0.065	30%	0.302	C	S	.	.	H	α-helix	trans	-124.4	-18.6	-170.4	-58.5	-54.3	0	0	0	114	F102 V145 N150	F102-H106 HydrophobicContact CD1-CB 3.94Å; F102-H106 AromaticContact CD2-CD2 3.55Å; F102-H106 HydrophobicContact CE1-CB 3.69Å; F102-H106 AromaticContact CE2-CD2 3.58Å; F102-H106 AromaticContact CG-CD2 3.77Å; F102-H106 HydrophobicContact CZ-CB 4.11Å; F102-H106 AromaticContact CZ-CD2 3.82Å; F102-H106 WeakPolarHBondContact O-CB 3.32Å; F102-H106 PolarHBondContact O-N 2.95Å; H106-V145 HydrophobicContact CB-CG1 4.05Å; H106-N150 PolarHBondContact CE1-OD1 2.82Å; H106-N150 VanDerWaalsContact CE1-OD1 3.23Å
107	I	85.8	Confident	80.5	Confident	7 Å²	7	56 Å²	56	4%	0.036	29%	0.288	C	S	.	.	S	Bend	trans	-101.1	125.6	179.7	-52.5	-55.2	0	0	0	108.5	F102 E103 A109 L111 V132 L134 V145 F152	F102-I107 HydrophobicContact CD1-CD1 4.35Å; F102-I107 HydrophobicContact CD1-CG1 4.35Å; F102-I107 HydrophobicContact CE1-CD1 4.19Å; E103-I107 WeakPolarHBondContact O-CB 3.12Å; E103-I107 PolarHBondContact O-N 2.9Å; I107-A109 PolarHBondContact O-N 3.33Å; I107-L111 HydrophobicContact CG2-CB 3.84Å; I107-L111 HydrophobicContact CG2-CD1 4.44Å; I107-V132 HydrophobicContact CD1-CG2 4.23Å; I107-L134 HydrophobicContact CD1-CD1 4.44Å; I107-L134 HydrophobicContact CD1-CD2 3.9Å; I107-L134 HydrophobicContact CG1-CD2 4.2Å; I107-V145 HydrophobicContact CD1-CG2 4.46Å; I107-F152 HydrophobicContact CD1-CD2 4.32Å; I107-F152 HydrophobicContact CD1-CE2 4.44Å
108	P	88.7	Confident	81.5	Confident	51 Å²	51	54.3 Å²	54.3	33%	0.331	28%	0.282	S	S	.	.			trans	-55.7	137.8	177.3	-26.6	33.8	0	0	0	111.6	H110 L111 S112 F152	P108-H110 PolarHBondContact O-N 2.98Å; P108-L111 WeakPolarHBondContact O-CA 3.39Å; P108-L111 WeakPolarHBondContact O-CB 3.02Å; P108-L111 PolarHBondContact O-N 3.12Å; P108-S112 PolarHBondContact O-N 2.89Å; P108-S112 VanDerWaalsContact O-N 3.16Å; P108-F152 VanDerWaalsContact CD-CG 3.41Å; P108-F152 HydrophobicContact CG-CB 3.68Å; P108-F152 HydrophobicContact CG-CD1 3.76Å; P108-F152 HydrophobicContact CG-CD2 4.04Å; P108-F152 HydrophobicContact CG-CE1 4.4Å; P108-F152 HydrophobicContact CG-CG 3.56Å
109	A	85.5	Confident	82.5	Confident	67 Å²	67	54.3 Å²	54.3	55%	0.554	28%	0.281	S	S	*	.	H	α-helix	trans	-53.6	-31.5	-179.4	0	0	0	0	0	113.3	I107 L111 S112 S113 I114	I107-A109 PolarHBondContact O-N 3.33Å; A109-L111 VanDerWaalsContact C-N 3.31Å; A109-L111 PolarHBondContact O-N 3.29Å; A109-S112 WeakPolarHBondContact CA-OG 3.44Å; A109-S112 PolarHBondContact O-OG 2.94Å; A109-S113 WeakPolarHBondContact O-CA 3.44Å; A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 2.87Å; A109-S113 PolarHBondContact O-OG 3.34Å; A109-S113 VanDerWaalsContact O-OG 3.08Å; A109-I114 PolarHBondContact O-N 2.81Å
110	H	85.5	Confident	83.1	Confident	100 Å²	100	56.9 Å²	56.9	46%	0.463	29%	0.29	S	S	.	.	I	π-helix	trans	-63.7	-35.5	174.6	178	-88	0	0	0	112.7	P108 I114 Q115	P108-H110 PolarHBondContact O-N 2.98Å; H110-I114 HydrophobicContact CB-CD1 4.24Å; H110-I114 VanDerWaalsContact CD2-CD1 3.49Å; H110-I114 WeakPolarHBondContact CD2-CD1 3.3Å; H110-I114 VanDerWaalsContact O-CB 3.31Å; H110-I114 WeakPolarHBondContact O-CB 3.17Å; H110-I114 PolarHBondContact O-N 2.83Å; H110-Q115 PolarHBondContact CE1-NE2 3.13Å; H110-Q115 VanDerWaalsContact CE1-NE2 3.34Å; H110-Q115 PolarHBondContact O-N 2.91Å
111	L	85.3	Confident	83.5	Confident	15 Å²	15	53.3 Å²	53.3	8%	0.079	28%	0.275	C	S	.	.	I	π-helix	trans	-75.8	-47.5	175.4	-61.9	-176.1	0	0	0	111.2	I107 P108 A109 Q115 N116 L117 L134 F152	I107-L111 HydrophobicContact CG2-CB 3.84Å; I107-L111 HydrophobicContact CG2-CD1 4.44Å; P108-L111 WeakPolarHBondContact O-CA 3.39Å; P108-L111 WeakPolarHBondContact O-CB 3.02Å; P108-L111 PolarHBondContact O-N 3.12Å; A109-L111 VanDerWaalsContact C-N 3.31Å; A109-L111 PolarHBondContact O-N 3.29Å; L111-Q115 CarbonylContact O-C 3.59Å; L111-Q115 WeakPolarHBondContact O-CB 3.42Å; L111-N116 PolarHBondContact O-N 2.79Å; L111-L117 HydrophobicContact CB-CD1 4.48Å; L111-L117 HydrophobicContact CD2-CD1 4.27Å; L111-L117 WeakPolarHBondContact O-CB 3.28Å; L111-L117 PolarHBondContact O-N 3.28Å; L111-L134 HydrophobicContact CD1-CD1 4.48Å; L111-F152 HydrophobicContact CD1-CD2 4.48Å; L111-F152 HydrophobicContact CD1-CE1 3.87Å; L111-F152 HydrophobicContact CD1-CE2 3.57Å; L111-F152 HydrophobicContact CD1-CZ 3.23Å
112	S	85	Confident	84	Confident	15 Å²	15	50.3 Å²	50.3	11%	0.105	26%	0.261	C	S	.	.	I	π-helix	trans	-74.7	-35	-175.5	60.2	0	0	0	0	114.2	P108 A109 N116	P108-S112 PolarHBondContact O-N 2.89Å; P108-S112 VanDerWaalsContact O-N 3.16Å; A109-S112 WeakPolarHBondContact CA-OG 3.44Å; A109-S112 PolarHBondContact O-OG 2.94Å; S112-N116 VanDerWaalsContact O-CA 3.29Å; S112-N116 WeakPolarHBondContact O-CA 3.2Å
113	S	83.8	Confident	84.6	Confident	77 Å²	77	50.5 Å²	50.5	54%	0.538	26%	0.263	S	S	.	.	I	π-helix	trans	-111.7	-27.7	-167.6	-38.2	0	0	0	0	113.6	A109 N116	A109-S113 WeakPolarHBondContact O-CA 3.44Å; A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 2.87Å; A109-S113 PolarHBondContact O-OG 3.34Å; A109-S113 VanDerWaalsContact O-OG 3.08Å; S113-N116 PolarHBondContact O-OD1 2.66Å
114	I	82.1	Confident	85	Confident	115 Å²	115	49.8 Å²	49.8	59%	0.59	26%	0.26	S	S	*	.	I	π-helix	trans	-98.5	-53.1	178.2	-61.3	171.4	0	0	0	108.9	A109 H110 N116 R136	A109-I114 PolarHBondContact O-N 2.81Å; H110-I114 HydrophobicContact CB-CD1 4.24Å; H110-I114 VanDerWaalsContact CD2-CD1 3.49Å; H110-I114 WeakPolarHBondContact CD2-CD1 3.3Å; H110-I114 VanDerWaalsContact O-CB 3.31Å; H110-I114 WeakPolarHBondContact O-CB 3.17Å; H110-I114 PolarHBondContact O-N 2.83Å; I114-N116 PolarHBondContact O-N 3.43Å; I114-R136 PolarHBondContact O-NH1 3.3Å
115	Q	83.2	Confident	85.3	Confident	66 Å²	66	42.4 Å²	42.4	31%	0.308	23%	0.233	S	C	.	.	S	Bend	trans	-80.7	0.3	175.5	-60.5	-173.3	-7.1	0	0	113.3	H110 L111 L117 R136	H110-Q115 PolarHBondContact CE1-NE2 3.13Å; H110-Q115 VanDerWaalsContact CE1-NE2 3.34Å; H110-Q115 PolarHBondContact O-N 2.91Å; L111-Q115 CarbonylContact O-C 3.59Å; L111-Q115 WeakPolarHBondContact O-CB 3.42Å; Q115-L117 HydrophobicContact CB-CD1 4.07Å; Q115-L117 HydrophobicContact CB-CG 4.18Å; Q115-L117 PolarHBondContact O-N 2.93Å; Q115-R136 WeakPolarHBondContact O-CD 3.31Å; Q115-R136 PolarHBondContact O-NH1 2.87Å
116	N	86	Confident	85.6	Confident	56 Å²	56	41.6 Å²	41.6	30%	0.299	23%	0.227	S	C	.	.			trans	40.1	32.3	-174.7	-44.3	-30.7	0	0	0	115.3	L111 S112 S113 I114 H118 R136	L111-N116 PolarHBondContact O-N 2.79Å; S112-N116 VanDerWaalsContact O-CA 3.29Å; S112-N116 WeakPolarHBondContact O-CA 3.2Å; S113-N116 PolarHBondContact O-OD1 2.66Å; I114-N116 PolarHBondContact O-N 3.43Å; N116-H118 PolarHBondContact O-CD2 3.33Å; N116-H118 VanDerWaalsContact O-CD2 3.28Å; N116-H118 PolarHBondContact O-N 2.88Å; N116-H118 PolarHBondContact O-NE2 2.9Å; N116-R136 HydrophobicContact CB-CG 4.15Å; N116-R136 VanDerWaalsContact CB-CZ 3.43Å; N116-R136 VanDerWaalsContact CB-NH1 3.33Å; N116-R136 VanDerWaalsContact CG-NH1 3.32Å; N116-R136 PolarHBondContact ND2-NH1 3.37Å; N116-R136 PolarHBondContact ND2-NH2 2.54Å; N116-R136 WeakPolarHBondContact O-CB 3.4Å; N116-R136 VanDerWaalsContact O-CD 3.31Å; N116-R136 WeakPolarHBondContact O-CD 3.47Å; N116-R136 WeakPolarHBondContact O-CG 3.49Å
117	L	86.1	Confident	85.7	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.026	25%	0.253	C	S	.	.			trans	-77.1	109	177.1	-75.4	167	0	0	0	109.4	L111 Q115 L134 R136 Q141	L111-L117 HydrophobicContact CB-CD1 4.48Å; L111-L117 HydrophobicContact CD2-CD1 4.27Å; L111-L117 WeakPolarHBondContact O-CB 3.28Å; L111-L117 PolarHBondContact O-N 3.28Å; Q115-L117 HydrophobicContact CB-CD1 4.07Å; Q115-L117 HydrophobicContact CB-CG 4.18Å; Q115-L117 PolarHBondContact O-N 2.93Å; L117-L134 HydrophobicContact CB-CB 4.33Å; L117-R136 HydrophobicContact CD2-CB 3.95Å; L117-Q141 HydrophobicContact CD1-CG 4.11Å; L117-Q141 HydrophobicContact CD2-CG 4.22Å
118	H	86.4	Confident	85.7	Confident	78 Å²	78	45.7 Å²	45.7	36%	0.361	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	143.7	-179	-64.8	-60.2	0	0	0	111.6	E103 N116 K120 L134 A135	E103-H118 IonicContact OE1-CE1 2.87Å; E103-H118 IonicContact OE1-CG 2.79Å; E103-H118 IonicContact OE1-ND1 3.13Å; E103-H118 PolarHBondContact OE1-ND1 3.1Å; E103-H118 WeakPolarHBondContact OE2-CA 3.35Å; E103-H118 IonicContact OE2-CG 3.43Å; E103-H118 IonicContact OE2-ND1 3.59Å; E103-H118 PolarHBondContact OE2-ND1 2.83Å; N116-H118 PolarHBondContact O-CD2 3.33Å; N116-H118 VanDerWaalsContact O-CD2 3.28Å; N116-H118 PolarHBondContact O-N 2.88Å; N116-H118 PolarHBondContact O-NE2 2.9Å; H118-K120 PolarHBondContact O-N 2.84Å; H118-L134 WeakPolarHBondContact O-CA 3.4Å; H118-A135 PolarHBondContact N-O 3.18Å; H118-A135 VanDerWaalsContact N-O 3.14Å; H118-A135 PolarHBondContact O-N 3.36Å
119	F	85.7	Confident	85.8	Confident	13 Å²	13	44.6 Å²	44.6	6%	0.057	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129.3	171	175.2	-89.7	0	0	0	110.4	A99 F102 E103 V122 V132 L134	A99-F119 HydrophobicContact CB-CD1 3.78Å; A99-F119 HydrophobicContact CB-CE1 4.44Å; F102-F119 HydrophobicContact CB-CD1 4.38Å; F102-F119 HydrophobicContact CB-CD2 4.19Å; F102-F119 HydrophobicContact CB-CE1 4.43Å; F102-F119 HydrophobicContact CB-CE2 4.24Å; F102-F119 HydrophobicContact CB-CG 4.23Å; F102-F119 HydrophobicContact CB-CZ 4.34Å; F102-F119 AromaticContact CD1-CD2 3.36Å; F102-F119 HydrophobicContact CD1-CD2 3.36Å; F102-F119 AromaticContact CD1-CE2 3.41Å; F102-F119 HydrophobicContact CD1-CE2 3.41Å; F102-F119 VanDerWaalsContact CD1-CE2 3.41Å; F102-F119 HydrophobicContact CD1-CG 4.17Å; F102-F119 HydrophobicContact CD1-CZ 4.26Å; F102-F119 HydrophobicContact CD2-CE2 4.22Å; F102-F119 HydrophobicContact CD2-CZ 4.39Å; F102-F119 AromaticContact CE1-CD2 3.95Å; F102-F119 HydrophobicContact CE1-CD2 3.95Å; F102-F119 AromaticContact CE1-CE2 3.76Å; F102-F119 HydrophobicContact CE1-CE2 3.76Å; F102-F119 AromaticContact CG-CD2 3.88Å; F102-F119 HydrophobicContact CG-CD2 3.88Å; F102-F119 AromaticContact CG-CE2 3.67Å; F102-F119 HydrophobicContact CG-CE2 3.67Å; F102-F119 HydrophobicContact CG-CG 4.43Å; F102-F119 HydrophobicContact CG-CZ 4.06Å; F102-F119 HydrophobicContact CZ-CE2 4.3Å; E103-F119 HydrophobicContact CB-CB 4.22Å; E103-F119 PolarHBondContact OE2-N 3.07Å; E103-F119 VanDerWaalsContact OE2-N 3.11Å; F119-V122 HydrophobicContact CE2-CG2 3.96Å; F119-V122 HydrophobicContact CZ-CG2 3.65Å; F119-V132 HydrophobicContact CD2-CB 4.33Å; F119-V132 HydrophobicContact CE2-CB 4Å; F119-V132 HydrophobicContact CE2-CG1 3.97Å; F119-L134 HydrophobicContact CB-CD2 4.42Å
120	K	83.8	Confident	86	Confident	64 Å²	64	41.4 Å²	41.4	28%	0.278	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-46.2	179.7	-63.7	-54.6	-178.1	-169.1	0	113.4	Y95 H118 H133 A135 P165	Y95-K120 PolarHBondContact OH-O 3.47Å; H118-K120 PolarHBondContact O-N 2.84Å; K120-H133 HydrophobicContact CB-CB 4.36Å; K120-H133 WeakPolarHBondContact CB-O 3.27Å; K120-H133 PolarHBondContact N-O 2.85Å; K120-A135 HydrophobicContact CD-CB 4.4Å; K120-A135 WeakPolarHBondContact CE-O 2.99Å; K120-A135 HydrophobicContact CG-CB 3.72Å; K120-P165 HydrophobicContact CB-CG 4.34Å
121	S	81.7	Confident	86.3	Confident	11 Å²	11	36.7 Å²	36.7	8%	0.077	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	159.9	178.8	56	0	0	0	0	111.6	V132 H133	S121-V132 CarbonylContact O-C 3.53Å; S121-V132 WeakPolarHBondContact O-CA 3.27Å; S121-H133 PolarHBondContact N-O 3.28Å; S121-H133 PolarHBondContact O-N 2.81Å
122	V	85.2	Confident	86.6	Confident	4 Å²	4	36 Å²	36	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.1	163.2	-175.2	0	0	0	0	108.7	T67 F70 F102 F119 I125 V132	T67-V122 PolarHBondContact OG1-O 2.88Å; T67-V122 VanDerWaalsContact OG1-O 3.07Å; F70-V122 HydrophobicContact CB-CB 3.7Å; F70-V122 HydrophobicContact CB-CG1 4.16Å; F70-V122 HydrophobicContact CB-CG2 4.16Å; F70-V122 HydrophobicContact CD2-CB 3.94Å; F70-V122 HydrophobicContact CD2-CG1 4.3Å; F70-V122 HydrophobicContact CD2-CG2 3.46Å; F70-V122 VanDerWaalsContact CD2-CG2 3.46Å; F70-V122 HydrophobicContact CE2-CG2 4.01Å; F70-V122 HydrophobicContact CG-CB 3.98Å; F70-V122 HydrophobicContact CG-CG2 3.85Å; F102-V122 HydrophobicContact CE2-CG2 4.47Å; F119-V122 HydrophobicContact CE2-CG2 3.96Å; F119-V122 HydrophobicContact CZ-CG2 3.65Å; V122-I125 HydrophobicContact CG1-CD1 3.74Å; V122-I125 HydrophobicContact CG1-CG1 3.62Å; V122-V132 HydrophobicContact CG2-CG1 4.2Å
123	L	87.9	Confident	86.7	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-47	-179.2	-62.1	-171.9	0	0	0	111.9	A69 V131 H133 F142 T168 G170 I181	A69-L123 WeakPolarHBondContact CB-O 3.1Å; L123-V131 HydrophobicContact CB-CG1 4.29Å; L123-V131 HydrophobicContact CD1-CG1 4.14Å; L123-V131 PolarHBondContact N-O 2.87Å; L123-H133 HydrophobicContact CD2-CB 4.14Å; L123-H133 HydrophobicContact CG-CB 4.25Å; L123-F142 HydrophobicContact CD1-CD1 3.57Å; L123-F142 HydrophobicContact CD1-CE1 3.62Å; L123-T168 HydrophobicContact CD1-CG2 4.17Å; L123-T168 HydrophobicContact CD2-CG2 3.93Å; L123-G170 VanDerWaalsContact O-O 3.12Å; L123-I181 HydrophobicContact CD1-CD1 4.07Å; L123-I181 HydrophobicContact CD1-CG1 4.4Å; L123-I181 HydrophobicContact CD1-CG2 4.19Å
124	D	89.6	Confident	87	Confident	13 Å²	13	31.6 Å²	31.6	7%	0.07	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	151.5	173.6	-149.1	36.3	0	0	0	112.1	A69 A130 V131 K171 I172	A69-D124 VanDerWaalsContact CB-CA 3.45Å; A69-D124 HydrophobicContact CB-CB 4.4Å; D124-A130 WeakPolarHBondContact O-CA 3.34Å; D124-V131 PolarHBondContact N-O 3.16Å; D124-V131 PolarHBondContact O-N 2.88Å; D124-K171 IonicContact OD1-NZ 2.81Å; D124-K171 PolarHBondContact OD1-NZ 3.22Å; D124-K171 WeakPolarHBondContact OD2-CA 3.39Å; D124-I172 HydrophobicContact CB-CD1 4.05Å; D124-I172 HydrophobicContact CB-CG1 3.99Å; D124-I172 PolarHBondContact OD2-N 3.27Å
125	I	87.6	Confident	87.2	Confident	38 Å²	38	26.1 Å²	26.1	20%	0.195	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.4	170.4	-68.2	163.1	0	0	0	108.5	F70 I77 V122 L129 A130 L147	F70-I125 HydrophobicContact CD2-CD1 3.86Å; I77-I125 HydrophobicContact CD1-CD1 3.89Å; V122-I125 HydrophobicContact CG1-CD1 3.74Å; V122-I125 HydrophobicContact CG1-CG1 3.62Å; I125-L129 CarbonylContact C-O 3.53Å; I125-L129 VanDerWaalsContact CA-O 3.29Å; I125-L129 WeakPolarHBondContact CA-O 3.48Å; I125-A130 HydrophobicContact CG1-CB 3.8Å; I125-L147 HydrophobicContact CD1-CD1 4.08Å; I125-L147 HydrophobicContact CG1-CD1 4.32Å; I125-L147 HydrophobicContact CG2-CD1 4.37Å
126	H	88.3	Confident	87.3	Confident	56 Å²	56	26.3 Å²	26.3	26%	0.259	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	123.5	176.2	-176	58.1	0	0	0	110.6	G128 L129 I172 S173 P174	H126-G128 PolarHBondContact O-N 3.03Å; H126-G128 VanDerWaalsContact O-N 3.1Å; H126-L129 PolarHBondContact N-O 3Å; H126-L129 VanDerWaalsContact O-CB 3.3Å; H126-L129 WeakPolarHBondContact O-CB 3.06Å; H126-L129 PolarHBondContact O-N 2.9Å; H126-I172 HydrophobicContact CB-CB 3.9Å; H126-I172 HydrophobicContact CB-CD1 4.14Å; H126-I172 HydrophobicContact CB-CG2 3.83Å; H126-S173 PolarHBondContact CD2-O 2.86Å; H126-P174 VanDerWaalsContact NE2-C 3.33Å; H126-P174 PolarHBondContact NE2-O 2.91Å
127	S	85.5	Confident	86.8	Confident	89 Å²	89	29.1 Å²	29.1	62%	0.622	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	32	177.4	-54.9	0	0	0	0	115.2	L129	S127-L129 VanDerWaalsContact C-N 3.31Å
128	G	86.6	Confident	86.5	Confident	18 Å²	18	33.9 Å²	33.9	19%	0.186	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	-8.1	-177.3	0	0	0	0	0	114.8	H126 L147	H126-G128 PolarHBondContact O-N 3.03Å; H126-G128 VanDerWaalsContact O-N 3.1Å; G128-L147 VanDerWaalsContact O-CB 3.27Å; G128-L147 WeakPolarHBondContact O-CB 3.46Å; G128-L147 PolarHBondContact O-N 2.99Å
129	L	90.2	Very high	86.5	Confident	29 Å²	29	32.1 Å²	32.1	15%	0.152	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	128.8	171	-167.5	66.7	0	0	0	109.5	I125 H126 S127 L144 L153 I172 L199	I125-L129 CarbonylContact C-O 3.53Å; I125-L129 VanDerWaalsContact CA-O 3.29Å; I125-L129 WeakPolarHBondContact CA-O 3.48Å; H126-L129 PolarHBondContact N-O 3Å; H126-L129 VanDerWaalsContact O-CB 3.3Å; H126-L129 WeakPolarHBondContact O-CB 3.06Å; H126-L129 PolarHBondContact O-N 2.9Å; S127-L129 VanDerWaalsContact C-N 3.31Å; L129-L144 HydrophobicContact CD1-CD1 3.64Å; L129-L144 HydrophobicContact CD1-CD2 4.06Å; L129-L144 HydrophobicContact CD1-CG 3.71Å; L129-L144 HydrophobicContact CD2-CD1 3.88Å; L129-L144 HydrophobicContact CG-CD1 3.61Å; L129-L144 HydrophobicContact CG-CG 4.26Å; L129-L153 HydrophobicContact CD1-CD1 3.78Å; L129-I172 WeakPolarHBondContact O-CD1 3.34Å; L129-L199 HydrophobicContact CD2-CD1 4.01Å
130	A	90.3	Very high	86.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132	179.3	0	0	0	0	0	110.7	D124 I125 V132 V145 L147	D124-A130 WeakPolarHBondContact O-CA 3.34Å; I125-A130 HydrophobicContact CG1-CB 3.8Å; A130-V132 HydrophobicContact CB-CG1 4.38Å; A130-V145 HydrophobicContact CB-CB 4.42Å; A130-V145 PolarHBondContact N-O 3.08Å; A130-V145 PolarHBondContact O-N 3.1Å; A130-L147 HydrophobicContact CB-CD1 3.88Å; A130-L147 HydrophobicContact CB-CD2 4.3Å; A130-L147 HydrophobicContact CB-CG 3.95Å
131	V	92.4	Very high	87.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.1	165.9	174.3	0	0	0	0	108.1	L123 D124 A143 L144 F156 I172 C179 I181 L199	L123-V131 HydrophobicContact CB-CG1 4.29Å; L123-V131 HydrophobicContact CD1-CG1 4.14Å; L123-V131 PolarHBondContact N-O 2.87Å; D124-V131 PolarHBondContact N-O 3.16Å; D124-V131 PolarHBondContact O-N 2.88Å; V131-A143 WeakPolarHBondContact CA-O 3.19Å; V131-L144 HydrophobicContact CG2-CD1 3.77Å; V131-F156 HydrophobicContact CG1-CZ 3.88Å; V131-F156 HydrophobicContact CG2-CZ 4.39Å; V131-I172 HydrophobicContact CB-CD1 4.39Å; V131-I172 HydrophobicContact CB-CG1 4.49Å; V131-I172 HydrophobicContact CG2-CD1 3.84Å; V131-I172 HydrophobicContact CG2-CG1 3.77Å; V131-C179 HydrophobicContact CG2-CB 4.36Å; V131-I181 HydrophobicContact CG1-CD1 4.47Å; V131-L199 HydrophobicContact CG2-CD1 4.38Å; V131-L199 HydrophobicContact CG2-CD2 4.15Å
132	V	90.3	Very high	87.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	148.5	-176.2	-55.4	0	0	0	0	111.5	F102 I107 F119 S121 V122 A130 L134 F142 A143 V145	F102-V132 HydrophobicContact CE1-CG1 3.75Å; F102-V132 HydrophobicContact CZ-CG1 3.74Å; I107-V132 HydrophobicContact CD1-CG2 4.23Å; F119-V132 HydrophobicContact CD2-CB 4.33Å; F119-V132 HydrophobicContact CE2-CB 4Å; F119-V132 HydrophobicContact CE2-CG1 3.97Å; S121-V132 CarbonylContact O-C 3.53Å; S121-V132 WeakPolarHBondContact O-CA 3.27Å; V122-V132 HydrophobicContact CG2-CG1 4.2Å; A130-V132 HydrophobicContact CB-CG1 4.38Å; V132-L134 HydrophobicContact CG2-CD2 4.15Å; V132-L134 HydrophobicContact CG2-CG 4.36Å; V132-F142 CarbonylContact O-C 3.56Å; V132-F142 VanDerWaalsContact O-CA 3.28Å; V132-F142 WeakPolarHBondContact O-CA 3.25Å; V132-A143 HydrophobicContact CG2-CB 3.7Å; V132-A143 PolarHBondContact N-O 2.87Å; V132-A143 PolarHBondContact O-N 2.74Å; V132-V145 HydrophobicContact CG2-CG2 4.23Å
133	H	88.6	Confident	88.1	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122.6	174.9	175.5	-159.8	0	0	0	109.3	K120 S121 L123 T140 F142 F163	K120-H133 HydrophobicContact CB-CB 4.36Å; K120-H133 WeakPolarHBondContact CB-O 3.27Å; K120-H133 PolarHBondContact N-O 2.85Å; S121-H133 PolarHBondContact N-O 3.28Å; S121-H133 PolarHBondContact O-N 2.81Å; L123-H133 HydrophobicContact CD2-CB 4.14Å; L123-H133 HydrophobicContact CG-CB 4.25Å; H133-T140 VanDerWaalsContact CD2-CG2 3.45Å; H133-T140 WeakPolarHBondContact CD2-CG2 3.45Å; H133-T140 WeakPolarHBondContact NE2-CG2 2.92Å; H133-T140 PolarHBondContact NE2-OG1 2.86Å; H133-F142 HydrophobicContact CB-CD1 4.39Å; H133-F142 HydrophobicContact CB-CE1 4.43Å; H133-F163 PolarHBondContact CE1-O 2.88Å
134	L	89.4	Confident	88.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.4	174.7	-54.4	179.3	0	0	0	109.2	I107 L111 L117 H118 F119 V132 Q141 A143	I107-L134 HydrophobicContact CD1-CD1 4.44Å; I107-L134 HydrophobicContact CD1-CD2 3.9Å; I107-L134 HydrophobicContact CG1-CD2 4.2Å; L111-L134 HydrophobicContact CD1-CD1 4.48Å; L117-L134 HydrophobicContact CB-CB 4.33Å; H118-L134 WeakPolarHBondContact O-CA 3.4Å; F119-L134 HydrophobicContact CB-CD2 4.42Å; V132-L134 HydrophobicContact CG2-CD2 4.15Å; V132-L134 HydrophobicContact CG2-CG 4.36Å; L134-Q141 HydrophobicContact CB-CG 4.04Å; L134-Q141 PolarHBondContact N-O 3.34Å; L134-Q141 PolarHBondContact O-N 2.82Å; L134-A143 HydrophobicContact CD1-CB 3.66Å; L134-A143 HydrophobicContact CG-CB 4.21Å
135	A	87.2	Confident	88.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	149.6	177	0	0	0	0	0	114.4	H118 K120 I139 L162	H118-A135 PolarHBondContact N-O 3.18Å; H118-A135 VanDerWaalsContact N-O 3.14Å; H118-A135 PolarHBondContact O-N 3.36Å; K120-A135 HydrophobicContact CD-CB 4.4Å; K120-A135 WeakPolarHBondContact CE-O 2.99Å; K120-A135 HydrophobicContact CG-CB 3.72Å; A135-I139 CarbonylContact C-O 3.56Å; A135-I139 WeakPolarHBondContact CA-O 3.42Å; A135-I139 WeakPolarHBondContact CB-O 3.39Å; A135-L162 HydrophobicContact CB-CD1 3.46Å; A135-L162 VanDerWaalsContact CB-CD1 3.46Å
136	R	83.8	Confident	88.5	Confident	70 Å²	70	26.4 Å²	26.4	26%	0.264	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	143.5	177.2	-176.8	-160.1	169	159.6	4.5	109.8	I114 Q115 N116 L117 M138 I139	I114-R136 PolarHBondContact O-NH1 3.3Å; Q115-R136 WeakPolarHBondContact O-CD 3.31Å; Q115-R136 PolarHBondContact O-NH1 2.87Å; N116-R136 HydrophobicContact CB-CG 4.15Å; N116-R136 VanDerWaalsContact CB-CZ 3.43Å; N116-R136 VanDerWaalsContact CB-NH1 3.33Å; N116-R136 VanDerWaalsContact CG-NH1 3.32Å; N116-R136 PolarHBondContact ND2-NH1 3.37Å; N116-R136 PolarHBondContact ND2-NH2 2.54Å; N116-R136 WeakPolarHBondContact O-CB 3.4Å; N116-R136 VanDerWaalsContact O-CD 3.31Å; N116-R136 WeakPolarHBondContact O-CD 3.47Å; N116-R136 WeakPolarHBondContact O-CG 3.49Å; L117-R136 HydrophobicContact CD2-CB 3.95Å; R136-M138 PolarHBondContact O-N 3.12Å; R136-M138 VanDerWaalsContact O-N 3.15Å; R136-I139 PolarHBondContact N-O 2.83Å; R136-I139 CarbonylContact O-C 3.52Å; R136-I139 WeakPolarHBondContact O-CA 3.49Å; R136-I139 WeakPolarHBondContact O-CB 3.15Å; R136-I139 PolarHBondContact O-N 2.93Å; R136-I139 VanDerWaalsContact O-O 3.04Å
137	D	76.3	Confident	88.4	Confident	116 Å²	116	25.1 Å²	25.1	62%	0.62	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	39.7	62.7	160.6	-59.6	-16.7	0	0	0	113.9	I139	D137-I139 PolarHBondContact O-N 3.34Å
138	M	80	Confident	88.4	Confident	105 Å²	105	29 Å²	29	52%	0.517	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	7.4	-179.3	-56.9	-63.4	-74	0	0	115.7	R136 T160 V161 L162	R136-M138 PolarHBondContact O-N 3.12Å; R136-M138 VanDerWaalsContact O-N 3.15Å; M138-T160 CarbonylContact O-C 3.56Å; M138-T160 WeakPolarHBondContact O-CA 3.36Å; M138-V161 CarbonylContact O-C 3.6Å; M138-V161 WeakPolarHBondContact O-CA 3.33Å; M138-V161 PolarHBondContact O-N 2.83Å; M138-L162 PolarHBondContact O-N 3.23Å; M138-L162 HydrophobicContact SD-CB 4.33Å
139	I	86.3	Confident	88.4	Confident	41 Å²	41	33.1 Å²	33.1	21%	0.21	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.5	174.8	-59.4	165.8	0	0	0	109.3	A135 R136 D137 R158 Q159	A135-I139 CarbonylContact C-O 3.56Å; A135-I139 WeakPolarHBondContact CA-O 3.42Å; A135-I139 WeakPolarHBondContact CB-O 3.39Å; R136-I139 PolarHBondContact N-O 2.83Å; R136-I139 CarbonylContact O-C 3.52Å; R136-I139 WeakPolarHBondContact O-CA 3.49Å; R136-I139 WeakPolarHBondContact O-CB 3.15Å; R136-I139 PolarHBondContact O-N 2.93Å; R136-I139 VanDerWaalsContact O-O 3.04Å; D137-I139 PolarHBondContact O-N 3.34Å; I139-R158 HydrophobicContact CG2-CG 3.98Å; I139-Q159 VanDerWaalsContact CA-O 3.31Å; I139-Q159 WeakPolarHBondContact CA-O 3.26Å
140	T	89	Confident	88.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.5	166.3	-80.5	0	0	0	0	108.7	H133 F142 R158 Q159 V161 F163	H133-T140 VanDerWaalsContact CD2-CG2 3.45Å; H133-T140 WeakPolarHBondContact CD2-CG2 3.45Å; H133-T140 WeakPolarHBondContact NE2-CG2 2.92Å; H133-T140 PolarHBondContact NE2-OG1 2.86Å; T140-F142 HydrophobicContact CG2-CE1 4.32Å; T140-F142 HydrophobicContact CG2-CZ 4.22Å; T140-R158 CarbonylContact O-C 3.51Å; T140-R158 WeakPolarHBondContact O-CA 3.48Å; T140-Q159 PolarHBondContact N-O 3.19Å; T140-Q159 PolarHBondContact O-N 3.09Å; T140-V161 WeakPolarHBondContact CB-O 3.16Å; T140-V161 PolarHBondContact OG1-O 3.21Å; T140-F163 HydrophobicContact CG2-CD2 3.77Å; T140-F163 HydrophobicContact CG2-CE2 4.41Å; T140-F163 PolarHBondContact OG1-N 3.49Å
141	Q	92.6	Very high	88	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.033	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	164	168.3	66.3	-178.4	45.1	0	0	110.9	L117 L134 R158	L117-Q141 HydrophobicContact CD1-CG 4.11Å; L117-Q141 HydrophobicContact CD2-CG 4.22Å; L134-Q141 HydrophobicContact CB-CG 4.04Å; L134-Q141 PolarHBondContact N-O 3.34Å; L134-Q141 PolarHBondContact O-N 2.82Å; Q141-R158 HydrophobicContact CB-CB 4.19Å
142	F	94.2	Very high	88	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	154.2	175.7	-53.1	-64.7	0	0	0	109.9	L123 V132 H133 T140 S155 F156 T168 I181 L183	L123-F142 HydrophobicContact CD1-CD1 3.57Å; L123-F142 HydrophobicContact CD1-CE1 3.62Å; V132-F142 CarbonylContact O-C 3.56Å; V132-F142 VanDerWaalsContact O-CA 3.28Å; V132-F142 WeakPolarHBondContact O-CA 3.25Å; H133-F142 HydrophobicContact CB-CD1 4.39Å; H133-F142 HydrophobicContact CB-CE1 4.43Å; T140-F142 HydrophobicContact CG2-CE1 4.32Å; T140-F142 HydrophobicContact CG2-CZ 4.22Å; F142-S155 CarbonylContact O-C 3.59Å; F142-S155 WeakPolarHBondContact O-CA 3.3Å; F142-S155 WeakPolarHBondContact O-CB 3.46Å; F142-F156 HydrophobicContact CB-CD1 4.28Å; F142-F156 HydrophobicContact CB-CD2 3.98Å; F142-F156 HydrophobicContact CB-CE1 3.96Å; F142-F156 HydrophobicContact CB-CE2 3.65Å; F142-F156 HydrophobicContact CB-CG 4.29Å; F142-F156 HydrophobicContact CB-CZ 3.64Å; F142-F156 HydrophobicContact CD2-CD2 4.35Å; F142-F156 HydrophobicContact CD2-CE2 4.21Å; F142-F156 HydrophobicContact CG-CE2 4.24Å; F142-F156 PolarHBondContact N-O 3.35Å; F142-F156 PolarHBondContact O-N 3.35Å; F142-T168 HydrophobicContact CE1-CG2 3.91Å; F142-T168 HydrophobicContact CZ-CG2 4.17Å; F142-I181 HydrophobicContact CB-CD1 4.37Å; F142-I181 HydrophobicContact CD1-CD1 3.98Å; F142-I181 HydrophobicContact CD2-CD1 3.56Å; F142-I181 HydrophobicContact CE1-CD1 4.2Å; F142-I181 HydrophobicContact CE1-CG2 4.2Å; F142-I181 HydrophobicContact CE2-CD1 3.78Å; F142-I181 HydrophobicContact CE2-CG2 4.22Å; F142-I181 HydrophobicContact CG-CD1 3.67Å; F142-I181 HydrophobicContact CZ-CD1 4.1Å; F142-I181 HydrophobicContact CZ-CG2 3.79Å; F142-L183 HydrophobicContact CE2-CD2 4.35Å; F142-L183 HydrophobicContact CZ-CD2 4.29Å
143	A	93.3	Very high	88.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.9	174.9	0	0	0	0	0	111.7	V131 V132 L134 F152 G154	V131-A143 WeakPolarHBondContact CA-O 3.19Å; V132-A143 HydrophobicContact CG2-CB 3.7Å; V132-A143 PolarHBondContact N-O 2.87Å; V132-A143 PolarHBondContact O-N 2.74Å; L134-A143 HydrophobicContact CD1-CB 3.66Å; L134-A143 HydrophobicContact CG-CB 4.21Å; A143-F152 HydrophobicContact CB-CD2 4.33Å; A143-F152 HydrophobicContact CB-CE2 3.37Å; A143-F152 HydrophobicContact CB-CZ 3.82Å; A143-G154 CarbonylContact C-O 3.58Å; A143-G154 VanDerWaalsContact CA-O 3.29Å; A143-G154 WeakPolarHBondContact CA-O 3.43Å
144	L	94.7	Very high	88.3	Confident	10 Å²	10	49.2 Å²	49.2	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.5	177.9	-167.3	67.4	0	0	0	109.4	L129 V131 L153 G154 F156 L199	L129-L144 HydrophobicContact CD1-CD1 3.64Å; L129-L144 HydrophobicContact CD1-CD2 4.06Å; L129-L144 HydrophobicContact CD1-CG 3.71Å; L129-L144 HydrophobicContact CD2-CD1 3.88Å; L129-L144 HydrophobicContact CG-CD1 3.61Å; L129-L144 HydrophobicContact CG-CG 4.26Å; V131-L144 HydrophobicContact CG2-CD1 3.77Å; L144-L153 HydrophobicContact CB-CB 4.15Å; L144-L153 HydrophobicContact CD2-CB 4.09Å; L144-L153 HydrophobicContact CD2-CD1 3.78Å; L144-L153 HydrophobicContact CG-CB 4.19Å; L144-L153 HydrophobicContact CG-CD1 4Å; L144-L153 PolarHBondContact O-N 2.82Å; L144-G154 PolarHBondContact N-O 2.8Å; L144-F156 HydrophobicContact CB-CE1 4.32Å; L144-L199 HydrophobicContact CD1-CD1 4.15Å; L144-L199 HydrophobicContact CD1-CD2 4.12Å; L144-L199 HydrophobicContact CD2-CB 4.2Å
145	V	91.5	Very high	88.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	126.3	-178.6	-176.5	0	0	0	0	109	F102 H106 I107 A130 V132 L147 K151 F152	F102-V145 HydrophobicContact CE1-CG2 4.41Å; H106-V145 HydrophobicContact CB-CG1 4.05Å; I107-V145 HydrophobicContact CD1-CG2 4.46Å; A130-V145 HydrophobicContact CB-CB 4.42Å; A130-V145 PolarHBondContact N-O 3.08Å; A130-V145 PolarHBondContact O-N 3.1Å; V132-V145 HydrophobicContact CG2-CG2 4.23Å; V145-L147 HydrophobicContact CG1-CD2 3.91Å; V145-K151 WeakPolarHBondContact CA-O 3.3Å; V145-F152 HydrophobicContact CG2-CD2 4.31Å
146	D	89.2	Confident	88.8	Confident	14 Å²	14	52.3 Å²	52.3	8%	0.075	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	105.7	167.3	-169.7	-24.9	0	0	0	108.9	R148 I149 N150 K151 L153	D146-R148 PolarHBondContact O-N 2.87Å; D146-R148 VanDerWaalsContact OD1-CB 3.28Å; D146-R148 WeakPolarHBondContact OD1-CB 3.24Å; D146-R148 IonicContact OD1-CZ 3.69Å; D146-R148 PolarHBondContact OD1-N 2.92Å; D146-R148 IonicContact OD1-NE 3.62Å; D146-R148 PolarHBondContact OD1-NE 3.37Å; D146-R148 VanDerWaalsContact OD1-NE 3.13Å; D146-R148 IonicContact OD1-NH2 3.85Å; D146-R148 IonicContact OD2-CZ 2.93Å; D146-R148 IonicContact OD2-NE 3.04Å; D146-R148 IonicContact OD2-NH2 3.77Å; D146-R148 PolarHBondContact OD2-NH2 3.29Å; D146-I149 HydrophobicContact CB-CD1 4.23Å; D146-I149 HydrophobicContact CB-CG1 3.77Å; D146-N150 CarbonylContact O-C 3.51Å; D146-N150 WeakPolarHBondContact O-CA 3.38Å; D146-N150 PolarHBondContact O-N 2.85Å; D146-K151 PolarHBondContact N-O 3.36Å; D146-K151 PolarHBondContact O-N 3.48Å; D146-L153 HydrophobicContact CB-CD1 4.18Å; D146-L153 HydrophobicContact CB-CD2 4.44Å; D146-L153 HydrophobicContact CB-CG 4.38Å
147	L	85.5	Confident	89.2	Confident	28 Å²	28	49.8 Å²	49.8	15%	0.147	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.4	-178.7	-58.7	176.6	0	0	0	112.9	I77 F102 I125 G128 A130 V145 N150	I77-L147 HydrophobicContact CD1-CD1 3.77Å; I77-L147 HydrophobicContact CG1-CD1 4.46Å; F102-L147 HydrophobicContact CE2-CD2 4.14Å; F102-L147 HydrophobicContact CZ-CD2 4.11Å; I125-L147 HydrophobicContact CD1-CD1 4.08Å; I125-L147 HydrophobicContact CG1-CD1 4.32Å; I125-L147 HydrophobicContact CG2-CD1 4.37Å; G128-L147 VanDerWaalsContact O-CB 3.27Å; G128-L147 WeakPolarHBondContact O-CB 3.46Å; G128-L147 PolarHBondContact O-N 2.99Å; A130-L147 HydrophobicContact CB-CD1 3.88Å; A130-L147 HydrophobicContact CB-CD2 4.3Å; A130-L147 HydrophobicContact CB-CG 3.95Å; V145-L147 HydrophobicContact CG1-CD2 3.91Å; L147-N150 PolarHBondContact O-OD1 3.16Å
148	R	85.4	Confident	89.9	Confident	170 Å²	170	51.8 Å²	51.8	64%	0.642	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-33.6	179.6	-56.5	172.2	-61.2	168	4.9	111.4	D146	D146-R148 PolarHBondContact O-N 2.87Å; D146-R148 VanDerWaalsContact OD1-CB 3.28Å; D146-R148 WeakPolarHBondContact OD1-CB 3.24Å; D146-R148 IonicContact OD1-CZ 3.69Å; D146-R148 PolarHBondContact OD1-N 2.92Å; D146-R148 IonicContact OD1-NE 3.62Å; D146-R148 PolarHBondContact OD1-NE 3.37Å; D146-R148 VanDerWaalsContact OD1-NE 3.13Å; D146-R148 IonicContact OD1-NH2 3.85Å; D146-R148 IonicContact OD2-CZ 2.93Å; D146-R148 IonicContact OD2-NE 3.04Å; D146-R148 IonicContact OD2-NH2 3.77Å; D146-R148 PolarHBondContact OD2-NH2 3.29Å
149	I	86.7	Confident	90.2	Very high	106 Å²	106	47.8 Å²	47.8	54%	0.544	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	5.8	178.6	60.1	167.1	0	0	0	112.3	D146 K151	D146-I149 HydrophobicContact CB-CD1 4.23Å; D146-I149 HydrophobicContact CB-CG1 3.77Å; I149-K151 VanDerWaalsContact C-N 3.26Å; I149-K151 HydrophobicContact CD1-CB 3.6Å; I149-K151 HydrophobicContact CD1-CD 3.93Å; I149-K151 HydrophobicContact CD1-CG 4.39Å; I149-K151 HydrophobicContact CG1-CB 3.68Å; I149-K151 PolarHBondContact O-N 2.83Å
150	N	84.2	Confident	90.1	Very high	102 Å²	102	51.2 Å²	51.2	55%	0.545	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	43.2	-175.8	-67	-34.7	0	0	0	113.5	H106 D146 L147	H106-N150 PolarHBondContact CE1-OD1 2.82Å; H106-N150 VanDerWaalsContact CE1-OD1 3.23Å; D146-N150 CarbonylContact O-C 3.51Å; D146-N150 WeakPolarHBondContact O-CA 3.38Å; D146-N150 PolarHBondContact O-N 2.85Å; L147-N150 PolarHBondContact O-OD1 3.16Å
151	K	88.6	Confident	89.7	Confident	123 Å²	123	52 Å²	52	54%	0.535	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.1	-174.4	-169.5	178.7	178	-179.3	0	111.9	V145 D146 I149 L153	V145-K151 WeakPolarHBondContact CA-O 3.3Å; D146-K151 PolarHBondContact N-O 3.36Å; D146-K151 PolarHBondContact O-N 3.48Å; I149-K151 VanDerWaalsContact C-N 3.26Å; I149-K151 HydrophobicContact CD1-CB 3.6Å; I149-K151 HydrophobicContact CD1-CD 3.93Å; I149-K151 HydrophobicContact CD1-CG 4.39Å; I149-K151 HydrophobicContact CG1-CB 3.68Å; I149-K151 PolarHBondContact O-N 2.83Å; K151-L153 HydrophobicContact CD-CD2 4.28Å; K151-L153 HydrophobicContact CG-CD2 4.29Å
152	F	91.8	Very high	89	Confident	42 Å²	42	55.2 Å²	55.2	18%	0.184	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	123.8	165.3	-174.8	-88.2	0	0	0	110.2	I107 P108 L111 A143 V145 G154	I107-F152 HydrophobicContact CD1-CD2 4.32Å; I107-F152 HydrophobicContact CD1-CE2 4.44Å; P108-F152 VanDerWaalsContact CD-CG 3.41Å; P108-F152 HydrophobicContact CG-CB 3.68Å; P108-F152 HydrophobicContact CG-CD1 3.76Å; P108-F152 HydrophobicContact CG-CD2 4.04Å; P108-F152 HydrophobicContact CG-CE1 4.4Å; P108-F152 HydrophobicContact CG-CG 3.56Å; L111-F152 HydrophobicContact CD1-CD2 4.48Å; L111-F152 HydrophobicContact CD1-CE1 3.87Å; L111-F152 HydrophobicContact CD1-CE2 3.57Å; L111-F152 HydrophobicContact CD1-CZ 3.23Å; A143-F152 HydrophobicContact CB-CD2 4.33Å; A143-F152 HydrophobicContact CB-CE2 3.37Å; A143-F152 HydrophobicContact CB-CZ 3.82Å; V145-F152 HydrophobicContact CG2-CD2 4.31Å; F152-G154 VanDerWaalsContact CE1-C 3.45Å; F152-G154 VanDerWaalsContact CE1-CA 3.42Å; F152-G154 VanDerWaalsContact CZ-C 3.47Å; F152-G154 WeakPolarHBondContact CZ-O 3.44Å
153	L	92.3	Very high	88.3	Confident	84 Å²	84	55.6 Å²	55.6	44%	0.44	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-30.4	-176.4	-59.7	-173.5	0	0	0	113	L129 L144 D146 K151	L129-L153 HydrophobicContact CD1-CD1 3.78Å; L144-L153 HydrophobicContact CB-CB 4.15Å; L144-L153 HydrophobicContact CD2-CB 4.09Å; L144-L153 HydrophobicContact CD2-CD1 3.78Å; L144-L153 HydrophobicContact CG-CB 4.19Å; L144-L153 HydrophobicContact CG-CD1 4Å; L144-L153 PolarHBondContact O-N 2.82Å; D146-L153 HydrophobicContact CB-CD1 4.18Å; D146-L153 HydrophobicContact CB-CD2 4.44Å; D146-L153 HydrophobicContact CB-CG 4.38Å; K151-L153 HydrophobicContact CD-CD2 4.28Å; K151-L153 HydrophobicContact CG-CD2 4.29Å
154	G	92.3	Very high	87.2	Confident	16 Å²	16	58.1 Å²	58.1	17%	0.165	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.3	169.5	-178.1	0	0	0	0	0	113.1	A143 L144 F152	A143-G154 CarbonylContact C-O 3.58Å; A143-G154 VanDerWaalsContact CA-O 3.29Å; A143-G154 WeakPolarHBondContact CA-O 3.43Å; L144-G154 PolarHBondContact N-O 2.8Å; F152-G154 VanDerWaalsContact CE1-C 3.45Å; F152-G154 VanDerWaalsContact CE1-CA 3.42Å; F152-G154 VanDerWaalsContact CZ-C 3.47Å; F152-G154 WeakPolarHBondContact CZ-O 3.44Å
155	S	93.1	Very high	86.2	Confident	55 Å²	55	60.2 Å²	60.2	39%	0.385	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	148	173.2	56	0	0	0	0	111.5	F142	F142-S155 CarbonylContact O-C 3.59Å; F142-S155 WeakPolarHBondContact O-CA 3.3Å; F142-S155 WeakPolarHBondContact O-CB 3.46Å
156	F	94.8	Very high	85.1	Confident	10 Å²	10	66.2 Å²	66.2	4%	0.044	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	170.6	-177.7	62.3	-85.9	0	0	0	112.2	V131 F142 L144 R158 I181 Y197 L199	V131-F156 HydrophobicContact CG1-CZ 3.88Å; V131-F156 HydrophobicContact CG2-CZ 4.39Å; F142-F156 HydrophobicContact CB-CD1 4.28Å; F142-F156 HydrophobicContact CB-CD2 3.98Å; F142-F156 HydrophobicContact CB-CE1 3.96Å; F142-F156 HydrophobicContact CB-CE2 3.65Å; F142-F156 HydrophobicContact CB-CG 4.29Å; F142-F156 HydrophobicContact CB-CZ 3.64Å; F142-F156 HydrophobicContact CD2-CD2 4.35Å; F142-F156 HydrophobicContact CD2-CE2 4.21Å; F142-F156 HydrophobicContact CG-CE2 4.24Å; F142-F156 PolarHBondContact N-O 3.35Å; F142-F156 PolarHBondContact O-N 3.35Å; L144-F156 HydrophobicContact CB-CE1 4.32Å; F156-R158 VanDerWaalsContact C-N 3.31Å; F156-R158 PolarHBondContact O-N 2.81Å; F156-I181 HydrophobicContact CE2-CD1 3.92Å; F156-I181 HydrophobicContact CZ-CD1 4.46Å; F156-Y197 AromaticContact CD2-CD1 3.78Å; F156-Y197 HydrophobicContact CD2-CD1 3.78Å; F156-Y197 HydrophobicContact CD2-CD2 4.21Å; F156-Y197 HydrophobicContact CD2-CE1 4.14Å; F156-Y197 AromaticContact CD2-CG 3.81Å; F156-Y197 HydrophobicContact CD2-CG 3.81Å; F156-Y197 HydrophobicContact CE2-CD1 4.31Å; F156-Y197 AromaticContact CE2-CD2 3.96Å; F156-Y197 HydrophobicContact CE2-CD2 3.96Å; F156-Y197 HydrophobicContact CE2-CE2 4.46Å; F156-Y197 AromaticContact CE2-CG 3.86Å; F156-Y197 HydrophobicContact CE2-CG 3.86Å; F156-L199 HydrophobicContact CE1-CD2 4.12Å; F156-L199 HydrophobicContact CZ-CD2 3.84Å
157	G	91.7	Very high	84.5	Confident	17 Å²	17	66.7 Å²	66.7	18%	0.175	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	62.6	32	171.7	0	0	0	0	0	115.1	Q159	G157-Q159 PolarHBondContact O-N 3.48Å
158	R	90.9	Very high	84.4	Confident	158 Å²	158	65.7 Å²	65.7	60%	0.596	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	129.7	177.7	-177	175.1	174.3	163.6	-2.6	110.9	I139 T140 Q141 F156	I139-R158 HydrophobicContact CG2-CG 3.98Å; T140-R158 CarbonylContact O-C 3.51Å; T140-R158 WeakPolarHBondContact O-CA 3.48Å; Q141-R158 HydrophobicContact CB-CB 4.19Å; F156-R158 VanDerWaalsContact C-N 3.31Å; F156-R158 PolarHBondContact O-N 2.81Å
159	Q	86.5	Confident	84.4	Confident	20 Å²	20	59.5 Å²	59.5	9%	0.093	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	141.9	178.9	-69.1	-178.2	62.3	0	0	109.7	I139 T140 G157 V161 F163 L183	I139-Q159 VanDerWaalsContact CA-O 3.31Å; I139-Q159 WeakPolarHBondContact CA-O 3.26Å; T140-Q159 PolarHBondContact N-O 3.19Å; T140-Q159 PolarHBondContact O-N 3.09Å; G157-Q159 PolarHBondContact O-N 3.48Å; Q159-V161 PolarHBondContact O-N 3.26Å; Q159-F163 HydrophobicContact CB-CE2 4.05Å; Q159-F163 HydrophobicContact CG-CE2 4.43Å; Q159-F163 VanDerWaalsContact OE1-CE2 3.28Å; Q159-F163 VanDerWaalsContact OE1-CZ 3.25Å; Q159-L183 VanDerWaalsContact NE2-CD1 3.35Å; Q159-L183 VanDerWaalsContact OE1-CD1 3.24Å
160	T	84.1	Confident	84.7	Confident	113 Å²	113	54.4 Å²	54.4	69%	0.693	29%	0.291	S	S	*	.	S	Bend	trans	-87.3	35.8	178.3	57.3	0	0	0	0	112.1	M138	M138-T160 CarbonylContact O-C 3.56Å; M138-T160 WeakPolarHBondContact O-CA 3.36Å
161	V	80.2	Confident	85.1	Confident	16 Å²	16	51.9 Å²	51.9	10%	0.097	28%	0.275	C	S	.	.	S	Bend	trans	-134.9	137.6	169.8	179.5	0	0	0	0	108.8	M138 T140 Q159 F163	M138-V161 CarbonylContact O-C 3.6Å; M138-V161 WeakPolarHBondContact O-CA 3.33Å; M138-V161 PolarHBondContact O-N 2.83Å; T140-V161 WeakPolarHBondContact CB-O 3.16Å; T140-V161 PolarHBondContact OG1-O 3.21Å; Q159-V161 PolarHBondContact O-N 3.26Å; V161-F163 HydrophobicContact CB-CE1 4.05Å; V161-F163 HydrophobicContact CB-CZ 3.93Å; V161-F163 HydrophobicContact CG1-CD1 4.17Å; V161-F163 HydrophobicContact CG1-CE1 3.72Å; V161-F163 HydrophobicContact CG1-CZ 4.14Å
162	L	78.2	Confident	85.4	Confident	76 Å²	76	46.5 Å²	46.5	40%	0.398	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-79.5	121.1	170.8	-177.8	67	0	0	0	110.2	A135 M138	A135-L162 HydrophobicContact CB-CD1 3.46Å; A135-L162 VanDerWaalsContact CB-CD1 3.46Å; M138-L162 PolarHBondContact O-N 3.23Å; M138-L162 HydrophobicContact SD-CB 4.33Å
163	F	78.3	Confident	85.6	Confident	8 Å²	8	44.5 Å²	44.5	4%	0.035	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-99.9	143.8	172.9	-57.1	-60.1	0	0	0	111.8	H133 T140 Q159 V161 L183 P184	H133-F163 PolarHBondContact CE1-O 2.88Å; T140-F163 HydrophobicContact CG2-CD2 3.77Å; T140-F163 HydrophobicContact CG2-CE2 4.41Å; T140-F163 PolarHBondContact OG1-N 3.49Å; Q159-F163 HydrophobicContact CB-CE2 4.05Å; Q159-F163 HydrophobicContact CG-CE2 4.43Å; Q159-F163 VanDerWaalsContact OE1-CE2 3.28Å; Q159-F163 VanDerWaalsContact OE1-CZ 3.25Å; V161-F163 HydrophobicContact CB-CE1 4.05Å; V161-F163 HydrophobicContact CB-CZ 3.93Å; V161-F163 HydrophobicContact CG1-CD1 4.17Å; V161-F163 HydrophobicContact CG1-CE1 3.72Å; V161-F163 HydrophobicContact CG1-CZ 4.14Å; F163-L183 HydrophobicContact CD2-CB 4.46Å; F163-L183 HydrophobicContact CE2-CB 4.46Å; F163-L183 HydrophobicContact CE2-CD1 3.96Å; F163-L183 HydrophobicContact CZ-CD1 3.83Å; F163-P184 HydrophobicContact CD1-CB 3.92Å; F163-P184 HydrophobicContact CD1-CG 3.78Å; F163-P184 HydrophobicContact CE1-CB 3.99Å; F163-P184 HydrophobicContact CE1-CG 4.33Å; F163-P184 WeakPolarHBondContact CE1-O 3.48Å; F163-P184 WeakPolarHBondContact CZ-O 3.49Å
164	S	71.7	Confident	85.4	Confident	53 Å²	53	42.7 Å²	42.7	37%	0.371	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-70.3	144	171.2	70.6	0	0	0	0	110.2	E166 S167 T168	S164-E166 PolarHBondContact O-N 2.86Å; S164-S167 PolarHBondContact O-N 2.84Å; S164-S167 VanDerWaalsContact O-N 3.08Å; S164-S167 WeakPolarHBondContact OG-CB 3.4Å; S164-S167 PolarHBondContact OG-N 3.41Å; S164-S167 PolarHBondContact OG-OG 2.93Å; S164-T168 PolarHBondContact O-N 2.58Å; S164-T168 PolarHBondContact O-OG1 3.42Å
165	P	72.6	Confident	85.3	Confident	53 Å²	53	45.3 Å²	45.3	34%	0.344	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-55.9	-34	177	-25.4	33.9	0	0	0	112.9	K120 S167 T168	K120-P165 HydrophobicContact CB-CG 4.34Å; P165-S167 VanDerWaalsContact C-N 3.33Å; P165-S167 PolarHBondContact O-N 3.44Å; P165-T168 PolarHBondContact O-N 2.78Å; P165-T168 VanDerWaalsContact O-O 3.11Å
166	E	69.7	Low	85.2	Confident	126 Å²	126	43.5 Å²	43.5	59%	0.589	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-71	-26.1	-179.8	-66.1	165.3	-165.2	0	0	113.6	H64 S164 T168	H64-E166 IonicContact CE1-OE1 3.36Å; H64-E166 PolarHBondContact CE1-OE1 3Å; H64-E166 IonicContact ND1-OE1 3.07Å; H64-E166 PolarHBondContact ND1-OE1 2.81Å; S164-E166 PolarHBondContact O-N 2.86Å; E166-T168 VanDerWaalsContact C-N 3.35Å
167	S	75.4	Confident	85.2	Confident	25 Å²	25	45.3 Å²	45.3	18%	0.175	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-86.9	-11.4	179.4	-55.5	0	0	0	0	112.8	S164 P165 R182	S164-S167 PolarHBondContact O-N 2.84Å; S164-S167 VanDerWaalsContact O-N 3.08Å; S164-S167 WeakPolarHBondContact OG-CB 3.4Å; S164-S167 PolarHBondContact OG-N 3.41Å; S164-S167 PolarHBondContact OG-OG 2.93Å; P165-S167 VanDerWaalsContact C-N 3.33Å; P165-S167 PolarHBondContact O-N 3.44Å; S167-R182 PolarHBondContact O-NH2 2.88Å
168	T	83.1	Confident	85.4	Confident	6 Å²	6	47.1 Å²	47.1	4%	0.037	25%	0.25	C	S	.	.			trans	-110	119.9	-173.4	-48	0	0	0	0	109.8	L123 F142 S164 P165 E166 I181 R182	L123-T168 HydrophobicContact CD1-CG2 4.17Å; L123-T168 HydrophobicContact CD2-CG2 3.93Å; F142-T168 HydrophobicContact CE1-CG2 3.91Å; F142-T168 HydrophobicContact CZ-CG2 4.17Å; S164-T168 PolarHBondContact O-N 2.58Å; S164-T168 PolarHBondContact O-OG1 3.42Å; P165-T168 PolarHBondContact O-N 2.78Å; P165-T168 VanDerWaalsContact O-O 3.11Å; E166-T168 VanDerWaalsContact C-N 3.35Å; T168-I181 HydrophobicContact CG2-CG2 4.01Å; T168-R182 WeakPolarHBondContact CA-O 3.15Å
169	I	87.1	Confident	85.6	Confident	40 Å²	40	39.6 Å²	39.6	21%	0.205	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.6	179.2	-58.7	175.7	0	0	0	107.8	I181 R182 L278 F279	I169-I181 CarbonylContact O-C 3.52Å; I169-I181 WeakPolarHBondContact O-CA 3.5Å; I169-R182 PolarHBondContact N-O 2.86Å; I169-R182 VanDerWaalsContact N-O 3.09Å; I169-R182 PolarHBondContact O-N 3.32Å; I169-L278 HydrophobicContact CD1-CD2 4.41Å; I169-F279 HydrophobicContact CG2-CE1 4.41Å; I169-F279 HydrophobicContact CG2-CZ 4.24Å
170	G	91.4	Very high	86.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155.4	174	0	0	0	0	0	112.3	L123 L180	L123-G170 VanDerWaalsContact O-O 3.12Å; G170-L180 CarbonylContact C-O 3.51Å; G170-L180 VanDerWaalsContact CA-O 3.23Å; G170-L180 WeakPolarHBondContact CA-O 3.24Å
171	K	93.8	Very high	86.6	Confident	49 Å²	49	33.2 Å²	33.2	21%	0.213	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.7	164.5	-69	-73	156.5	-159.8	0	110.4	D124 C179 L180 F279 F281	D124-K171 IonicContact OD1-NZ 2.81Å; D124-K171 PolarHBondContact OD1-NZ 3.22Å; D124-K171 WeakPolarHBondContact OD2-CA 3.39Å; K171-C179 CarbonylContact O-C 3.57Å; K171-C179 VanDerWaalsContact O-CA 3.27Å; K171-C179 WeakPolarHBondContact O-CA 3.38Å; K171-C179 PolarHBondContact O-SG 3.28Å; K171-C179 VanDerWaalsContact O-SG 3.32Å; K171-L180 PolarHBondContact N-O 2.88Å; K171-L180 PolarHBondContact O-N 2.52Å; K171-F279 HydrophobicContact CB-CD2 4.1Å; K171-F279 HydrophobicContact CB-CE2 3.69Å; K171-F279 HydrophobicContact CG-CD2 3.93Å; K171-F279 HydrophobicContact CG-CE2 3.64Å; K171-F281 HydrophobicContact CB-CD2 4.04Å; K171-F281 HydrophobicContact CB-CE2 3.98Å; K171-F281 WeakPolarHBondContact O-CE2 3.31Å
172	I	95	Very high	87.2	Confident	9 Å²	9	32.7 Å²	32.7	5%	0.046	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.1	170.7	-63.9	160.7	0	0	0	107.9	D124 H126 L129 V131 Y178 L199	D124-I172 HydrophobicContact CB-CD1 4.05Å; D124-I172 HydrophobicContact CB-CG1 3.99Å; D124-I172 PolarHBondContact OD2-N 3.27Å; H126-I172 HydrophobicContact CB-CB 3.9Å; H126-I172 HydrophobicContact CB-CD1 4.14Å; H126-I172 HydrophobicContact CB-CG2 3.83Å; L129-I172 WeakPolarHBondContact O-CD1 3.34Å; V131-I172 HydrophobicContact CB-CD1 4.39Å; V131-I172 HydrophobicContact CB-CG1 4.49Å; V131-I172 HydrophobicContact CG2-CD1 3.84Å; V131-I172 HydrophobicContact CG2-CG1 3.77Å; I172-Y178 WeakPolarHBondContact CA-O 3.09Å; I172-L199 HydrophobicContact CG1-CD1 4.32Å; I172-L199 HydrophobicContact CG2-CD1 4.07Å
173	S	94.6	Very high	87.7	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.			trans	-67	156.1	176.1	60.5	0	0	0	0	111.6	H126 D175 G176 T177 Y178	H126-S173 PolarHBondContact CD2-O 2.86Å; S173-D175 VanDerWaalsContact CB-OD1 3.31Å; S173-D175 WeakPolarHBondContact CB-OD1 3.37Å; S173-D175 PolarHBondContact O-N 2.77Å; S173-D175 VanDerWaalsContact O-N 3.12Å; S173-D175 PolarHBondContact OG-OD1 3.42Å; S173-G176 WeakPolarHBondContact O-CA 3.4Å; S173-G176 PolarHBondContact O-N 2.8Å; S173-T177 PolarHBondContact OG-N 3.46Å; S173-Y178 PolarHBondContact N-O 2.95Å; S173-Y178 PolarHBondContact OG-N 3.18Å; S173-Y178 PolarHBondContact OG-O 2.84Å
174	P	89.5	Confident	88	Confident	46 Å²	46	29 Å²	29	30%	0.299	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.9	-177.9	-24.6	34.3	0	0	0	115.5	H126 F281 P283 V286	H126-P174 VanDerWaalsContact NE2-C 3.33Å; H126-P174 PolarHBondContact NE2-O 2.91Å; P174-F281 HydrophobicContact CG-CB 4.15Å; P174-P283 HydrophobicContact CG-CB 4.43Å; P174-V286 WeakPolarHBondContact CD-O 3.05Å
175	D	89.1	Confident	88.4	Confident	72 Å²	72	30.9 Å²	30.9	39%	0.385	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.7	173	61.2	-12.9	0	0	0	113.7	S173 T177 V286 N287	S173-D175 VanDerWaalsContact CB-OD1 3.31Å; S173-D175 WeakPolarHBondContact CB-OD1 3.37Å; S173-D175 PolarHBondContact O-N 2.77Å; S173-D175 VanDerWaalsContact O-N 3.12Å; S173-D175 PolarHBondContact OG-OD1 3.42Å; D175-T177 HydrophobicContact CB-CG2 4.23Å; D175-T177 PolarHBondContact O-N 3.45Å; D175-T177 PolarHBondContact OD1-N 2.99Å; D175-T177 PolarHBondContact OD1-OG1 3.42Å; D175-T177 WeakPolarHBondContact OD2-CB 3.18Å; D175-T177 WeakPolarHBondContact OD2-CG2 3.03Å; D175-T177 PolarHBondContact OD2-OG1 3.37Å; D175-V286 HydrophobicContact CB-CG1 3.3Å; D175-V286 WeakPolarHBondContact OD1-CG1 3.08Å; D175-V286 VanDerWaalsContact OD2-CG1 3.26Å; D175-V286 WeakPolarHBondContact OD2-CG1 3.34Å; D175-N287 PolarHBondContact OD2-ND2 2.79Å
176	G	92.4	Very high	88.5	Confident	17 Å²	17	31.1 Å²	31.1	18%	0.175	16%	0.164	C	C	.	.	S	Bend	trans	71.7	12.2	-177.3	0	0	0	0	0	114.7	S173	S173-G176 WeakPolarHBondContact O-CA 3.4Å; S173-G176 PolarHBondContact O-N 2.8Å
177	T	93.5	Very high	88.6	Confident	48 Å²	48	35.4 Å²	35.4	29%	0.294	18%	0.175	S	C	.	.	S	Bend	trans	-85.4	-39	-176.9	61.4	0	0	0	0	112.7	S173 D175 L199 N287	S173-T177 PolarHBondContact OG-N 3.46Å; D175-T177 HydrophobicContact CB-CG2 4.23Å; D175-T177 PolarHBondContact O-N 3.45Å; D175-T177 PolarHBondContact OD1-N 2.99Å; D175-T177 PolarHBondContact OD1-OG1 3.42Å; D175-T177 WeakPolarHBondContact OD2-CB 3.18Å; D175-T177 WeakPolarHBondContact OD2-CG2 3.03Å; D175-T177 PolarHBondContact OD2-OG1 3.37Å; T177-L199 WeakPolarHBondContact O-CB 3.2Å; T177-L199 PolarHBondContact O-N 3.18Å; T177-N287 PolarHBondContact OG1-ND2 3Å
178	Y	95.7	Very high	88.4	Confident	54 Å²	54	36.8 Å²	36.8	21%	0.212	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	155.9	-176.6	-66	-6.9	0	0	0	111.8	I172 S173 L196 Y197 N198 I205 N287	I172-Y178 WeakPolarHBondContact CA-O 3.09Å; S173-Y178 PolarHBondContact N-O 2.95Å; S173-Y178 PolarHBondContact OG-N 3.18Å; S173-Y178 PolarHBondContact OG-O 2.84Å; Y178-L196 HydrophobicContact CD2-CD1 4.2Å; Y178-L196 HydrophobicContact CD2-CD2 4.19Å; Y178-L196 HydrophobicContact CD2-CG 4.38Å; Y178-L196 HydrophobicContact CG-CD1 4.44Å; Y178-Y197 CarbonylContact C-O 3.59Å; Y178-Y197 WeakPolarHBondContact CA-O 3.17Å; Y178-N198 HydrophobicContact CD1-CB 4.14Å; Y178-N198 HydrophobicContact CE1-CB 4.07Å; Y178-I205 HydrophobicContact CD1-CD1 3.63Å; Y178-I205 HydrophobicContact CD2-CD1 3.9Å; Y178-I205 HydrophobicContact CE1-CD1 3.39Å; Y178-I205 HydrophobicContact CE2-CD1 3.67Å; Y178-I205 HydrophobicContact CG-CD1 3.93Å; Y178-I205 VanDerWaalsContact CZ-CD1 3.41Å; Y178-N287 HydrophobicContact CD2-CB 3.54Å; Y178-N287 HydrophobicContact CE2-CB 4.07Å; Y178-N287 HydrophobicContact CG-CB 4Å
179	C	96.3	Very high	87.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	129.1	168	-178.2	0	0	0	0	110.2	V131 K171 Y197 L199	V131-C179 HydrophobicContact CG2-CB 4.36Å; K171-C179 CarbonylContact O-C 3.57Å; K171-C179 VanDerWaalsContact O-CA 3.27Å; K171-C179 WeakPolarHBondContact O-CA 3.38Å; K171-C179 PolarHBondContact O-SG 3.28Å; K171-C179 VanDerWaalsContact O-SG 3.32Å; C179-Y197 PolarHBondContact N-O 3.42Å; C179-Y197 PolarHBondContact O-N 3.42Å; C179-L199 HydrophobicContact CB-CD1 4.05Å; C179-L199 HydrophobicContact CB-CD2 3.61Å; C179-L199 HydrophobicContact CB-CG 3.97Å
180	L	96.9	Very high	86.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.7	173.2	178.6	55.6	0	0	0	109.3	G170 K171 L194 L196 F279 F281 I290 W326	G170-L180 CarbonylContact C-O 3.51Å; G170-L180 VanDerWaalsContact CA-O 3.23Å; G170-L180 WeakPolarHBondContact CA-O 3.24Å; K171-L180 PolarHBondContact N-O 2.88Å; K171-L180 PolarHBondContact O-N 2.52Å; L180-L194 HydrophobicContact CD1-CB 4.07Å; L180-L194 HydrophobicContact CD1-CD2 4.01Å; L180-L194 HydrophobicContact CD2-CD2 4.44Å; L180-L194 HydrophobicContact CG-CD2 4.17Å; L180-L196 HydrophobicContact CB-CD1 4.24Å; L180-L196 HydrophobicContact CD1-CB 4.43Å; L180-F279 HydrophobicContact CB-CD2 4.27Å; L180-F279 HydrophobicContact CB-CE2 3.88Å; L180-F279 HydrophobicContact CD2-CB 4.34Å; L180-F279 HydrophobicContact CD2-CD2 3.51Å; L180-F279 HydrophobicContact CD2-CE2 3.87Å; L180-F279 HydrophobicContact CD2-CG 3.88Å; L180-F279 HydrophobicContact CG-CD2 3.87Å; L180-F279 HydrophobicContact CG-CE2 3.65Å; L180-F279 HydrophobicContact CG-CG 4.45Å; L180-F279 HydrophobicContact CG-CZ 4.12Å; L180-F279 WeakPolarHBondContact O-CE2 3.48Å; L180-F279 WeakPolarHBondContact O-CZ 3.49Å; L180-F281 HydrophobicContact CB-CE2 3.96Å; L180-F281 HydrophobicContact CB-CZ 3.78Å; L180-I290 HydrophobicContact CD2-CD1 3.69Å; L180-I290 HydrophobicContact CD2-CG2 4.4Å; L180-W326 HydrophobicContact CD1-CH2 3.71Å; L180-W326 HydrophobicContact CD2-CH2 4.48Å
181	I	94.5	Very high	86.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127	-178.9	-54.4	-179.2	0	0	0	110	L123 V131 F142 F156 T168 I169 L183 L194 K195 Y197	L123-I181 HydrophobicContact CD1-CD1 4.07Å; L123-I181 HydrophobicContact CD1-CG1 4.4Å; L123-I181 HydrophobicContact CD1-CG2 4.19Å; V131-I181 HydrophobicContact CG1-CD1 4.47Å; F142-I181 HydrophobicContact CB-CD1 4.37Å; F142-I181 HydrophobicContact CD1-CD1 3.98Å; F142-I181 HydrophobicContact CD2-CD1 3.56Å; F142-I181 HydrophobicContact CE1-CD1 4.2Å; F142-I181 HydrophobicContact CE1-CG2 4.2Å; F142-I181 HydrophobicContact CE2-CD1 3.78Å; F142-I181 HydrophobicContact CE2-CG2 4.22Å; F142-I181 HydrophobicContact CG-CD1 3.67Å; F142-I181 HydrophobicContact CZ-CD1 4.1Å; F142-I181 HydrophobicContact CZ-CG2 3.79Å; F156-I181 HydrophobicContact CE2-CD1 3.92Å; F156-I181 HydrophobicContact CZ-CD1 4.46Å; T168-I181 HydrophobicContact CG2-CG2 4.01Å; I169-I181 CarbonylContact O-C 3.52Å; I169-I181 WeakPolarHBondContact O-CA 3.5Å; I181-L183 HydrophobicContact CG2-CD2 3.98Å; I181-L194 CarbonylContact O-C 3.51Å; I181-L194 WeakPolarHBondContact O-CA 3.32Å; I181-K195 PolarHBondContact N-O 2.82Å; I181-K195 PolarHBondContact O-N 2.89Å; I181-Y197 HydrophobicContact CB-CE2 4.38Å; I181-Y197 HydrophobicContact CD1-CD2 3.99Å; I181-Y197 HydrophobicContact CD1-CE2 3.96Å; I181-Y197 HydrophobicContact CG1-CD2 4.25Å; I181-Y197 HydrophobicContact CG1-CE2 4.33Å
182	R	92.2	Very high	85.7	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.4	166.9	-174.8	-173.9	72.4	99.7	4.7	109.5	S167 T168 I169 Y192 I193 L194 V277 F279	S167-R182 PolarHBondContact O-NH2 2.88Å; T168-R182 WeakPolarHBondContact CA-O 3.15Å; I169-R182 PolarHBondContact N-O 2.86Å; I169-R182 VanDerWaalsContact N-O 3.09Å; I169-R182 PolarHBondContact O-N 3.32Å; R182-Y192 HydrophobicContact CG-CD1 4.09Å; R182-Y192 VanDerWaalsContact NH1-CZ 3.28Å; R182-I193 WeakPolarHBondContact CA-O 3.35Å; R182-L194 HydrophobicContact CB-CD2 3.64Å; R182-L194 HydrophobicContact CG-CD2 4.15Å; R182-V277 WeakPolarHBondContact CD-O 3.29Å; R182-V277 PolarHBondContact NE-O 3.25Å; R182-F279 HydrophobicContact CB-CE1 3.75Å; R182-F279 HydrophobicContact CB-CZ 4.36Å
183	L	89	Confident	85.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	154.6	177.3	53.5	108.9	0	0	0	111	F142 Q159 F163 I181 Y192 I193 K195	F142-L183 HydrophobicContact CE2-CD2 4.35Å; F142-L183 HydrophobicContact CZ-CD2 4.29Å; Q159-L183 VanDerWaalsContact NE2-CD1 3.35Å; Q159-L183 VanDerWaalsContact OE1-CD1 3.24Å; F163-L183 HydrophobicContact CD2-CB 4.46Å; F163-L183 HydrophobicContact CE2-CB 4.46Å; F163-L183 HydrophobicContact CE2-CD1 3.96Å; F163-L183 HydrophobicContact CZ-CD1 3.83Å; I181-L183 HydrophobicContact CG2-CD2 3.98Å; L183-Y192 WeakPolarHBondContact O-CA 3.31Å; L183-I193 HydrophobicContact CD1-CG2 3.38Å; L183-I193 HydrophobicContact CG-CG2 3.7Å; L183-I193 PolarHBondContact N-O 2.87Å; L183-I193 PolarHBondContact O-N 2.79Å; L183-K195 HydrophobicContact CD2-CD 4.23Å; L183-K195 HydrophobicContact CD2-CG 4.37Å
184	P	84.1	Confident	85.5	Confident	8 Å²	8	52.4 Å²	52.4	5%	0.052	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	141.4	170.3	-21.8	32.3	0	0	0	111.1	F163 S186 Y192	F163-P184 HydrophobicContact CD1-CB 3.92Å; F163-P184 HydrophobicContact CD1-CG 3.78Å; F163-P184 HydrophobicContact CE1-CB 3.99Å; F163-P184 HydrophobicContact CE1-CG 4.33Å; F163-P184 WeakPolarHBondContact CE1-O 3.48Å; F163-P184 WeakPolarHBondContact CZ-O 3.49Å; P184-S186 PolarHBondContact O-N 2.76Å; P184-Y192 HydrophobicContact CB-CE1 4.49Å; P184-Y192 HydrophobicContact CG-CD1 4.42Å; P184-Y192 HydrophobicContact CG-CE1 3.97Å
185	W	80.1	Confident	85.7	Confident	92 Å²	92	51.7 Å²	51.7	35%	0.348	23%	0.229	S	C	.	.			trans	-68.8	131.5	176.5	-168.1	20.2	0	0	0	110	R187 N188 R189 V191	W185-R187 HydrophobicContact CD2-CB 4.47Å; W185-R187 PolarHBondContact O-N 2.88Å; W185-N188 HydrophobicContact CE3-CB 4.32Å; W185-N188 CarbonylContact O-C 3.58Å; W185-N188 PolarHBondContact O-N 2.95Å; W185-N188 VanDerWaalsContact O-N 3.09Å; W185-R189 PolarHBondContact O-N 3.13Å; W185-V191 HydrophobicContact CB-CB 4.07Å; W185-V191 HydrophobicContact CB-CG1 4.18Å; W185-V191 WeakPolarHBondContact CB-O 3.36Å; W185-V191 HydrophobicContact CD2-CG1 4.33Å; W185-V191 HydrophobicContact CE3-CB 3.84Å; W185-V191 HydrophobicContact CE3-CG1 3.58Å; W185-V191 HydrophobicContact CE3-CG2 4.24Å; W185-V191 HydrophobicContact CZ3-CG1 4.27Å; W185-V191 PolarHBondContact N-O 3.1Å
186	S	74.6	Confident	86.1	Confident	57 Å²	57	48.3 Å²	48.3	40%	0.399	21%	0.211	S	C	.	.	S	Bend	trans	-56.2	-35.8	-176.6	54.8	0	0	0	0	113.4	P184	P184-S186 PolarHBondContact O-N 2.76Å
187	R	72.3	Confident	86.4	Confident	217 Å²	217	47.8 Å²	47.8	82%	0.819	20%	0.203	S	C	*	.	S	Bend	trans	-80.4	-29	179	-65.9	-174.2	177.4	179.2	-0.2	113.4	W185	W185-R187 HydrophobicContact CD2-CB 4.47Å; W185-R187 PolarHBondContact O-N 2.88Å
188	N	71.2	Confident	86.5	Confident	53 Å²	53	47.1 Å²	47.1	28%	0.283	20%	0.198	S	C	.	.			trans	-146.1	102.7	-178.3	-173.1	-17.5	0	0	0	110.1	W185 R190 V191	W185-N188 HydrophobicContact CE3-CB 4.32Å; W185-N188 CarbonylContact O-C 3.58Å; W185-N188 PolarHBondContact O-N 2.95Å; W185-N188 VanDerWaalsContact O-N 3.09Å; N188-R190 PolarHBondContact O-N 2.88Å; N188-R190 VanDerWaalsContact OD1-CB 3.28Å; N188-R190 WeakPolarHBondContact OD1-CB 3.38Å; N188-R190 PolarHBondContact OD1-N 2.86Å; N188-V191 HydrophobicContact CB-CB 4.33Å; N188-V191 HydrophobicContact CB-CG2 4.06Å; N188-V191 PolarHBondContact O-N 2.91Å
189	R	69.6	Low	86.5	Confident	167 Å²	167	45 Å²	45	63%	0.63	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-13	-179.1	-64	-175.2	-179.9	-175.4	0.4	114	W185	W185-R189 PolarHBondContact O-N 3.13Å
190	R	69	Low	86.2	Confident	195 Å²	195	54.1 Å²	54.1	74%	0.736	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-16.2	174.9	-57.9	-176.1	177.4	177.6	0.4	113	N188 N212	N188-R190 PolarHBondContact O-N 2.88Å; N188-R190 VanDerWaalsContact OD1-CB 3.28Å; N188-R190 WeakPolarHBondContact OD1-CB 3.38Å; N188-R190 PolarHBondContact OD1-N 2.86Å; R190-N212 PolarHBondContact O-ND2 2.89Å
191	V	74.7	Confident	86	Confident	17 Å²	17	57.5 Å²	57.5	10%	0.103	24%	0.243	C	C	.	.	S	Bend	trans	-99.8	140.5	177.1	178.9	0	0	0	0	107.4	W185 N188 L210	W185-V191 HydrophobicContact CB-CB 4.07Å; W185-V191 HydrophobicContact CB-CG1 4.18Å; W185-V191 WeakPolarHBondContact CB-O 3.36Å; W185-V191 HydrophobicContact CD2-CG1 4.33Å; W185-V191 HydrophobicContact CE3-CB 3.84Å; W185-V191 HydrophobicContact CE3-CG1 3.58Å; W185-V191 HydrophobicContact CE3-CG2 4.24Å; W185-V191 HydrophobicContact CZ3-CG1 4.27Å; W185-V191 PolarHBondContact N-O 3.1Å; N188-V191 HydrophobicContact CB-CB 4.33Å; N188-V191 HydrophobicContact CB-CG2 4.06Å; N188-V191 PolarHBondContact O-N 2.91Å; V191-L210 VanDerWaalsContact CG1-O 3.3Å; V191-L210 WeakPolarHBondContact CG1-O 3.3Å
192	Y	85.2	Confident	85.9	Confident	47 Å²	47	59.5 Å²	59.5	18%	0.184	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	156.2	172.5	-73.1	-87.4	0	0	0	109.9	R182 L183 P184 L210	R182-Y192 HydrophobicContact CG-CD1 4.09Å; R182-Y192 VanDerWaalsContact NH1-CZ 3.28Å; L183-Y192 WeakPolarHBondContact O-CA 3.31Å; P184-Y192 HydrophobicContact CB-CE1 4.49Å; P184-Y192 HydrophobicContact CG-CD1 4.42Å; P184-Y192 HydrophobicContact CG-CE1 3.97Å; Y192-L210 WeakPolarHBondContact O-CA 3.28Å; Y192-L210 VanDerWaalsContact O-CB 3.24Å; Y192-L210 WeakPolarHBondContact O-CB 3.43Å; Y192-L210 PolarHBondContact O-N 3.47Å
193	I	90.5	Very high	86	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.5	171.6	-170.6	168.1	0	0	0	108.9	R182 L183 K195 E207	R182-I193 WeakPolarHBondContact CA-O 3.35Å; L183-I193 HydrophobicContact CD1-CG2 3.38Å; L183-I193 HydrophobicContact CG-CG2 3.7Å; L183-I193 PolarHBondContact N-O 2.87Å; L183-I193 PolarHBondContact O-N 2.79Å; I193-K195 HydrophobicContact CG1-CG 4.36Å; I193-E207 HydrophobicContact CD1-CB 4.05Å; I193-E207 HydrophobicContact CD1-CG 4.28Å; I193-E207 HydrophobicContact CG1-CB 4.31Å
194	L	94.1	Very high	86.3	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.5	169.4	-77	169.3	0	0	0	109	L180 I181 R182 E207 L208 L210 F279 I292 W326	L180-L194 HydrophobicContact CD1-CB 4.07Å; L180-L194 HydrophobicContact CD1-CD2 4.01Å; L180-L194 HydrophobicContact CD2-CD2 4.44Å; L180-L194 HydrophobicContact CG-CD2 4.17Å; I181-L194 CarbonylContact O-C 3.51Å; I181-L194 WeakPolarHBondContact O-CA 3.32Å; R182-L194 HydrophobicContact CB-CD2 3.64Å; R182-L194 HydrophobicContact CG-CD2 4.15Å; L194-E207 CarbonylContact O-C 3.58Å; L194-E207 WeakPolarHBondContact O-CA 3.49Å; L194-E207 WeakPolarHBondContact O-CB 3.39Å; L194-L208 HydrophobicContact CB-CB 4.3Å; L194-L208 HydrophobicContact CD1-CD2 4.43Å; L194-L208 PolarHBondContact N-O 3.42Å; L194-L208 PolarHBondContact O-N 3.11Å; L194-L210 HydrophobicContact CD1-CD1 4.05Å; L194-L210 HydrophobicContact CD1-CD2 4.15Å; L194-L210 HydrophobicContact CD1-CG 4.46Å; L194-L210 HydrophobicContact CG-CD1 3.97Å; L194-F279 HydrophobicContact CD2-CD1 3.93Å; L194-F279 HydrophobicContact CD2-CE1 3.78Å; L194-F279 HydrophobicContact CD2-CZ 4.39Å; L194-I292 HydrophobicContact CD1-CD1 3.32Å; L194-W326 HydrophobicContact CB-CH2 3.94Å; L194-W326 HydrophobicContact CB-CZ3 4.45Å; L194-W326 HydrophobicContact CD1-CZ3 4.26Å
195	K	95.2	Very high	86.9	Confident	32 Å²	32	71 Å²	71	14%	0.139	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	122	177.9	-67.5	-163	174.2	-163.3	0	110	I181 L183 I193 Y197 L204 E207	I181-K195 PolarHBondContact N-O 2.82Å; I181-K195 PolarHBondContact O-N 2.89Å; L183-K195 HydrophobicContact CD2-CD 4.23Å; L183-K195 HydrophobicContact CD2-CG 4.37Å; I193-K195 HydrophobicContact CG1-CG 4.36Å; K195-Y197 HydrophobicContact CB-CD2 4.26Å; K195-Y197 HydrophobicContact CB-CE2 3.49Å; K195-Y197 VanDerWaalsContact CB-CE2 3.49Å; K195-Y197 HydrophobicContact CD-CE2 4.48Å; K195-Y197 VanDerWaalsContact CD-OH 3.28Å; K195-Y197 WeakPolarHBondContact CD-OH 3.45Å; K195-L204 HydrophobicContact CB-CD1 3.72Å; K195-L204 HydrophobicContact CD-CD1 4.11Å; K195-L204 HydrophobicContact CG-CD1 4.11Å; K195-E207 VanDerWaalsContact CE-OE2 3.27Å; K195-E207 WeakPolarHBondContact CE-OE2 3.29Å; K195-E207 HydrophobicContact CG-CB 4.16Å; K195-E207 IonicContact NZ-OE2 3.61Å
196	L	97.4	Very high	87.7	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	118.1	176.8	-177	68.2	0	0	0	109.2	Y178 L180 I205 S206 F281 L323 P324 W326	Y178-L196 HydrophobicContact CD2-CD1 4.2Å; Y178-L196 HydrophobicContact CD2-CD2 4.19Å; Y178-L196 HydrophobicContact CD2-CG 4.38Å; Y178-L196 HydrophobicContact CG-CD1 4.44Å; L180-L196 HydrophobicContact CB-CD1 4.24Å; L180-L196 HydrophobicContact CD1-CB 4.43Å; L196-I205 HydrophobicContact CD2-CB 4.33Å; L196-I205 HydrophobicContact CD2-CD1 4.24Å; L196-I205 HydrophobicContact CD2-CG2 4.45Å; L196-I205 HydrophobicContact CG-CB 4.39Å; L196-I205 HydrophobicContact CG-CD1 4.17Å; L196-I205 WeakPolarHBondContact O-CB 3.47Å; L196-I205 PolarHBondContact O-N 2.86Å; L196-S206 PolarHBondContact N-O 3.26Å; L196-S206 PolarHBondContact O-N 3.04Å; L196-F281 HydrophobicContact CD1-CZ 4.34Å; L196-L323 HydrophobicContact CD1-CD1 4.05Å; L196-L323 HydrophobicContact CD2-CB 4.14Å; L196-L323 HydrophobicContact CD2-CD1 4.19Å; L196-L323 HydrophobicContact CD2-CD2 4.41Å; L196-L323 HydrophobicContact CD2-CG 4.49Å; L196-P324 HydrophobicContact CD2-CB 4.03Å; L196-W326 HydrophobicContact CB-CZ2 4.33Å
197	Y	97.6	Very high	88.6	Confident	7 Å²	7	69.5 Å²	69.5	3%	0.027	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	146.4	179.4	-64.5	-85.6	0	0	0	111.4	F156 Y178 C179 I181 K195 E203 L204	F156-Y197 AromaticContact CD2-CD1 3.78Å; F156-Y197 HydrophobicContact CD2-CD1 3.78Å; F156-Y197 HydrophobicContact CD2-CD2 4.21Å; F156-Y197 HydrophobicContact CD2-CE1 4.14Å; F156-Y197 AromaticContact CD2-CG 3.81Å; F156-Y197 HydrophobicContact CD2-CG 3.81Å; F156-Y197 HydrophobicContact CE2-CD1 4.31Å; F156-Y197 AromaticContact CE2-CD2 3.96Å; F156-Y197 HydrophobicContact CE2-CD2 3.96Å; F156-Y197 HydrophobicContact CE2-CE2 4.46Å; F156-Y197 AromaticContact CE2-CG 3.86Å; F156-Y197 HydrophobicContact CE2-CG 3.86Å; Y178-Y197 CarbonylContact C-O 3.59Å; Y178-Y197 WeakPolarHBondContact CA-O 3.17Å; C179-Y197 PolarHBondContact N-O 3.42Å; C179-Y197 PolarHBondContact O-N 3.42Å; I181-Y197 HydrophobicContact CB-CE2 4.38Å; I181-Y197 HydrophobicContact CD1-CD2 3.99Å; I181-Y197 HydrophobicContact CD1-CE2 3.96Å; I181-Y197 HydrophobicContact CG1-CD2 4.25Å; I181-Y197 HydrophobicContact CG1-CE2 4.33Å; K195-Y197 HydrophobicContact CB-CD2 4.26Å; K195-Y197 HydrophobicContact CB-CE2 3.49Å; K195-Y197 VanDerWaalsContact CB-CE2 3.49Å; K195-Y197 HydrophobicContact CD-CE2 4.48Å; K195-Y197 VanDerWaalsContact CD-OH 3.28Å; K195-Y197 WeakPolarHBondContact CD-OH 3.45Å; Y197-E203 CarbonylContact C-O 3.49Å; Y197-E203 VanDerWaalsContact CA-O 3.25Å; Y197-E203 WeakPolarHBondContact CA-O 3.34Å; Y197-L204 HydrophobicContact CD1-CB 4.13Å; Y197-L204 HydrophobicContact CD1-CD1 4.14Å; Y197-L204 HydrophobicContact CE1-CB 3.95Å; Y197-L204 HydrophobicContact CE1-CD1 3.8Å; Y197-L204 HydrophobicContact CE1-CG 4.47Å; Y197-L204 HydrophobicContact CE2-CD1 4.42Å
198	N	96	Very high	89.5	Confident	34 Å²	34	60.6 Å²	60.6	18%	0.182	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.3	165.1	-178.4	-16.3	0	0	0	109	Y178 R200 N201 S202 E203 I205	Y178-N198 HydrophobicContact CD1-CB 4.14Å; Y178-N198 HydrophobicContact CE1-CB 4.07Å; N198-R200 VanDerWaalsContact C-N 3.32Å; N198-R200 PolarHBondContact O-N 2.9Å; N198-R200 WeakPolarHBondContact OD1-CB 3.23Å; N198-R200 PolarHBondContact OD1-N 3.38Å; N198-N201 WeakPolarHBondContact CB-OD1 3.34Å; N198-N201 PolarHBondContact ND2-OD1 2.8Å; N198-N201 PolarHBondContact O-OD1 2.79Å; N198-S202 WeakPolarHBondContact O-CA 3.42Å; N198-S202 PolarHBondContact O-N 3.13Å; N198-E203 PolarHBondContact N-O 3.38Å; N198-E203 PolarHBondContact O-N 2.91Å; N198-I205 HydrophobicContact CB-CD1 3.75Å; N198-I205 HydrophobicContact CB-CG1 3.88Å
199	L	94.9	Very high	90.3	Very high	8 Å²	8	61.8 Å²	61.8	4%	0.042	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.4	-176.6	-63.3	-178.3	0	0	0	113.1	L129 V131 L144 F156 I172 T177 C179	L129-L199 HydrophobicContact CD2-CD1 4.01Å; V131-L199 HydrophobicContact CG2-CD1 4.38Å; V131-L199 HydrophobicContact CG2-CD2 4.15Å; L144-L199 HydrophobicContact CD1-CD1 4.15Å; L144-L199 HydrophobicContact CD1-CD2 4.12Å; L144-L199 HydrophobicContact CD2-CB 4.2Å; F156-L199 HydrophobicContact CE1-CD2 4.12Å; F156-L199 HydrophobicContact CZ-CD2 3.84Å; I172-L199 HydrophobicContact CG1-CD1 4.32Å; I172-L199 HydrophobicContact CG2-CD1 4.07Å; T177-L199 WeakPolarHBondContact O-CB 3.2Å; T177-L199 PolarHBondContact O-N 3.18Å; C179-L199 HydrophobicContact CB-CD1 4.05Å; C179-L199 HydrophobicContact CB-CD2 3.61Å; C179-L199 HydrophobicContact CB-CG 3.97Å
200	R	91.6	Very high	90.9	Very high	193 Å²	193	54.5 Å²	54.5	73%	0.728	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-42.8	-179.3	-175.2	178.7	176.6	166.2	-0.7	112.1	N198	N198-R200 VanDerWaalsContact C-N 3.32Å; N198-R200 PolarHBondContact O-N 2.9Å; N198-R200 WeakPolarHBondContact OD1-CB 3.23Å; N198-R200 PolarHBondContact OD1-N 3.38Å
201	N	92.2	Very high	90.6	Very high	71 Å²	71	49 Å²	49	38%	0.38	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-1.4	-179.9	65	-5.9	0	0	0	113	N198 E203	N198-N201 WeakPolarHBondContact CB-OD1 3.34Å; N198-N201 PolarHBondContact ND2-OD1 2.8Å; N198-N201 PolarHBondContact O-OD1 2.79Å; N201-E203 VanDerWaalsContact C-N 3.28Å; N201-E203 HydrophobicContact CB-CG 4.37Å; N201-E203 VanDerWaalsContact ND2-CD 3.26Å; N201-E203 PolarHBondContact ND2-OE2 2.97Å; N201-E203 PolarHBondContact O-N 2.81Å; N201-E203 PolarHBondContact OD1-N 2.94Å
202	S	92.5	Very high	89.5	Confident	41 Å²	41	51.2 Å²	51.2	29%	0.287	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	28.1	178.1	-69.4	0	0	0	0	114.4	N198	N198-S202 WeakPolarHBondContact O-CA 3.42Å; N198-S202 PolarHBondContact O-N 3.13Å
203	E	94.3	Very high	87.4	Confident	116 Å²	116	51 Å²	51	54%	0.542	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	151.8	-176.8	-68.6	178.2	172.3	0	0	113.2	Y197 N198 N201	Y197-E203 CarbonylContact C-O 3.49Å; Y197-E203 VanDerWaalsContact CA-O 3.25Å; Y197-E203 WeakPolarHBondContact CA-O 3.34Å; N198-E203 PolarHBondContact N-O 3.38Å; N198-E203 PolarHBondContact O-N 2.91Å; N201-E203 VanDerWaalsContact C-N 3.28Å; N201-E203 HydrophobicContact CB-CG 4.37Å; N201-E203 VanDerWaalsContact ND2-CD 3.26Å; N201-E203 PolarHBondContact ND2-OE2 2.97Å; N201-E203 PolarHBondContact O-N 2.81Å; N201-E203 PolarHBondContact OD1-N 2.94Å
204	L	96.2	Very high	85.1	Confident	78 Å²	78	55.4 Å²	55.4	41%	0.408	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.3	170.1	-179.9	69.2	0	0	0	109.4	K195 Y197	K195-L204 HydrophobicContact CB-CD1 3.72Å; K195-L204 HydrophobicContact CD-CD1 4.11Å; K195-L204 HydrophobicContact CG-CD1 4.11Å; Y197-L204 HydrophobicContact CD1-CB 4.13Å; Y197-L204 HydrophobicContact CD1-CD1 4.14Å; Y197-L204 HydrophobicContact CE1-CB 3.95Å; Y197-L204 HydrophobicContact CE1-CD1 3.8Å; Y197-L204 HydrophobicContact CE1-CG 4.47Å; Y197-L204 HydrophobicContact CE2-CD1 4.42Å
205	I	96.1	Very high	82.2	Confident	61 Å²	61	61.3 Å²	61.3	31%	0.313	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-51.8	178.7	-51.3	178.2	0	0	0	110.6	Y178 L196 N198 P324	Y178-I205 HydrophobicContact CD1-CD1 3.63Å; Y178-I205 HydrophobicContact CD2-CD1 3.9Å; Y178-I205 HydrophobicContact CE1-CD1 3.39Å; Y178-I205 HydrophobicContact CE2-CD1 3.67Å; Y178-I205 HydrophobicContact CG-CD1 3.93Å; Y178-I205 VanDerWaalsContact CZ-CD1 3.41Å; L196-I205 HydrophobicContact CD2-CB 4.33Å; L196-I205 HydrophobicContact CD2-CD1 4.24Å; L196-I205 HydrophobicContact CD2-CG2 4.45Å; L196-I205 HydrophobicContact CG-CB 4.39Å; L196-I205 HydrophobicContact CG-CD1 4.17Å; L196-I205 WeakPolarHBondContact O-CB 3.47Å; L196-I205 PolarHBondContact O-N 2.86Å; N198-I205 HydrophobicContact CB-CD1 3.75Å; N198-I205 HydrophobicContact CB-CG1 3.88Å; I205-P324 HydrophobicContact CG2-CB 3.83Å; I205-P324 HydrophobicContact CG2-CG 4.34Å
206	S	95.6	Very high	79.3	Confident	21 Å²	21	69 Å²	69	15%	0.147	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	160.2	-178.6	69.9	0	0	0	0	111.5	L196 P324 W326	L196-S206 PolarHBondContact N-O 3.26Å; L196-S206 PolarHBondContact O-N 3.04Å; S206-P324 PolarHBondContact OG-O 2.94Å; S206-P324 VanDerWaalsContact OG-O 3.14Å; S206-W326 PolarHBondContact OG-NE1 3.33Å; S206-W326 VanDerWaalsContact OG-NE1 3.08Å
207	E	93.7	Very high	76.2	Confident	96 Å²	96	76.7 Å²	76.7	45%	0.449	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	150.6	175.7	61.6	179.9	-159.1	0	0	111.7	I193 L194 K195 W326	I193-E207 HydrophobicContact CD1-CB 4.05Å; I193-E207 HydrophobicContact CD1-CG 4.28Å; I193-E207 HydrophobicContact CG1-CB 4.31Å; L194-E207 CarbonylContact O-C 3.58Å; L194-E207 WeakPolarHBondContact O-CA 3.49Å; L194-E207 WeakPolarHBondContact O-CB 3.39Å; K195-E207 VanDerWaalsContact CE-OE2 3.27Å; K195-E207 WeakPolarHBondContact CE-OE2 3.29Å; K195-E207 HydrophobicContact CG-CB 4.16Å; K195-E207 IonicContact NZ-OE2 3.61Å; E207-W326 PolarHBondContact O-NE1 3.16Å
208	L	91.5	Very high	73	Confident	29 Å²	29	85.4 Å²	85.4	15%	0.152	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	109.4	176.9	177.1	68.2	0	0	0	109.2	L194 L210 F297 W326	L194-L208 HydrophobicContact CB-CB 4.3Å; L194-L208 HydrophobicContact CD1-CD2 4.43Å; L194-L208 PolarHBondContact N-O 3.42Å; L194-L208 PolarHBondContact O-N 3.11Å; L208-L210 HydrophobicContact CD2-CD2 4.04Å; L208-L210 HydrophobicContact CG-CD2 4.19Å; L208-F297 HydrophobicContact CD2-CE1 4Å; L208-F297 HydrophobicContact CD2-CZ 4.05Å; L208-W326 HydrophobicContact CB-CD2 3.65Å; L208-W326 HydrophobicContact CB-CE3 3.95Å; L208-W326 HydrophobicContact CB-CG 4.07Å; L208-W326 HydrophobicContact CB-CH2 4.26Å; L208-W326 HydrophobicContact CB-CZ2 3.98Å; L208-W326 HydrophobicContact CB-CZ3 4.23Å; L208-W326 HydrophobicContact CD1-CB 4.32Å; L208-W326 HydrophobicContact CD1-CG 4.31Å; L208-W326 HydrophobicContact CD2-CD2 3.96Å; L208-W326 HydrophobicContact CD2-CE3 3.57Å; L208-W326 HydrophobicContact CD2-CG 4.36Å; L208-W326 HydrophobicContact CD2-CZ3 4.07Å; L208-W326 HydrophobicContact CG-CD2 4.28Å; L208-W326 HydrophobicContact CG-CE3 4.34Å; L208-W326 HydrophobicContact CG-CG 4.48Å
209	P	87.7	Confident	69.9	Low	78 Å²	78	91.5 Å²	91.5	51%	0.506	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	131.3	171.8	28.6	-32.2	0	0	0	110.4
210	L	83.8	Confident	66.8	Low	14 Å²	14	96.7 Å²	96.7	7%	0.073	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	86.3	-179.5	-56	172.6	0	0	0	108.8	V191 Y192 L194 L208 N212 V277 V295	V191-L210 VanDerWaalsContact CG1-O 3.3Å; V191-L210 WeakPolarHBondContact CG1-O 3.3Å; Y192-L210 WeakPolarHBondContact O-CA 3.28Å; Y192-L210 VanDerWaalsContact O-CB 3.24Å; Y192-L210 WeakPolarHBondContact O-CB 3.43Å; Y192-L210 PolarHBondContact O-N 3.47Å; L194-L210 HydrophobicContact CD1-CD1 4.05Å; L194-L210 HydrophobicContact CD1-CD2 4.15Å; L194-L210 HydrophobicContact CD1-CG 4.46Å; L194-L210 HydrophobicContact CG-CD1 3.97Å; L208-L210 HydrophobicContact CD2-CD2 4.04Å; L208-L210 HydrophobicContact CG-CD2 4.19Å; L210-N212 PolarHBondContact O-N 3.24Å; L210-V277 HydrophobicContact CD1-CB 4.18Å; L210-V277 HydrophobicContact CD1-CG1 3.92Å; L210-V277 HydrophobicContact CD1-CG2 4.07Å; L210-V295 HydrophobicContact CD2-CB 4.4Å; L210-V295 HydrophobicContact CD2-CG1 3.76Å; L210-V295 HydrophobicContact CD2-CG2 3.68Å
211	A	61.8	Low	63.9	Low	79 Å²	79	94.4 Å²	94.4	65%	0.653	51%	0.513	S	S	*	.			trans	-66.7	120.6	177.6	0	0	0	0	0	110.3	S213	A211-S213 PolarHBondContact O-N 2.76Å
212	N	51.8	Low	61	Low	64 Å²	64	98 Å²	98	34%	0.342	53%	0.532	S	S	.	.			trans	-72.6	116.7	158.8	-79.5	-11.5	0	0	0	106.2	R190 L210 S214	R190-N212 PolarHBondContact O-ND2 2.89Å; L210-N212 PolarHBondContact O-N 3.24Å; N212-S214 PolarHBondContact O-N 3.06Å
213	S	41.8	Very low	58.1	Low	42 Å²	42	101.4 Å²	101.4	29%	0.294	56%	0.556	S	S	.	*	S	Bend	trans	-66.8	6.4	-176.5	77.7	0	0	0	0	114.6	A211 N215 P312	A211-S213 PolarHBondContact O-N 2.76Å; S213-N215 PolarHBondContact O-N 2.85Å; S213-P312 VanDerWaalsContact CB-CG 3.47Å; S213-P312 WeakPolarHBondContact OG-CB 3.49Å; S213-P312 WeakPolarHBondContact OG-CD 3.32Å; S213-P312 WeakPolarHBondContact OG-CG 3.34Å
214	S	40.6	Very low	55	Low	100 Å²	100	100.9 Å²	100.9	70%	0.699	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	21.4	-177.1	70.3	0	0	0	0	113.6	N212	N212-S214 PolarHBondContact O-N 3.06Å
215	N	33.3	Very low	52	Low	123 Å²	123	109 Å²	109	66%	0.658	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.1	12.5	-174.2	-100.2	8.8	0	0	0	114	S213 D217	S213-N215 PolarHBondContact O-N 2.85Å; N215-D217 PolarHBondContact O-N 2.97Å
216	Y	34.3	Very low	49	Very low	194 Å²	194	113 Å²	113	76%	0.761	62%	0.617	S	S	*	*			trans	-97.3	71	169.3	-77	-79.7	0	0	0	109.6
217	D	32	Very low	46	Very low	161 Å²	161	117 Å²	117	86%	0.861	64%	0.642	S	S	*	*			trans	-161.2	54.9	166.2	-95.3	-26.3	0	0	0	110.2	N215	N215-D217 PolarHBondContact O-N 2.97Å
218	E	32.2	Very low	43.2	Very low	191 Å²	191	121.3 Å²	121.3	89%	0.893	67%	0.668	S	S	*	*			trans	-154.1	78.9	153.4	-78.3	-157.9	159.6	0	0	108.6
219	L	29.4	Very low	40.3	Very low	162 Å²	162	123.3 Å²	123.3	85%	0.848	70%	0.695	S	S	*	*			trans	-102	113.9	159	-89.3	162.3	0	0	0	107.2	I221	L219-I221 PolarHBondContact O-N 3Å
220	P	31	Very low	37.4	Very low	116 Å²	116	127.3 Å²	127.3	75%	0.753	71%	0.711	S	S	*	*			trans	-73.3	119	163.6	24	-17.7	0	0	0	108.1
221	I	30.3	Very low	34.8	Very low	146 Å²	146	136.3 Å²	136.3	75%	0.749	75%	0.746	S	S	*	*			trans	-54.7	141.8	170.2	-66.6	161.7	0	0	0	109.3	L219	L219-I221 PolarHBondContact O-N 3Å
222	N	31.6	Very low	33.4	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	75%	0.75	S	S	*	*			trans	79.7	131.8	178.6	-49.6	-31.3	0	0	0	114.6
223	S	31.7	Very low	32.4	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	77%	0.769	S	S	*	*			cis	-155.3	147.2	20.5	-155.7	0	0	0	0	110.8
224	S	29.7	Very low	32	Very low	105 Å²	105	150 Å²	150	73%	0.734	79%	0.789	S	S	*	*			trans	-44.9	129.2	171	44.3	0	0	0	0	115.7
225	R	32.9	Very low	31.6	Very low	247 Å²	247	151.4 Å²	151.4	93%	0.932	79%	0.789	S	S	*	*				-174.9	130.7	123.3	-99.6	169.6	-166.6	177.8	4.7	111.7
226	V	32.3	Very low	31.5	Very low	146 Å²	146	155.6 Å²	155.6	89%	0.885	80%	0.796	S	S	*	*			trans	-84.9	162.4	-174.6	160.3	0	0	0	0	111.3
227	P	32.2	Very low	31.3	Very low	104 Å²	104	154.4 Å²	154.4	68%	0.675	80%	0.797	S	S	*	*			trans	-115.7	167.3	-152.6	40.8	-28.1	0	0	0	115.6
228	L	35.6	Very low	31.4	Very low	188 Å²	188	151.8 Å²	151.8	98%	0.984	79%	0.792	S	S	*	*			trans	-162.6	143.2	160.2	-83.7	112.7	0	0	0	106.6
229	G	30.4	Very low	31.4	Very low	71 Å²	71	149.9 Å²	149.9	73%	0.732	79%	0.787	S	S	*	*			cis	163.3	134	1.1	0	0	0	0	0	108.1
230	L	26	Very low	31.7	Very low	161 Å²	161	149.7 Å²	149.7	84%	0.843	79%	0.785	S	S	*	*			trans	52.3	153.5	149.4	-90.8	146.2	0	0	0	124.8
231	Y	30.6	Very low	31.7	Very low	203 Å²	203	155.5 Å²	155.5	80%	0.796	79%	0.792	S	S	*	*			trans	89.8	138.4	170	-67.7	-90.8	0	0	0	116.7
232	Q	31.3	Very low	31.7	Very low	159 Å²	159	153.7 Å²	153.7	74%	0.743	79%	0.79	S	S	*	*			cis	-172.3	156.3	-8.9	-178.8	170.2	0.8	0	0	107
233	E	30.3	Very low	31.9	Very low	158 Å²	158	152.3 Å²	152.3	74%	0.738	79%	0.792	S	S	*	*			trans	-54.1	148.9	178.5	-60.6	174	133.6	0	0	115.8
234	H	34.4	Very low	31.7	Very low	155 Å²	155	156.6 Å²	156.6	72%	0.718	79%	0.793	S	S	*	*				177.1	121.9	118.7	-95.3	-26.4	0	0	0	115.2
235	N	31.2	Very low	32	Very low	130 Å²	130	159.3 Å²	159.3	70%	0.695	80%	0.799	S	S	*	*				66.9	136.5	124.5	-79.9	-24.7	0	0	0	125
236	R	31.7	Very low	31.9	Very low	211 Å²	211	154.9 Å²	154.9	80%	0.796	79%	0.792	S	S	*	*			trans	86.8	103.3	147.8	-73.8	177.4	172.1	163.8	1.1	118
237	E	30.3	Very low	32	Very low	169 Å²	169	155.9 Å²	155.9	79%	0.79	79%	0.792	S	S	*	*				79.8	104.6	81.7	-86.2	177.8	154.1	0	0	113.2
238	S	35.2	Very low	31.7	Very low	107 Å²	107	156.1 Å²	156.1	75%	0.748	80%	0.796	S	S	*	*			trans	176.5	107.5	130	57	0	0	0	0	112.7
239	N	31.7	Very low	31.5	Very low	150 Å²	150	154 Å²	154	80%	0.802	79%	0.79	S	S	*	*				64.7	130.6	118.5	-69.7	-25.1	0	0	0	123.4
240	I	36	Very low	31.4	Very low	158 Å²	158	155.5 Å²	155.5	81%	0.81	79%	0.79	S	S	*	*			trans	105.2	89.4	145.3	-58.2	143.5	0	0	0	118.3
241	R	29.7	Very low	31.8	Very low	238 Å²	238	156.1 Å²	156.1	90%	0.898	79%	0.794	S	S	*	*				58.8	135.2	120.3	-148	167.8	-170.6	-176.1	2.3	121
242	P	31.9	Very low	31.7	Very low	108 Å²	108	151 Å²	151	70%	0.701	79%	0.788	S	S	*	*			trans	-95.7	153.3	-167.2	38.3	-32.8	0	0	0	113.7
243	S	34.4	Very low	32	Very low	118 Å²	118	150.7 Å²	150.7	83%	0.825	80%	0.796	S	S	*	*			trans	-133.9	128.7	162.3	-144.6	0	0	0	0	109.9
244	Y	28.1	Very low	32	Very low	203 Å²	203	149.3 Å²	149.3	80%	0.796	79%	0.794	S	S	*	*			trans	-74.1	135.4	168.6	-55.5	-95.6	0	0	0	107.5
245	D	35.2	Very low	32	Very low	162 Å²	162	147 Å²	147	87%	0.866	80%	0.802	S	S	*	*			trans	-158.8	140.6	145.2	-93.4	-34.2	0	0	0	111.6
246	I	31.5	Very low	32.1	Very low	154 Å²	154	147.3 Å²	147.3	79%	0.79	80%	0.804	S	S	*	*			trans	-71	133.4	-179.3	-66.3	154.6	0	0	0	109
247	L	34.3	Very low	32.2	Very low	167 Å²	167	146 Å²	146	87%	0.874	81%	0.811	S	S	*	*			trans	-176.3	126.5	138.2	-105.1	135.4	0	0	0	112.5
248	S	26	Very low	32.1	Very low	109 Å²	109	150 Å²	150	76%	0.762	82%	0.819	S	S	*	*			trans	-59.2	138.7	169.7	-53.1	0	0	0	0	111.9
249	T	32.1	Very low	31.9	Very low	142 Å²	142	148.6 Å²	148.6	87%	0.871	82%	0.821	S	S	*	*			trans	-160.7	126.2	145	6.7	0	0	0	0	110.9
250	S	28.8	Very low	31.7	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	83%	0.825	S	S	*	*			trans	-64.3	149.8	175.9	42.6	0	0	0	0	113.5
251	N	33.4	Very low	31.4	Very low	174 Å²	174	147.2 Å²	147.2	93%	0.93	82%	0.819	S	S	*	*			trans	-141.6	121.7	145	-92.3	-25.2	0	0	0	110.4
252	S	29.4	Very low	31.3	Very low	97 Å²	97	144.1 Å²	144.1	68%	0.678	82%	0.815	S	S	*	*			trans	-87.7	150.6	-178.7	53.6	0	0	0	0	112.5
253	V	36	Very low	30.9	Very low	151 Å²	151	146.3 Å²	146.3	92%	0.915	82%	0.821	S	S	*	*			trans	-133	117.8	146.5	-179.7	0	0	0	0	108.3
254	N	31.3	Very low	30.7	Very low	130 Å²	130	147.9 Å²	147.9	70%	0.695	82%	0.815	S	S	*	*			trans	-76.4	149.9	-179.2	-81	-34.8	0	0	0	112.7
255	A	34.7	Very low	30.6	Very low	105 Å²	105	146.6 Å²	146.6	87%	0.868	82%	0.822	S	S	*	*			trans	-147.3	108.8	141.8	0	0	0	0	0	109.4
256	N	32.4	Very low	30.2	Very low	138 Å²	138	145 Å²	145	74%	0.738	81%	0.809	S	S	*	*			trans	-75.2	140.4	177	-75.6	-52.6	0	0	0	111.5
257	L	34.4	Very low	30	Very low	182 Å²	182	145 Å²	145	95%	0.953	81%	0.81	S	S	*	*			trans	-150.4	106.7	144.3	-106.7	144.8	0	0	0	108.9
258	R	27	Very low	29.5	Very low	255 Å²	255	146.6 Å²	146.6	96%	0.962	81%	0.813	S	S	*	*			trans	-95.4	124.3	-179	-165.8	-173.1	-148.6	-139.7	6.8	107.5
259	G	32.3	Very low	29.5	Very low	76 Å²	76	148.9 Å²	148.9	78%	0.784	82%	0.816	S	S	*	*			trans	-150.1	126	174.3	0	0	0	0	0	109.8
260	N	26.3	Very low	29.1	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	80%	0.802	S	S	*	*			trans	-84.9	174.1	-161.6	-135.9	-9.4	0	0	0	112.7
261	V	30.7	Very low	29.1	Very low	115 Å²	115	146.1 Å²	146.1	70%	0.697	81%	0.809	S	S	*	*			trans	106.8	94.5	153.3	-165	0	0	0	0	118.4
262	Q	27.2	Very low	28.9	Very low	174 Å²	174	142.2 Å²	142.2	81%	0.813	80%	0.801	S	S	*	*				54	131.6	128	-58	-178.7	-17	0	0	122.6
263	N	24.6	Very low	29.6	Very low	154 Å²	154	146.7 Å²	146.7	82%	0.824	80%	0.802	S	S	*	*			trans	69.2	91.9	154.1	-75.2	-16.8	0	0	0	119.3
264	E	29.1	Very low	30.4	Very low	150 Å²	150	142.1 Å²	142.1	70%	0.701	78%	0.777	S	S	*	*			trans	-143	94.7	146.2	-78.7	-145.5	127.7	0	0	112	Q266	E264-Q266 PolarHBondContact O-N 3.39Å; E264-Q266 VanDerWaalsContact O-N 3.11Å; E264-Q266 PolarHBondContact OE1-NE2 3.01Å
265	N	25.4	Very low	32	Very low	177 Å²	177	136.5 Å²	136.5	95%	0.947	75%	0.748	S	S	*	*			trans	-73.4	76.3	150.1	-82.7	-28.4	0	0	0	107.9
266	Q	27	Very low	34	Very low	128 Å²	128	135.7 Å²	135.7	60%	0.598	73%	0.726	S	S	*	*			trans	-139.4	108.5	172.1	-74.6	-160.8	64.1	0	0	111.5	E264 Q268	E264-Q266 PolarHBondContact O-N 3.39Å; E264-Q266 VanDerWaalsContact O-N 3.11Å; E264-Q266 PolarHBondContact OE1-NE2 3.01Å; Q266-Q268 PolarHBondContact O-N 2.92Å
267	L	26.7	Very low	36.6	Very low	155 Å²	155	129.7 Å²	129.7	81%	0.812	70%	0.695	S	S	*	*			trans	29.9	81.4	146.2	-70	154.3	0	0	0	117.7	L269	L267-L269 HydrophobicContact CB-CD1 4.44Å; L267-L269 PolarHBondContact O-N 3.28Å
268	Q	24.2	Very low	39.3	Very low	200 Å²	200	121.8 Å²	121.8	94%	0.935	65%	0.653	S	S	*	*			trans	-71.4	91.7	159.9	-77.8	-172.6	-5	0	0	110.4	Q266 G270	Q266-Q268 PolarHBondContact O-N 2.92Å; Q268-G270 PolarHBondContact O-N 2.81Å
269	L	25.9	Very low	42.5	Very low	156 Å²	156	110.1 Å²	110.1	82%	0.817	61%	0.61	S	S	*	*			trans	-69.3	102.6	159.7	-90.8	93.4	0	0	0	108.8	L267	L267-L269 HydrophobicContact CB-CD1 4.44Å; L267-L269 PolarHBondContact O-N 3.28Å
270	G	23.6	Very low	45.5	Very low	57 Å²	57	107 Å²	107	59%	0.588	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-60.5	156.6	168.8	0	0	0	0	0	112.1	Q268 A272	Q268-G270 PolarHBondContact O-N 2.81Å; G270-A272 PolarHBondContact O-N 2.76Å
271	P	29.1	Very low	48.8	Very low	131 Å²	131	100 Å²	100	85%	0.851	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-57.3	124.1	-173.2	23.4	-32.3	0	0	0	110.4	R273	P271-R273 PolarHBondContact O-N 2.93Å; P271-R273 VanDerWaalsContact O-N 3.09Å
272	A	28.8	Very low	51.8	Low	92 Å²	92	94.6 Å²	94.6	76%	0.76	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-52.1	117.7	179.9	0	0	0	0	0	109.7	G270 S274	G270-A272 PolarHBondContact O-N 2.76Å; A272-S274 PolarHBondContact O-N 3Å
273	R	45.5	Very low	54.7	Low	190 Å²	190	88.3 Å²	88.3	72%	0.717	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-52.3	117.5	174.2	-69.1	-177.5	175.6	-170.9	-3.3	108.2	P271 S275	P271-R273 PolarHBondContact O-N 2.93Å; P271-R273 VanDerWaalsContact O-N 3.09Å; R273-S275 PolarHBondContact O-N 2.05Å
274	S	52.6	Low	57.6	Low	55 Å²	55	83.8 Å²	83.8	39%	0.385	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-50	131.2	174.7	56.7	0	0	0	0	109.4	A272 Q276	A272-S274 PolarHBondContact O-N 3Å; S274-Q276 PolarHBondContact O-N 3.28Å
275	S	63.8	Low	60.5	Low	13 Å²	13	79.5 Å²	79.5	9%	0.091	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-53.2	134.3	179	-58.9	0	0	0	0	110.2	R273 N294 R405	R273-S275 PolarHBondContact O-N 2.05Å; S275-N294 WeakPolarHBondContact CB-ND2 3.37Å; S275-R405 PolarHBondContact OG-NH1 3.18Å
276	Q	76.6	Confident	63.4	Low	87 Å²	87	73.3 Å²	73.3	41%	0.407	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-65.9	140.1	-176.1	-67.4	-176.8	-10.5	0	0	110.9	S274 T293 N294	S274-Q276 PolarHBondContact O-N 3.28Å; Q276-T293 PolarHBondContact O-OG1 2.71Å; Q276-N294 PolarHBondContact O-ND2 2.82Å
277	V	87.6	Confident	66.4	Low	13 Å²	13	68.8 Å²	68.8	8%	0.079	38%	0.379	C	S	.	.			trans	-85.7	114.2	171.2	175.3	0	0	0	0	108.5	R182 L210 I292 V295	R182-V277 WeakPolarHBondContact CD-O 3.29Å; R182-V277 PolarHBondContact NE-O 3.25Å; L210-V277 HydrophobicContact CD1-CB 4.18Å; L210-V277 HydrophobicContact CD1-CG1 3.92Å; L210-V277 HydrophobicContact CD1-CG2 4.07Å; V277-I292 HydrophobicContact CG1-CD1 3.9Å; V277-I292 HydrophobicContact CG1-CG1 3.85Å; V277-V295 HydrophobicContact CB-CG2 4.49Å; V277-V295 HydrophobicContact CG1-CG2 3.71Å; V277-V295 HydrophobicContact CG2-CG2 3.94Å
278	L	91.1	Very high	69.5	Low	15 Å²	15	63.4 Å²	63.4	8%	0.079	35%	0.354	C	S	.	.			trans	-113.2	151.3	179.1	-58.3	168.4	0	0	0	108.6	I169 I292 T293 I385 I388	I169-L278 HydrophobicContact CD1-CD2 4.41Å; L278-I292 CarbonylContact O-C 3.59Å; L278-I292 WeakPolarHBondContact O-CA 3.14Å; L278-T293 HydrophobicContact CB-CG2 4.29Å; L278-T293 WeakPolarHBondContact CB-OG1 3.33Å; L278-T293 PolarHBondContact N-OG1 3.15Å; L278-T293 PolarHBondContact O-N 3.03Å; L278-T293 PolarHBondContact O-OG1 2.83Å; L278-I385 HydrophobicContact CD1-CB 4.36Å; L278-I385 HydrophobicContact CD1-CG2 3.82Å; L278-I385 WeakPolarHBondContact CD1-O 3.11Å; L278-I388 HydrophobicContact CB-CG1 4.15Å
279	F	95	Very high	72.8	Confident	11 Å²	11	54.8 Å²	54.8	5%	0.048	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	152.6	-178.9	52.5	-87.6	0	0	0	111.4	I169 K171 L180 R182 L194 A291 I292	I169-F279 HydrophobicContact CG2-CE1 4.41Å; I169-F279 HydrophobicContact CG2-CZ 4.24Å; K171-F279 HydrophobicContact CB-CD2 4.1Å; K171-F279 HydrophobicContact CB-CE2 3.69Å; K171-F279 HydrophobicContact CG-CD2 3.93Å; K171-F279 HydrophobicContact CG-CE2 3.64Å; L180-F279 HydrophobicContact CB-CD2 4.27Å; L180-F279 HydrophobicContact CB-CE2 3.88Å; L180-F279 HydrophobicContact CD2-CB 4.34Å; L180-F279 HydrophobicContact CD2-CD2 3.51Å; L180-F279 HydrophobicContact CD2-CE2 3.87Å; L180-F279 HydrophobicContact CD2-CG 3.88Å; L180-F279 HydrophobicContact CG-CD2 3.87Å; L180-F279 HydrophobicContact CG-CE2 3.65Å; L180-F279 HydrophobicContact CG-CG 4.45Å; L180-F279 HydrophobicContact CG-CZ 4.12Å; L180-F279 WeakPolarHBondContact O-CE2 3.48Å; L180-F279 WeakPolarHBondContact O-CZ 3.49Å; R182-F279 HydrophobicContact CB-CE1 3.75Å; R182-F279 HydrophobicContact CB-CZ 4.36Å; L194-F279 HydrophobicContact CD2-CD1 3.93Å; L194-F279 HydrophobicContact CD2-CE1 3.78Å; L194-F279 HydrophobicContact CD2-CZ 4.39Å; F279-A291 CarbonylContact C-O 3.52Å; F279-A291 WeakPolarHBondContact CA-O 3.41Å; F279-A291 WeakPolarHBondContact CB-O 3.42Å; F279-I292 HydrophobicContact CB-CG1 4.41Å
280	A	95.2	Very high	76.2	Confident	11 Å²	11	47.4 Å²	47.4	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	138.3	174.2	0	0	0	0	0	110.2	I290 A291 I388 Y390	A280-I290 CarbonylContact O-C 3.51Å; A280-I290 WeakPolarHBondContact O-CA 3.28Å; A280-I290 WeakPolarHBondContact O-CB 3.36Å; A280-A291 PolarHBondContact N-O 3.19Å; A280-A291 PolarHBondContact O-N 3.34Å; A280-I388 HydrophobicContact CB-CD1 4.2Å; A280-I388 HydrophobicContact CB-CG1 4.17Å; A280-Y390 HydrophobicContact CB-CD2 3.96Å; A280-Y390 HydrophobicContact CB-CE2 4Å; A280-Y390 WeakPolarHBondContact O-CE2 3.48Å
281	F	95.2	Very high	79.6	Confident	17 Å²	17	44.7 Å²	44.7	8%	0.075	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	136.9	171.2	-74.6	-83	0	0	0	110.9	K171 P174 L180 L196 P283 V286 I290 L323 Y390	K171-F281 HydrophobicContact CB-CD2 4.04Å; K171-F281 HydrophobicContact CB-CE2 3.98Å; K171-F281 WeakPolarHBondContact O-CE2 3.31Å; P174-F281 HydrophobicContact CG-CB 4.15Å; L180-F281 HydrophobicContact CB-CE2 3.96Å; L180-F281 HydrophobicContact CB-CZ 3.78Å; L196-F281 HydrophobicContact CD1-CZ 4.34Å; F281-P283 WeakPolarHBondContact O-CD 3.49Å; F281-V286 WeakPolarHBondContact CD1-O 3.38Å; F281-I290 HydrophobicContact CD1-CG2 3.58Å; F281-I290 HydrophobicContact CE1-CG2 3.78Å; F281-I290 HydrophobicContact CG-CG2 4.07Å; F281-I290 HydrophobicContact CZ-CG2 4.4Å; F281-L323 HydrophobicContact CE1-CD1 3.72Å; F281-L323 HydrophobicContact CZ-CD1 4.4Å; F281-Y390 WeakPolarHBondContact O-CD2 3.44Å
282	D	93.3	Very high	82.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.			trans	-77.1	117	171.6	-172.8	-36.1	0	0	0	109.4	R284 F285 V286 R289 Y390	D282-R284 PolarHBondContact O-N 2.81Å; D282-R284 VanDerWaalsContact O-N 3.08Å; D282-R284 WeakPolarHBondContact OD1-CB 3.28Å; D282-R284 IonicContact OD1-CZ 3.37Å; D282-R284 PolarHBondContact OD1-N 2.86Å; D282-R284 IonicContact OD1-NE 3.58Å; D282-R284 PolarHBondContact OD1-NE 3.45Å; D282-R284 VanDerWaalsContact OD1-NE 3.16Å; D282-R284 IonicContact OD1-NH2 3.07Å; D282-R284 IonicContact OD2-CZ 3.69Å; D282-R284 IonicContact OD2-NE 2.92Å; D282-R284 PolarHBondContact OD2-NE 2.99Å; D282-R284 IonicContact OD2-NH2 3.5Å; D282-R284 PolarHBondContact OD2-NH2 3.44Å; D282-F285 HydrophobicContact CB-CB 4.35Å; D282-F285 HydrophobicContact CB-CD2 4.27Å; D282-F285 CarbonylContact O-C 3.6Å; D282-F285 PolarHBondContact O-N 3.04Å; D282-V286 PolarHBondContact O-N 2.85Å; D282-R289 HydrophobicContact CB-CB 4.37Å; D282-R289 PolarHBondContact N-O 3.46Å; D282-R289 IonicContact OD2-CZ 3.85Å; D282-R289 IonicContact OD2-NE 3.19Å; D282-R289 PolarHBondContact OD2-NE 3.17Å; D282-R289 IonicContact OD2-NH2 2.84Å; D282-R289 PolarHBondContact OD2-NH2 3.3Å; D282-Y390 HydrophobicContact CB-CE1 4.03Å; D282-Y390 HydrophobicContact CB-CE2 4.08Å
283	P	88.3	Confident	85.8	Confident	43 Å²	43	34.1 Å²	34.1	28%	0.279	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.6	-176.4	25.9	-34.4	0	0	0	114.2	P174 F281	P174-P283 HydrophobicContact CG-CB 4.43Å; F281-P283 WeakPolarHBondContact O-CD 3.49Å
284	R	86.6	Confident	87.7	Confident	59 Å²	59	26.4 Å²	26.4	22%	0.223	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-27.7	177.5	-59.8	171	-64.4	167.5	-1.7	112.7	D282 D393 G394 S497 D498	D282-R284 PolarHBondContact O-N 2.81Å; D282-R284 VanDerWaalsContact O-N 3.08Å; D282-R284 WeakPolarHBondContact OD1-CB 3.28Å; D282-R284 IonicContact OD1-CZ 3.37Å; D282-R284 PolarHBondContact OD1-N 2.86Å; D282-R284 IonicContact OD1-NE 3.58Å; D282-R284 PolarHBondContact OD1-NE 3.45Å; D282-R284 VanDerWaalsContact OD1-NE 3.16Å; D282-R284 IonicContact OD1-NH2 3.07Å; D282-R284 IonicContact OD2-CZ 3.69Å; D282-R284 IonicContact OD2-NE 2.92Å; D282-R284 PolarHBondContact OD2-NE 2.99Å; D282-R284 IonicContact OD2-NH2 3.5Å; D282-R284 PolarHBondContact OD2-NH2 3.44Å; R284-D393 VanDerWaalsContact CD-O 3.27Å; R284-D393 WeakPolarHBondContact CD-O 3.32Å; R284-D393 WeakPolarHBondContact CG-O 3.27Å; R284-G394 PolarHBondContact NE-O 3.42Å; R284-G394 VanDerWaalsContact NE-O 3.07Å; R284-G394 PolarHBondContact NH2-O 3.31Å; R284-G394 VanDerWaalsContact NH2-O 3.1Å; R284-S497 PolarHBondContact NH2-OG 2.82Å; R284-D498 IonicContact CZ-OD1 2.82Å; R284-D498 IonicContact CZ-OD2 3.52Å; R284-D498 VanDerWaalsContact NH1-CG 3.32Å; R284-D498 IonicContact NH1-OD1 3.64Å; R284-D498 PolarHBondContact NH1-OD1 2.88Å; R284-D498 VanDerWaalsContact NH1-OD1 3.13Å; R284-D498 IonicContact NH1-OD2 3.13Å; R284-D498 PolarHBondContact NH1-OD2 3.34Å; R284-D498 IonicContact NH2-OD1 3.69Å; R284-D498 PolarHBondContact NH2-OD1 3.02Å; R284-D498 IonicContact NH2-OD2 3.96Å
285	F	88.5	Confident	89.1	Confident	59 Å²	59	24.5 Å²	24.5	26%	0.259	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	2.3	-176.9	-70.3	-94.2	0	0	0	112	D282 N287 S288 R289	D282-F285 HydrophobicContact CB-CB 4.35Å; D282-F285 HydrophobicContact CB-CD2 4.27Å; D282-F285 CarbonylContact O-C 3.6Å; D282-F285 PolarHBondContact O-N 3.04Å; F285-N287 PolarHBondContact O-N 2.98Å; F285-S288 PolarHBondContact O-N 2.79Å; F285-S288 PolarHBondContact O-OG 3.38Å; F285-R289 HydrophobicContact CB-CB 3.55Å; F285-R289 HydrophobicContact CD1-CB 4.38Å; F285-R289 VanDerWaalsContact CD2-NE 3.32Å; F285-R289 VanDerWaalsContact CD2-NH2 3.32Å; F285-R289 HydrophobicContact CG-CB 3.9Å
286	V	87.3	Confident	89.7	Confident	48 Å²	48	27.5 Å²	27.5	29%	0.291	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-101.2	174	-170.9	0	0	0	0	109.8	P174 D175 F281 D282	P174-V286 WeakPolarHBondContact CD-O 3.05Å; D175-V286 HydrophobicContact CB-CG1 3.3Å; D175-V286 WeakPolarHBondContact OD1-CG1 3.08Å; D175-V286 VanDerWaalsContact OD2-CG1 3.26Å; D175-V286 WeakPolarHBondContact OD2-CG1 3.34Å; F281-V286 WeakPolarHBondContact CD1-O 3.38Å; D282-V286 PolarHBondContact O-N 2.85Å
287	N	90.6	Very high	89.6	Confident	32 Å²	32	24.7 Å²	24.7	17%	0.171	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-1.4	-175.6	64.1	6.3	0	0	0	113.5	D175 T177 Y178 F285	D175-N287 PolarHBondContact OD2-ND2 2.79Å; T177-N287 PolarHBondContact OG1-ND2 3Å; Y178-N287 HydrophobicContact CD2-CB 3.54Å; Y178-N287 HydrophobicContact CE2-CB 4.07Å; Y178-N287 HydrophobicContact CG-CB 4Å; F285-N287 PolarHBondContact O-N 2.98Å
288	S	91.1	Very high	88.3	Confident	43 Å²	43	30.3 Å²	30.3	30%	0.301	17%	0.167	S	C	.	.	S	Bend	trans	-97.8	-8	-170.9	66.6	0	0	0	0	114.7	F285 K322 L323	F285-S288 PolarHBondContact O-N 2.79Å; F285-S288 PolarHBondContact O-OG 3.38Å; S288-K322 CarbonylContact O-C 3.56Å; S288-K322 WeakPolarHBondContact O-CA 3.12Å; S288-L323 PolarHBondContact O-N 3.09Å
289	R	93.3	Very high	86.5	Confident	19 Å²	19	35.1 Å²	35.1	7%	0.072	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	139.7	178.1	-169.8	167.5	74.2	173.4	10.7	112.2	D282 F285 V321 L329 D498	D282-R289 HydrophobicContact CB-CB 4.37Å; D282-R289 PolarHBondContact N-O 3.46Å; D282-R289 IonicContact OD2-CZ 3.85Å; D282-R289 IonicContact OD2-NE 3.19Å; D282-R289 PolarHBondContact OD2-NE 3.17Å; D282-R289 IonicContact OD2-NH2 2.84Å; D282-R289 PolarHBondContact OD2-NH2 3.3Å; F285-R289 HydrophobicContact CB-CB 3.55Å; F285-R289 HydrophobicContact CD1-CB 4.38Å; F285-R289 VanDerWaalsContact CD2-NE 3.32Å; F285-R289 VanDerWaalsContact CD2-NH2 3.32Å; F285-R289 HydrophobicContact CG-CB 3.9Å; R289-V321 WeakPolarHBondContact CA-O 3.21Å; R289-L329 VanDerWaalsContact CD-CD1 3.46Å; R289-L329 HydrophobicContact CG-CD1 4.05Å; R289-D498 IonicContact CZ-OD1 2.88Å; R289-D498 IonicContact NH1-OD1 3.93Å; R289-D498 PolarHBondContact NH1-OD1 3.06Å; R289-D498 IonicContact NH2-OD1 3.41Å; R289-D498 PolarHBondContact NH2-OD1 3.19Å
290	I	96.7	Very high	83.9	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	155.3	173.7	62.7	172.8	0	0	0	110.8	L180 A280 F281 I292 L320 V321 L323 W326	L180-I290 HydrophobicContact CD2-CD1 3.69Å; L180-I290 HydrophobicContact CD2-CG2 4.4Å; A280-I290 CarbonylContact O-C 3.51Å; A280-I290 WeakPolarHBondContact O-CA 3.28Å; A280-I290 WeakPolarHBondContact O-CB 3.36Å; F281-I290 HydrophobicContact CD1-CG2 3.58Å; F281-I290 HydrophobicContact CE1-CG2 3.78Å; F281-I290 HydrophobicContact CG-CG2 4.07Å; F281-I290 HydrophobicContact CZ-CG2 4.4Å; I290-I292 HydrophobicContact CD1-CB 4.37Å; I290-L320 WeakPolarHBondContact O-CA 3.45Å; I290-V321 HydrophobicContact CG1-CB 3.99Å; I290-V321 PolarHBondContact N-O 3.43Å; I290-V321 PolarHBondContact O-N 3.24Å; I290-L323 HydrophobicContact CD1-CD2 4.27Å; I290-L323 HydrophobicContact CG1-CG 4.45Å; I290-L323 HydrophobicContact CG2-CD1 3.56Å; I290-L323 HydrophobicContact CG2-CG 4.28Å; I290-W326 HydrophobicContact CD1-CZ3 4.01Å
291	A	96.2	Very high	80.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	141.2	152	0	0	0	0	0	108.6	F279 A280 I318 S319 L320 I388 Y390 L397	F279-A291 CarbonylContact C-O 3.52Å; F279-A291 WeakPolarHBondContact CA-O 3.41Å; F279-A291 WeakPolarHBondContact CB-O 3.42Å; A280-A291 PolarHBondContact N-O 3.19Å; A280-A291 PolarHBondContact O-N 3.34Å; A291-I318 HydrophobicContact CB-CG2 4.49Å; A291-S319 CarbonylContact C-O 3.52Å; A291-S319 WeakPolarHBondContact CA-O 3.13Å; A291-L320 HydrophobicContact CB-CD2 3.99Å; A291-I388 HydrophobicContact CB-CD1 4.04Å; A291-Y390 HydrophobicContact CB-CE2 3.94Å; A291-Y390 VanDerWaalsContact CB-OH 3.24Å; A291-Y390 WeakPolarHBondContact CB-OH 3.36Å; A291-Y390 PolarHBondContact N-OH 2.73Å; A291-L397 HydrophobicContact CB-CD1 3.92Å; A291-L397 HydrophobicContact CB-CD2 3.74Å
292	I	94.8	Very high	77.9	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.2	177.2	-171.3	168.9	0	0	0	110.3	L194 V277 L278 F279 I290 V295 F297 I318 S319 V321	L194-I292 HydrophobicContact CD1-CD1 3.32Å; V277-I292 HydrophobicContact CG1-CD1 3.9Å; V277-I292 HydrophobicContact CG1-CG1 3.85Å; L278-I292 CarbonylContact O-C 3.59Å; L278-I292 WeakPolarHBondContact O-CA 3.14Å; F279-I292 HydrophobicContact CB-CG1 4.41Å; I290-I292 HydrophobicContact CD1-CB 4.37Å; I292-V295 HydrophobicContact CD1-CB 4.24Å; I292-V295 HydrophobicContact CD1-CG2 3.56Å; I292-V295 HydrophobicContact CG1-CB 4.44Å; I292-V295 HydrophobicContact CG1-CG2 3.8Å; I292-F297 HydrophobicContact CG2-CE2 3.88Å; I292-F297 HydrophobicContact CG2-CZ 4.23Å; I292-I318 CarbonylContact O-C 3.35Å; I292-I318 WeakPolarHBondContact O-CA 3.45Å; I292-S319 PolarHBondContact N-O 3.02Å; I292-S319 PolarHBondContact O-N 2.82Å; I292-V321 HydrophobicContact CG2-CB 4.5Å; I292-V321 HydrophobicContact CG2-CG2 3.56Å
293	T	91.8	Very high	75.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.8	-178.8	69.3	0	0	0	0	113	Q276 L278 V295 T317 I318 I385 I388	Q276-T293 PolarHBondContact O-OG1 2.71Å; L278-T293 HydrophobicContact CB-CG2 4.29Å; L278-T293 WeakPolarHBondContact CB-OG1 3.33Å; L278-T293 PolarHBondContact N-OG1 3.15Å; L278-T293 PolarHBondContact O-N 3.03Å; L278-T293 PolarHBondContact O-OG1 2.83Å; T293-V295 VanDerWaalsContact C-N 3.27Å; T293-V295 PolarHBondContact O-N 2.92Å; T293-T317 CarbonylContact C-O 3.54Å; T293-T317 WeakPolarHBondContact CA-O 3.43Å; T293-T317 WeakPolarHBondContact CB-O 3.32Å; T293-I318 HydrophobicContact CG2-CG1 4.22Å; T293-I385 HydrophobicContact CG2-CD1 3.93Å; T293-I385 HydrophobicContact CG2-CG2 4.35Å; T293-I388 HydrophobicContact CG2-CD1 3.83Å; T293-I388 HydrophobicContact CG2-CG1 4.36Å; T293-I388 HydrophobicContact CG2-CG2 3.51Å
294	N	85.4	Confident	72.4	Confident	29 Å²	29	57.9 Å²	57.9	16%	0.155	33%	0.327	C	S	.	.	S	Bend	trans	58.1	38.9	170.8	-49.5	-39.6	0	0	0	112.9	S275 Q276 A316 T317	S275-N294 WeakPolarHBondContact CB-ND2 3.37Å; Q276-N294 PolarHBondContact O-ND2 2.82Å; N294-A316 WeakPolarHBondContact OD1-CA 2.93Å; N294-T317 WeakPolarHBondContact CA-OG1 3.12Å; N294-T317 PolarHBondContact N-O 2.86Å; N294-T317 PolarHBondContact N-OG1 3.49Å; N294-T317 PolarHBondContact OD1-N 3.05Å
295	V	83.6	Confident	69.6	Low	14 Å²	14	64.4 Å²	64.4	9%	0.085	36%	0.357	C	S	.	.			trans	-126	125.4	174.4	-178.9	0	0	0	0	108.7	L210 V277 I292 T293 F297	L210-V295 HydrophobicContact CD2-CB 4.4Å; L210-V295 HydrophobicContact CD2-CG1 3.76Å; L210-V295 HydrophobicContact CD2-CG2 3.68Å; V277-V295 HydrophobicContact CB-CG2 4.49Å; V277-V295 HydrophobicContact CG1-CG2 3.71Å; V277-V295 HydrophobicContact CG2-CG2 3.94Å; I292-V295 HydrophobicContact CD1-CB 4.24Å; I292-V295 HydrophobicContact CD1-CG2 3.56Å; I292-V295 HydrophobicContact CG1-CB 4.44Å; I292-V295 HydrophobicContact CG1-CG2 3.8Å; T293-V295 VanDerWaalsContact C-N 3.27Å; T293-V295 PolarHBondContact O-N 2.92Å; V295-F297 HydrophobicContact CB-CE2 3.87Å; V295-F297 HydrophobicContact CB-CZ 4.34Å; V295-F297 HydrophobicContact CG1-CD2 4.15Å; V295-F297 HydrophobicContact CG1-CE1 4.35Å; V295-F297 HydrophobicContact CG1-CE2 3.54Å; V295-F297 HydrophobicContact CG1-CZ 3.65Å
296	D	75.8	Confident	67.1	Low	76 Å²	76	67.9 Å²	67.9	41%	0.406	38%	0.378	S	S	.	.			trans	-91.4	116.6	-179.9	-60.7	-27.3	0	0	0	108.7	W310 P312	D296-W310 VanDerWaalsContact OD1-CZ3 3.25Å; D296-W310 WeakPolarHBondContact OD1-CZ3 3.22Å; D296-P312 WeakPolarHBondContact OD2-CB 3.33Å; D296-P312 WeakPolarHBondContact OD2-CG 3.26Å
297	F	74.9	Confident	64.6	Low	29 Å²	29	69 Å²	69	13%	0.127	39%	0.387	C	S	.	.			trans	-100.8	129.2	171.8	-66.6	-88	0	0	0	107.6	L208 I292 V295 H299 V321 C328	L208-F297 HydrophobicContact CD2-CE1 4Å; L208-F297 HydrophobicContact CD2-CZ 4.05Å; I292-F297 HydrophobicContact CG2-CE2 3.88Å; I292-F297 HydrophobicContact CG2-CZ 4.23Å; V295-F297 HydrophobicContact CB-CE2 3.87Å; V295-F297 HydrophobicContact CB-CZ 4.34Å; V295-F297 HydrophobicContact CG1-CD2 4.15Å; V295-F297 HydrophobicContact CG1-CE1 4.35Å; V295-F297 HydrophobicContact CG1-CE2 3.54Å; V295-F297 HydrophobicContact CG1-CZ 3.65Å; F297-H299 PolarHBondContact O-N 2.96Å; F297-V321 HydrophobicContact CD2-CG2 4.37Å; F297-V321 HydrophobicContact CE1-CG1 4.45Å; F297-V321 HydrophobicContact CE1-CG2 4.18Å; F297-V321 HydrophobicContact CE2-CG2 3.55Å; F297-V321 HydrophobicContact CZ-CG1 4.29Å; F297-V321 HydrophobicContact CZ-CG2 3.45Å; F297-V321 VanDerWaalsContact CZ-CG2 3.45Å; F297-C328 HydrophobicContact CB-CB 3.62Å; F297-C328 HydrophobicContact CD1-CB 4.09Å; F297-C328 HydrophobicContact CD2-CB 4.03Å; F297-C328 HydrophobicContact CG-CB 3.64Å
298	P	59.8	Low	61.7	Low	130 Å²	130	73.2 Å²	73.2	84%	0.844	42%	0.42	S	S	*	.			trans	-60.1	113	172.2	23.7	-30.1	0	0	0	107.9	G300	P298-G300 PolarHBondContact O-N 3.14Å
299	H	53.6	Low	59	Low	117 Å²	117	77.4 Å²	77.4	54%	0.542	44%	0.439	S	S	.	.			trans	-60.8	136.2	175.1	-68.5	-61.9	0	0	0	108.7	F297	F297-H299 PolarHBondContact O-N 2.96Å
300	G	39.7	Very low	56	Low	51 Å²	51	81.5 Å²	81.5	53%	0.526	45%	0.454	S	S	.	.			trans	-54.4	166.6	179.6	0	0	0	0	0	113	P298 N302 S303	P298-G300 PolarHBondContact O-N 3.14Å; G300-N302 PolarHBondContact O-N 3.48Å; G300-S303 PolarHBondContact O-N 3.48Å
301	P	33.8	Very low	53	Low	128 Å²	128	85.5 Å²	85.5	83%	0.831	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	0.1	-164.5	19	-31.8	0	0	0	117.6
302	N	32	Very low	50.3	Low	149 Å²	149	87.5 Å²	87.5	80%	0.797	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	8.1	-179.9	-67.1	-11.2	0	0	0	114.6	G300 H304	G300-N302 PolarHBondContact O-N 3.48Å; N302-H304 PolarHBondContact O-N 2.84Å
303	S	34.1	Very low	47.9	Very low	70 Å²	70	89.4 Å²	89.4	49%	0.49	51%	0.512	S	S	.	.			trans	-87.1	77.2	173.4	-179.3	0	0	0	0	111.1	G300	G300-S303 PolarHBondContact O-N 3.48Å
304	H	31	Very low	45.9	Very low	162 Å²	162	93 Å²	93	75%	0.75	53%	0.53	S	S	*	.			trans	-74.9	126.3	171.6	-80.2	-73.6	0	0	0	111.2	N302	N302-H304 PolarHBondContact O-N 2.84Å
305	K	28.1	Very low	44.7	Very low	196 Å²	196	92.9 Å²	92.9	85%	0.852	53%	0.529	S	S	*	.			trans	63.8	82.5	157.4	-67.5	179.5	174.8	176.6	0	117.3
306	L	35.8	Very low	44.5	Very low	132 Å²	132	92.3 Å²	92.3	69%	0.691	53%	0.525	S	S	*	.			trans	-130.4	90.1	150.6	-89.4	155.8	0	0	0	111
307	S	34.1	Very low	45	Very low	70 Å²	70	88.9 Å²	88.9	49%	0.49	51%	0.507	S	S	.	.			trans	54.1	106.4	152.2	168.7	0	0	0	0	118.2	N309	S307-N309 PolarHBondContact O-N 2.86Å
308	S	30.8	Very low	45.8	Very low	122 Å²	122	87.5 Å²	87.5	85%	0.853	50%	0.501	S	S	*	.	S	Bend	trans	-60	25.1	175.4	55.8	0	0	0	0	118.3
309	N	33.6	Very low	47.4	Very low	131 Å²	131	81.4 Å²	81.4	70%	0.701	46%	0.461	S	S	*	.			trans	-121.9	37.3	177.4	-72.2	-2.8	0	0	0	111.8	S307 V311	S307-N309 PolarHBondContact O-N 2.86Å; N309-V311 PolarHBondContact O-N 2.81Å
310	W	30.7	Very low	49.4	Very low	105 Å²	105	75.9 Å²	75.9	40%	0.398	44%	0.436	S	S	.	.			trans	-83.3	109.7	179	-105.6	91.1	0	0	0	110.1	D296 T317	D296-W310 VanDerWaalsContact OD1-CZ3 3.25Å; D296-W310 WeakPolarHBondContact OD1-CZ3 3.22Å; W310-T317 HydrophobicContact CH2-CG2 3.99Å
311	V	32.6	Very low	52	Low	83 Å²	83	73.4 Å²	73.4	50%	0.503	41%	0.411	S	S	.	.			trans	-110.2	107.9	166.6	-175.9	0	0	0	0	107.5	N309 I314	N309-V311 PolarHBondContact O-N 2.81Å; V311-I314 HydrophobicContact CB-CD1 3.58Å; V311-I314 HydrophobicContact CB-CG1 3.92Å; V311-I314 HydrophobicContact CG1-CD1 3.66Å; V311-I314 HydrophobicContact CG1-CG1 3.88Å; V311-I314 HydrophobicContact CG2-CD1 4.23Å; V311-I314 WeakPolarHBondContact O-CB 3.22Å; V311-I314 PolarHBondContact O-N 3.39Å
312	P	39.6	Very low	54.9	Low	42 Å²	42	71.8 Å²	71.8	27%	0.273	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	143.9	176.4	-32.1	39.6	0	0	0	112.7	S213 D296 I314	S213-P312 VanDerWaalsContact CB-CG 3.47Å; S213-P312 WeakPolarHBondContact OG-CB 3.49Å; S213-P312 WeakPolarHBondContact OG-CD 3.32Å; S213-P312 WeakPolarHBondContact OG-CG 3.34Å; D296-P312 WeakPolarHBondContact OD2-CB 3.33Å; D296-P312 WeakPolarHBondContact OD2-CG 3.26Å; P312-I314 VanDerWaalsContact C-N 3.29Å; P312-I314 PolarHBondContact O-N 3.26Å
313	G	44.3	Very low	57.8	Low	42 Å²	42	65.1 Å²	65.1	43%	0.433	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	-14.3	-173.8	0	0	0	0	0	114.9
314	I	50.4	Low	60.7	Low	76 Å²	76	64.7 Å²	64.7	39%	0.39	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-40	177	-60.4	-163.5	0	0	0	110.9	V311 P312 F382	V311-I314 HydrophobicContact CB-CD1 3.58Å; V311-I314 HydrophobicContact CB-CG1 3.92Å; V311-I314 HydrophobicContact CG1-CD1 3.66Å; V311-I314 HydrophobicContact CG1-CG1 3.88Å; V311-I314 HydrophobicContact CG2-CD1 4.23Å; V311-I314 WeakPolarHBondContact O-CB 3.22Å; V311-I314 PolarHBondContact O-N 3.39Å; P312-I314 VanDerWaalsContact C-N 3.29Å; P312-I314 PolarHBondContact O-N 3.26Å; I314-F382 HydrophobicContact CB-CE2 4.43Å; I314-F382 HydrophobicContact CG2-CD2 3.66Å; I314-F382 HydrophobicContact CG2-CE2 3.07Å; I314-F382 HydrophobicContact CG2-CZ 3.59Å; I314-F382 VanDerWaalsContact O-CB 3.24Å; I314-F382 WeakPolarHBondContact O-CB 3.32Å; I314-F382 WeakPolarHBondContact O-CD1 3.4Å; I314-F382 WeakPolarHBondContact O-CD2 3.36Å; I314-F382 WeakPolarHBondContact O-CG 3.36Å
315	Q	61.5	Low	63.6	Low	26 Å²	26	61 Å²	61	12%	0.121	34%	0.339	C	S	.	.	S	Bend	trans	-104.4	139.7	-174.9	-73.7	165.9	27.7	0	0	113.2	K334 F382	Q315-K334 VanDerWaalsContact OE1-CG 3.31Å; Q315-F382 HydrophobicContact CB-CD1 4.49Å; Q315-F382 HydrophobicContact CB-CE1 4.41Å; Q315-F382 HydrophobicContact CG-CD1 3.95Å; Q315-F382 HydrophobicContact CG-CE1 3.42Å; Q315-F382 VanDerWaalsContact CG-CE1 3.42Å; Q315-F382 HydrophobicContact CG-CZ 3.9Å
316	A	77.9	Confident	66.7	Low	2 Å²	2	52.9 Å²	52.9	2%	0.017	30%	0.303	C	S	.	.			trans	-82.9	125.4	173.2	0	0	0	0	0	110.2	N294 L335 P383 I385	N294-A316 WeakPolarHBondContact OD1-CA 2.93Å; A316-L335 HydrophobicContact CB-CB 4.14Å; A316-L335 HydrophobicContact CB-CD1 4.48Å; A316-L335 WeakPolarHBondContact O-CD1 3.44Å; A316-L335 PolarHBondContact O-N 3.23Å; A316-P383 HydrophobicContact CB-CG 4.29Å; A316-I385 HydrophobicContact CB-CD1 4Å; A316-I385 HydrophobicContact CB-CG1 4.16Å
317	T	86.5	Confident	69.4	Low	4 Å²	4	51.6 Å²	51.6	3%	0.025	29%	0.294	C	S	.	.			trans	-129.3	153.3	-178.3	58	0	0	0	0	111.2	T293 N294 W310	T293-T317 CarbonylContact C-O 3.54Å; T293-T317 WeakPolarHBondContact CA-O 3.43Å; T293-T317 WeakPolarHBondContact CB-O 3.32Å; N294-T317 WeakPolarHBondContact CA-OG1 3.12Å; N294-T317 PolarHBondContact N-O 2.86Å; N294-T317 PolarHBondContact N-OG1 3.49Å; N294-T317 PolarHBondContact OD1-N 3.05Å; W310-T317 HydrophobicContact CH2-CG2 3.99Å
318	I	92.1	Very high	72.2	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.4	169.7	-58	160.1	0	0	0	107.1	A291 I292 T293 S331 T332 L335 L397 T399 F495 L500	A291-I318 HydrophobicContact CB-CG2 4.49Å; I292-I318 CarbonylContact O-C 3.35Å; I292-I318 WeakPolarHBondContact O-CA 3.45Å; T293-I318 HydrophobicContact CG2-CG1 4.22Å; I318-S331 CarbonylContact O-C 3.6Å; I318-S331 VanDerWaalsContact O-CA 3.3Å; I318-S331 WeakPolarHBondContact O-CA 2.87Å; I318-S331 PolarHBondContact O-OG 2.77Å; I318-T332 HydrophobicContact CB-CG2 3.92Å; I318-T332 HydrophobicContact CD1-CG2 4.28Å; I318-T332 PolarHBondContact N-OG1 3.49Å; I318-T332 PolarHBondContact O-N 3.16Å; I318-T332 PolarHBondContact O-OG1 3.28Å; I318-L335 HydrophobicContact CD1-CD1 3.76Å; I318-L335 HydrophobicContact CD1-CD2 4.38Å; I318-L335 HydrophobicContact CG1-CD1 3.8Å; I318-L397 HydrophobicContact CG2-CD2 3.73Å; I318-T399 HydrophobicContact CD1-CG2 3.33Å; I318-T399 HydrophobicContact CG1-CG2 4.21Å; I318-F495 HydrophobicContact CD1-CD2 4.14Å; I318-F495 HydrophobicContact CD1-CE2 3.52Å; I318-F495 HydrophobicContact CD1-CZ 3.73Å; I318-L500 HydrophobicContact CG2-CD1 4.36Å; I318-L500 HydrophobicContact CG2-CD2 4.07Å; I318-L500 WeakPolarHBondContact O-CD1 3.12Å
319	S	93.3	Very high	75	Confident	1 Å²	1	48 Å²	48	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.4	177.4	-57.9	0	0	0	0	109.8	A291 I292 T330 S331	A291-S319 CarbonylContact C-O 3.52Å; A291-S319 WeakPolarHBondContact CA-O 3.13Å; I292-S319 PolarHBondContact N-O 3.02Å; I292-S319 PolarHBondContact O-N 2.82Å; S319-T330 CarbonylContact C-O 3.57Å; S319-T330 VanDerWaalsContact CA-O 3.3Å; S319-T330 WeakPolarHBondContact CA-O 3.31Å; S319-S331 WeakPolarHBondContact OG-CB 3.34Å; S319-S331 PolarHBondContact OG-OG 3.45Å
320	L	94.8	Very high	77.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132	165.8	-62	-176.1	0	0	0	108.6	I290 A291 L329 T330 Y390 S497 L500	I290-L320 WeakPolarHBondContact O-CA 3.45Å; A291-L320 HydrophobicContact CB-CD2 3.99Å; L320-L329 HydrophobicContact CB-CB 4.19Å; L320-L329 PolarHBondContact O-N 2.88Å; L320-T330 HydrophobicContact CB-CG2 3.8Å; L320-T330 HydrophobicContact CD1-CG2 3.46Å; L320-T330 VanDerWaalsContact CD1-CG2 3.46Å; L320-T330 HydrophobicContact CG-CG2 3.66Å; L320-T330 PolarHBondContact N-O 2.68Å; L320-Y390 WeakPolarHBondContact CD2-OH 3.18Å; L320-S497 WeakPolarHBondContact CD1-O 3.42Å; L320-L500 HydrophobicContact CD1-CD2 4.29Å; L320-L500 HydrophobicContact CD1-CG 4.19Å; L320-L500 HydrophobicContact CD2-CD2 3.89Å; L320-L500 HydrophobicContact CD2-CG 4.48Å; L320-L500 HydrophobicContact CG-CD1 4Å; L320-L500 HydrophobicContact CG-CD2 3.89Å; L320-L500 HydrophobicContact CG-CG 3.92Å
321	V	94.6	Very high	80.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.4	-172.6	-179.4	0	0	0	0	110.1	R289 I290 I292 F297 W326 E327	R289-V321 WeakPolarHBondContact CA-O 3.21Å; I290-V321 HydrophobicContact CG1-CB 3.99Å; I290-V321 PolarHBondContact N-O 3.43Å; I290-V321 PolarHBondContact O-N 3.24Å; I292-V321 HydrophobicContact CG2-CB 4.5Å; I292-V321 HydrophobicContact CG2-CG2 3.56Å; F297-V321 HydrophobicContact CD2-CG2 4.37Å; F297-V321 HydrophobicContact CE1-CG1 4.45Å; F297-V321 HydrophobicContact CE1-CG2 4.18Å; F297-V321 HydrophobicContact CE2-CG2 3.55Å; F297-V321 HydrophobicContact CZ-CG1 4.29Å; F297-V321 HydrophobicContact CZ-CG2 3.45Å; F297-V321 VanDerWaalsContact CZ-CG2 3.45Å; V321-W326 HydrophobicContact CG1-CB 4.42Å; V321-W326 HydrophobicContact CG1-CE3 4.1Å; V321-E327 CarbonylContact C-O 3.59Å; V321-E327 WeakPolarHBondContact CA-O 3.49Å
322	K	94.5	Very high	83	Confident	94 Å²	94	37 Å²	37	41%	0.409	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	138.4	174.3	-172.7	178.2	175.4	-174.9	0	110.5	S288 W326 E327 L329	S288-K322 CarbonylContact O-C 3.56Å; S288-K322 WeakPolarHBondContact O-CA 3.12Å; K322-W326 VanDerWaalsContact O-CA 3.28Å; K322-W326 WeakPolarHBondContact O-CA 3.17Å; K322-W326 PolarHBondContact O-N 3.39Å; K322-E327 HydrophobicContact CB-CB 4.28Å; K322-E327 PolarHBondContact N-O 3.41Å; K322-L329 HydrophobicContact CB-CD1 4.38Å; K322-L329 HydrophobicContact CB-CD2 4.28Å; K322-L329 HydrophobicContact CB-CG 4.38Å
323	L	94.3	Very high	84.2	Confident	8 Å²	8	41.5 Å²	41.5	4%	0.042	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	148.1	174.4	-64.1	-179.7	0	0	0	110.3	L196 F281 S288 I290 T325 W326	L196-L323 HydrophobicContact CD1-CD1 4.05Å; L196-L323 HydrophobicContact CD2-CB 4.14Å; L196-L323 HydrophobicContact CD2-CD1 4.19Å; L196-L323 HydrophobicContact CD2-CD2 4.41Å; L196-L323 HydrophobicContact CD2-CG 4.49Å; F281-L323 HydrophobicContact CE1-CD1 3.72Å; F281-L323 HydrophobicContact CZ-CD1 4.4Å; S288-L323 PolarHBondContact O-N 3.09Å; I290-L323 HydrophobicContact CD1-CD2 4.27Å; I290-L323 HydrophobicContact CG1-CG 4.45Å; I290-L323 HydrophobicContact CG2-CD1 3.56Å; I290-L323 HydrophobicContact CG2-CG 4.28Å; L323-T325 VanDerWaalsContact C-N 3.35Å; L323-W326 HydrophobicContact CD2-CD2 4.01Å; L323-W326 HydrophobicContact CD2-CE3 3.63Å; L323-W326 HydrophobicContact CD2-CH2 3.69Å; L323-W326 HydrophobicContact CD2-CZ2 4.06Å; L323-W326 HydrophobicContact CD2-CZ3 3.47Å; L323-W326 VanDerWaalsContact CD2-CZ3 3.47Å
324	P	93.7	Very high	85.1	Confident	61 Å²	61	43.1 Å²	43.1	40%	0.396	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.4	2.6	-0.5	35.4	-36.2	0	0	0	114.1	L196 I205 S206 W326	L196-P324 HydrophobicContact CD2-CB 4.03Å; I205-P324 HydrophobicContact CG2-CB 3.83Å; I205-P324 HydrophobicContact CG2-CG 4.34Å; S206-P324 PolarHBondContact OG-O 2.94Å; S206-P324 VanDerWaalsContact OG-O 3.14Å; P324-W326 VanDerWaalsContact C-N 3.31Å; P324-W326 PolarHBondContact O-N 3.22Å; P324-W326 PolarHBondContact O-NE1 3.15Å
325	T	93	Very high	85.8	Confident	85 Å²	85	40.4 Å²	40.4	52%	0.521	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.7	-169.5	56.9	0	0	0	0	115.2	L323 E327	L323-T325 VanDerWaalsContact C-N 3.35Å; T325-E327 PolarHBondContact O-N 3.17Å
326	W	93.6	Very high	85.3	Confident	26 Å²	26	42.5 Å²	42.5	10%	0.098	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	21.1	-174.7	-53.6	105.7	0	0	0	114.7	L180 L194 L196 S206 E207 L208 I290 V321 K322 L323 P324 C328	L180-W326 HydrophobicContact CD1-CH2 3.71Å; L180-W326 HydrophobicContact CD2-CH2 4.48Å; L194-W326 HydrophobicContact CB-CH2 3.94Å; L194-W326 HydrophobicContact CB-CZ3 4.45Å; L194-W326 HydrophobicContact CD1-CZ3 4.26Å; L196-W326 HydrophobicContact CB-CZ2 4.33Å; S206-W326 PolarHBondContact OG-NE1 3.33Å; S206-W326 VanDerWaalsContact OG-NE1 3.08Å; E207-W326 PolarHBondContact O-NE1 3.16Å; L208-W326 HydrophobicContact CB-CD2 3.65Å; L208-W326 HydrophobicContact CB-CE3 3.95Å; L208-W326 HydrophobicContact CB-CG 4.07Å; L208-W326 HydrophobicContact CB-CH2 4.26Å; L208-W326 HydrophobicContact CB-CZ2 3.98Å; L208-W326 HydrophobicContact CB-CZ3 4.23Å; L208-W326 HydrophobicContact CD1-CB 4.32Å; L208-W326 HydrophobicContact CD1-CG 4.31Å; L208-W326 HydrophobicContact CD2-CD2 3.96Å; L208-W326 HydrophobicContact CD2-CE3 3.57Å; L208-W326 HydrophobicContact CD2-CG 4.36Å; L208-W326 HydrophobicContact CD2-CZ3 4.07Å; L208-W326 HydrophobicContact CG-CD2 4.28Å; L208-W326 HydrophobicContact CG-CE3 4.34Å; L208-W326 HydrophobicContact CG-CG 4.48Å; I290-W326 HydrophobicContact CD1-CZ3 4.01Å; V321-W326 HydrophobicContact CG1-CB 4.42Å; V321-W326 HydrophobicContact CG1-CE3 4.1Å; K322-W326 VanDerWaalsContact O-CA 3.28Å; K322-W326 WeakPolarHBondContact O-CA 3.17Å; K322-W326 PolarHBondContact O-N 3.39Å; L323-W326 HydrophobicContact CD2-CD2 4.01Å; L323-W326 HydrophobicContact CD2-CE3 3.63Å; L323-W326 HydrophobicContact CD2-CH2 3.69Å; L323-W326 HydrophobicContact CD2-CZ2 4.06Å; L323-W326 HydrophobicContact CD2-CZ3 3.47Å; L323-W326 VanDerWaalsContact CD2-CZ3 3.47Å; P324-W326 VanDerWaalsContact C-N 3.31Å; P324-W326 PolarHBondContact O-N 3.22Å; P324-W326 PolarHBondContact O-NE1 3.15Å; W326-C328 PolarHBondContact O-N 3.39Å
327	E	91.9	Very high	83.9	Confident	105 Å²	105	44.9 Å²	44.9	49%	0.491	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	123.2	177.5	-176.4	-172.6	176.8	0	0	110.4	V321 K322 T325 L329	V321-E327 CarbonylContact C-O 3.59Å; V321-E327 WeakPolarHBondContact CA-O 3.49Å; K322-E327 HydrophobicContact CB-CB 4.28Å; K322-E327 PolarHBondContact N-O 3.41Å; T325-E327 PolarHBondContact O-N 3.17Å; E327-L329 PolarHBondContact O-N 3.24Å
328	C	91.8	Very high	82.1	Confident	36 Å²	36	46.5 Å²	46.5	24%	0.243	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	117.7	175.6	-176.3	0	0	0	0	110.2	F297 W326	F297-C328 HydrophobicContact CB-CB 3.62Å; F297-C328 HydrophobicContact CD1-CB 4.09Å; F297-C328 HydrophobicContact CD2-CB 4.03Å; F297-C328 HydrophobicContact CG-CB 3.64Å; W326-C328 PolarHBondContact O-N 3.39Å
329	L	90.4	Very high	79.4	Confident	81 Å²	81	49 Å²	49	42%	0.424	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-38.5	-179	-59	173.3	0	0	0	111.9	R289 L320 K322 E327	R289-L329 VanDerWaalsContact CD-CD1 3.46Å; R289-L329 HydrophobicContact CG-CD1 4.05Å; L320-L329 HydrophobicContact CB-CB 4.19Å; L320-L329 PolarHBondContact O-N 2.88Å; K322-L329 HydrophobicContact CB-CD1 4.38Å; K322-L329 HydrophobicContact CB-CD2 4.28Å; K322-L329 HydrophobicContact CB-CG 4.38Å; E327-L329 PolarHBondContact O-N 3.24Å
330	T	90	Very high	76.6	Confident	41 Å²	41	52.6 Å²	52.6	25%	0.252	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	157.9	177.3	179.4	0	0	0	0	109.4	S319 L320 L500	S319-T330 CarbonylContact C-O 3.57Å; S319-T330 VanDerWaalsContact CA-O 3.3Å; S319-T330 WeakPolarHBondContact CA-O 3.31Å; L320-T330 HydrophobicContact CB-CG2 3.8Å; L320-T330 HydrophobicContact CD1-CG2 3.46Å; L320-T330 VanDerWaalsContact CD1-CG2 3.46Å; L320-T330 HydrophobicContact CG-CG2 3.66Å; L320-T330 PolarHBondContact N-O 2.68Å; T330-L500 HydrophobicContact CG2-CD1 3.79Å; T330-L500 HydrophobicContact CG2-CG 3.88Å
331	S	89.4	Confident	73.7	Confident	29 Å²	29	56.6 Å²	56.6	20%	0.203	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	147.9	175.5	-165.6	0	0	0	0	110.8	I318 S319	I318-S331 CarbonylContact O-C 3.6Å; I318-S331 VanDerWaalsContact O-CA 3.3Å; I318-S331 WeakPolarHBondContact O-CA 2.87Å; I318-S331 PolarHBondContact O-OG 2.77Å; S319-S331 WeakPolarHBondContact OG-CB 3.34Å; S319-S331 PolarHBondContact OG-OG 3.45Å
332	T	85.3	Confident	70.5	Confident	16 Å²	16	64.4 Å²	64.4	10%	0.098	37%	0.365	C	S	.	.			trans	-68.5	132.6	173.5	54.8	0	0	0	0	110.5	I318 K334 F495 L500	I318-T332 HydrophobicContact CB-CG2 3.92Å; I318-T332 HydrophobicContact CD1-CG2 4.28Å; I318-T332 PolarHBondContact N-OG1 3.49Å; I318-T332 PolarHBondContact O-N 3.16Å; I318-T332 PolarHBondContact O-OG1 3.28Å; T332-K334 PolarHBondContact O-N 3.43Å; T332-F495 HydrophobicContact CG2-CE1 4.17Å; T332-L500 HydrophobicContact CG2-CB 3.86Å; T332-L500 HydrophobicContact CG2-CD1 4.11Å; T332-L500 HydrophobicContact CG2-CG 4.5Å
333	N	66	Low	67.4	Low	138 Å²	138	69.9 Å²	69.9	74%	0.738	38%	0.383	S	S	*	.	S	Bend	trans	-71.6	81	165.6	-73.2	-27.7	0	0	0	110.2
334	K	62.4	Low	64.4	Low	76 Å²	76	78.7 Å²	78.7	33%	0.33	42%	0.423	S	S	.	.			trans	57.8	123.5	175.4	-50.4	-179.3	-177.3	-166.7	0	113.8	Q315 T332 C336	Q315-K334 VanDerWaalsContact OE1-CG 3.31Å; T332-K334 PolarHBondContact O-N 3.43Å; K334-C336 VanDerWaalsContact CB-SG 3.55Å; K334-C336 PolarHBondContact O-N 3.07Å
335	L	64.1	Low	61.4	Low	18 Å²	18	78.8 Å²	78.8	9%	0.094	44%	0.436	C	S	.	.			trans	-70.9	78.1	160.8	-80.5	97.1	0	0	0	108.9	A316 I318 P383 T401 F495	A316-L335 HydrophobicContact CB-CB 4.14Å; A316-L335 HydrophobicContact CB-CD1 4.48Å; A316-L335 WeakPolarHBondContact O-CD1 3.44Å; A316-L335 PolarHBondContact O-N 3.23Å; I318-L335 HydrophobicContact CD1-CD1 3.76Å; I318-L335 HydrophobicContact CD1-CD2 4.38Å; I318-L335 HydrophobicContact CG1-CD1 3.8Å; L335-P383 HydrophobicContact CB-CG 4.05Å; L335-P383 WeakPolarHBondContact O-CG 3.46Å; L335-T401 HydrophobicContact CD2-CG2 4.4Å; L335-F495 HydrophobicContact CD2-CZ 4.14Å; L335-F495 HydrophobicContact CG-CZ 4.44Å
336	C	52	Low	58.2	Low	71 Å²	71	79.9 Å²	79.9	48%	0.48	45%	0.447	S	S	.	.			trans	-66.8	150	179.6	-75.8	0	0	0	0	111.3	K334	K334-C336 VanDerWaalsContact CB-SG 3.55Å; K334-C336 PolarHBondContact O-N 3.07Å
337	S	47.8	Very low	55.2	Low	52 Å²	52	83.6 Å²	83.6	36%	0.364	47%	0.474	S	S	.	.			trans	-37.7	145.9	176.5	53.9	0	0	0	0	113.2	S339	S337-S339 PolarHBondContact O-N 2.91Å
338	W	49.7	Very low	52.2	Low	37 Å²	37	86.6 Å²	86.6	14%	0.14	49%	0.493	C	S	.	.	S	Bend	trans	-74	20.3	-174.2	-55.3	-16.9	0	0	0	115.5	P383 T401 E403 L480 W491	W338-P383 HydrophobicContact CZ2-CB 3.92Å; W338-T401 WeakPolarHBondContact CZ2-OG1 3.36Å; W338-E403 HydrophobicContact CE3-CG 4.3Å; W338-E403 VanDerWaalsContact CE3-OE1 3.26Å; W338-E403 HydrophobicContact CH2-CG 3.81Å; W338-E403 VanDerWaalsContact CZ3-CD 3.45Å; W338-E403 HydrophobicContact CZ3-CG 3.44Å; W338-E403 VanDerWaalsContact CZ3-CG 3.44Å; W338-E403 WeakPolarHBondContact CZ3-OE1 3.17Å; W338-L480 HydrophobicContact CE3-CD2 4.48Å; W338-W491 AromaticContact CD2-CD1 3.85Å; W338-W491 HydrophobicContact CD2-CD2 4.01Å; W338-W491 AromaticContact CD2-CE2 3.85Å; W338-W491 HydrophobicContact CD2-CG 4Å; W338-W491 HydrophobicContact CD2-CZ2 4.36Å; W338-W491 AromaticContact CD2-NE1 3.74Å; W338-W491 AromaticContact CE2-CG 3.91Å; W338-W491 AromaticContact CE3-CD1 3.77Å; W338-W491 AromaticContact CE3-CD2 3.42Å; W338-W491 HydrophobicContact CE3-CD2 3.42Å; W338-W491 VanDerWaalsContact CE3-CD2 3.42Å; W338-W491 AromaticContact CE3-CE2 2.98Å; W338-W491 AromaticContact CE3-CE3 3.94Å; W338-W491 HydrophobicContact CE3-CE3 3.94Å; W338-W491 AromaticContact CE3-CG 3.88Å; W338-W491 HydrophobicContact CE3-CG 3.88Å; W338-W491 AromaticContact CE3-CH2 3.68Å; W338-W491 HydrophobicContact CE3-CH2 3.68Å; W338-W491 AromaticContact CE3-CZ2 3.15Å; W338-W491 HydrophobicContact CE3-CZ2 3.15Å; W338-W491 HydrophobicContact CE3-CZ3 4.04Å; W338-W491 AromaticContact CE3-NE1 3.24Å; W338-W491 HydrophobicContact CH2-CB 4.17Å; W338-W491 AromaticContact CH2-CD2 3.04Å; W338-W491 HydrophobicContact CH2-CD2 3.04Å; W338-W491 AromaticContact CH2-CE2 3.58Å; W338-W491 AromaticContact CH2-CE3 2.78Å; W338-W491 HydrophobicContact CH2-CE3 2.78Å; W338-W491 AromaticContact CH2-CG 3.66Å; W338-W491 HydrophobicContact CH2-CG 3.66Å; W338-W491 AromaticContact CH2-CH2 3.62Å; W338-W491 HydrophobicContact CH2-CH2 3.62Å; W338-W491 AromaticContact CH2-CZ2 3.86Å; W338-W491 HydrophobicContact CH2-CZ2 3.86Å; W338-W491 AromaticContact CH2-CZ3 3.08Å; W338-W491 HydrophobicContact CH2-CZ3 3.08Å; W338-W491 HydrophobicContact CZ2-CB 3.82Å; W338-W491 AromaticContact CZ2-CD2 3.6Å; W338-W491 HydrophobicContact CZ2-CD2 3.6Å; W338-W491 AromaticContact CZ2-CE3 3.67Å; W338-W491 HydrophobicContact CZ2-CE3 3.67Å; W338-W491 AromaticContact CZ2-CG 3.68Å; W338-W491 HydrophobicContact CZ2-CG 3.68Å; W338-W491 HydrophobicContact CZ2-CZ3 4.3Å; W338-W491 AromaticContact CZ3-CD2 2.99Å; W338-W491 HydrophobicContact CZ3-CD2 2.99Å; W338-W491 AromaticContact CZ3-CE2 2.93Å; W338-W491 AromaticContact CZ3-CE3 3.02Å; W338-W491 HydrophobicContact CZ3-CE3 3.02Å; W338-W491 AromaticContact CZ3-CG 3.81Å; W338-W491 HydrophobicContact CZ3-CG 3.81Å; W338-W491 AromaticContact CZ3-CH2 2.9Å; W338-W491 HydrophobicContact CZ3-CH2 2.9Å; W338-W491 AromaticContact CZ3-CZ2 2.91Å; W338-W491 HydrophobicContact CZ3-CZ2 2.91Å; W338-W491 AromaticContact CZ3-CZ3 2.95Å; W338-W491 HydrophobicContact CZ3-CZ3 2.95Å; W338-W491 AromaticContact CZ3-NE1 3.68Å
339	S	34.7	Very low	49.4	Very low	53 Å²	53	91.5 Å²	91.5	37%	0.371	52%	0.515	S	S	.	.	S	Bend	trans	-87.5	133.6	168.5	-51.1	0	0	0	0	108.7	S337 S341	S337-S339 PolarHBondContact O-N 2.91Å; S339-S341 PolarHBondContact O-N 3.42Å
340	P	34.8	Very low	46.4	Very low	77 Å²	77	94.8 Å²	94.8	50%	0.5	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-53.1	127.4	157.7	-14.6	27.5	0	0	0	107.2	N342 M479	P340-N342 PolarHBondContact O-N 3.32Å; P340-N342 VanDerWaalsContact O-N 3.1Å; P340-M479 HydrophobicContact CG-SD 4.02Å
341	S	33.2	Very low	43.5	Very low	84 Å²	84	99.9 Å²	99.9	59%	0.587	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-63	118	178.2	63.1	0	0	0	0	109.2	S339 R343	S339-S341 PolarHBondContact O-N 3.42Å; S341-R343 PolarHBondContact O-N 3.08Å
342	N	27	Very low	40.7	Very low	165 Å²	165	104.2 Å²	104.2	88%	0.882	58%	0.584	S	S	*	*			trans	-62.5	85.1	154.3	-96.3	-16.2	0	0	0	107.4	P340	P340-N342 PolarHBondContact O-N 3.32Å; P340-N342 VanDerWaalsContact O-N 3.1Å
343	R	31.3	Very low	38.3	Very low	208 Å²	208	109.7 Å²	109.7	79%	0.785	62%	0.618	S	S	*	*			trans	-96.1	71.2	164.2	-76.5	-169.3	-166	-144.6	5.5	108.8	S341 G345	S341-R343 PolarHBondContact O-N 3.08Å; R343-G345 VanDerWaalsContact C-N 3.28Å
344	H	31.1	Very low	36.5	Very low	193 Å²	193	108.6 Å²	108.6	89%	0.894	62%	0.62	S	S	*	*			trans	-92.8	77.8	143.6	-81.7	-59.6	0	0	0	106.6
345	G	29.6	Very low	35.1	Very low	64 Å²	64	116.4 Å²	116.4	66%	0.66	65%	0.647	S	S	*	*			trans	-135.2	78.1	172.7	0	0	0	0	0	107	R343	R343-G345 VanDerWaalsContact C-N 3.28Å
346	S	25.8	Very low	33.6	Very low	108 Å²	108	123.1 Å²	123.1	76%	0.755	68%	0.678	S	S	*	*			trans	-56.4	134.3	176.6	-163.6	0	0	0	0	109.5	L348	S346-L348 PolarHBondContact O-N 3.06Å; S346-L348 VanDerWaalsContact O-N 3.11Å
347	P	30.6	Very low	33	Very low	103 Å²	103	124.7 Å²	124.7	67%	0.669	69%	0.687	S	S	*	*			trans	-74.1	104	175	29.9	-28.7	0	0	0	108.1	I349	P347-I349 PolarHBondContact O-N 3.19Å
348	L	28.4	Very low	32.4	Very low	169 Å²	169	127.3 Å²	127.3	89%	0.885	70%	0.701	S	S	*	*			trans	-67.5	88	162	-89.4	151.2	0	0	0	107.7	S346 N350	S346-L348 PolarHBondContact O-N 3.06Å; S346-L348 VanDerWaalsContact O-N 3.11Å; L348-N350 PolarHBondContact O-N 3.48Å
349	I	33.1	Very low	31.9	Very low	139 Å²	139	137.6 Å²	137.6	71%	0.713	74%	0.74	S	S	*	*			trans	-69.2	113.8	160.6	-68	175.3	0	0	0	106	P347 N351	P347-I349 PolarHBondContact O-N 3.19Å; I349-N351 PolarHBondContact O-N 3.2Å; I349-N351 VanDerWaalsContact O-N 3.1Å
350	N	27.2	Very low	31.9	Very low	149 Å²	149	145.4 Å²	145.4	80%	0.797	76%	0.762	S	S	*	*			trans	-50.1	113.1	158.6	-76.3	-20.5	0	0	0	108.2	L348	L348-N350 PolarHBondContact O-N 3.48Å
351	N	30.3	Very low	32	Very low	149 Å²	149	154.1 Å²	154.1	80%	0.797	78%	0.784	S	S	*	*			trans	-150.5	131.2	141.2	-98.1	-16.7	0	0	0	110.3	I349	I349-N351 PolarHBondContact O-N 3.2Å; I349-N351 VanDerWaalsContact O-N 3.1Å
352	T	31.5	Very low	32.1	Very low	120 Å²	120	160.7 Å²	160.7	74%	0.736	80%	0.796	S	S	*	*			trans	-55.7	152.1	-179.6	35.4	0	0	0	0	113.6
353	T	33.8	Very low	32.6	Very low	131 Å²	131	157.9 Å²	157.9	80%	0.804	79%	0.789	S	S	*	*			trans	86.1	123.1	155.2	60.1	0	0	0	0	120.2
354	C	29.4	Very low	33	Very low	114 Å²	114	152.5 Å²	152.5	77%	0.77	78%	0.784	S	S	*	*			trans	100	95.2	143.3	-68.2	0	0	0	0	120.5
355	R	33	Very low	33.3	Very low	241 Å²	241	150.7 Å²	150.7	91%	0.909	78%	0.781	S	S	*	*				81.8	90.7	129.9	-71	-174.8	172.5	173.6	-2	120.2
356	E	31.5	Very low	33.6	Very low	158 Å²	158	152.3 Å²	152.3	74%	0.738	79%	0.788	S	S	*	*				-12.7	150.6	122.3	-147.9	50.6	-129.3	0	0	114.4	T358	E356-T358 PolarHBondContact OE1-N 3.03Å
357	P	38.5	Very low	34.1	Very low	104 Å²	104	154.5 Å²	154.5	68%	0.675	79%	0.791	S	S	*	*			cis	-156	151.4	50	42.4	-19.2	0	0	0	122.1
358	T	35.5	Very low	34.4	Very low	108 Å²	108	158.7 Å²	158.7	66%	0.663	80%	0.802	S	S	*	*			trans	69.3	118.9	131.4	59.6	0	0	0	0	122.4	E356	E356-T358 PolarHBondContact OE1-N 3.03Å
359	R	39	Very low	34.8	Very low	252 Å²	252	157.6 Å²	157.6	95%	0.951	80%	0.801	S	S	*	*				-165.3	126	106.8	-119.2	179.5	-178.6	-169.9	0.9	113.1
360	R	34.7	Very low	34.5	Very low	218 Å²	218	154.7 Å²	154.7	82%	0.823	81%	0.806	S	S	*	*			trans	-72.9	151.3	-179.6	-68.6	172.7	171.9	173.9	-2.7	113.4
361	R	37.8	Very low	34.5	Very low	259 Å²	259	151.1 Å²	151.1	98%	0.977	80%	0.804	S	S	*	*				-145.8	120	129.2	-117.3	180	-179.7	-177	-0.4	110.3
362	R	34.6	Very low	34.4	Very low	223 Å²	223	152 Å²	152	84%	0.842	81%	0.808	S	S	*	*			trans	-104.3	148.5	176.5	-83.2	-176.2	172.6	-167.3	-2.8	109.6
363	S	39	Very low	34.3	Very low	105 Å²	105	152.3 Å²	152.3	73%	0.734	81%	0.812	S	S	*	*			trans	-169.3	102.5	141.9	52.5	0	0	0	0	107.1
364	S	38.9	Very low	33.9	Very low	96 Å²	96	150.5 Å²	150.5	67%	0.671	81%	0.805	S	S	*	*				66.5	129.7	84.5	65.3	0	0	0	0	111.8
365	D	36.4	Very low	34	Very low	154 Å²	154	150.2 Å²	150.2	82%	0.824	80%	0.804	S	S	*	*			cis	-163.2	144.4	6.7	-78.4	-40.4	0	0	0	107.8
366	A	37.2	Very low	33.9	Very low	98 Å²	98	145.7 Å²	145.7	81%	0.81	80%	0.798	S	S	*	*			trans	-175.8	105.4	146.3	0	0	0	0	0	109.6	H368	A366-H368 PolarHBondContact O-N 3.4Å
367	N	35.4	Very low	33.6	Very low	155 Å²	155	142.6 Å²	142.6	83%	0.829	79%	0.794	S	S	*	*			trans	-66	120.1	178.6	-67.7	-50.1	0	0	0	111.8
368	H	38.4	Very low	33.3	Very low	191 Å²	191	145.3 Å²	145.3	88%	0.884	80%	0.795	S	S	*	*			trans	-125.7	118.5	148	-84.8	-65.1	0	0	0	109.7	A366	A366-H368 PolarHBondContact O-N 3.4Å
369	V	35.9	Very low	33.1	Very low	145 Å²	145	147.6 Å²	147.6	88%	0.879	80%	0.803	S	S	*	*			trans	-59.2	143.1	179.8	173.4	0	0	0	0	110.8
370	G	26.3	Very low	33.3	Very low	79 Å²	79	140.1 Å²	140.1	81%	0.814	78%	0.779	S	S	*	*			trans	-62.1	148.1	-165.1	0	0	0	0	0	117.3
371	G	27.2	Very low	34.2	Very low	73 Å²	73	134 Å²	134	75%	0.753	77%	0.765	S	S	*	*			trans	-132.9	122.4	155.9	0	0	0	0	0	108.3
372	L	28.1	Very low	35.4	Very low	168 Å²	168	123.8 Å²	123.8	88%	0.88	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-55.3	138.8	167.4	-88.3	85.4	0	0	0	109.4	S374	L372-S374 PolarHBondContact O-N 2.9Å
373	P	29.8	Very low	37.4	Very low	127 Å²	127	113.3 Å²	113.3	83%	0.825	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-66.9	122.5	169.9	27.2	-29.7	0	0	0	108.9
374	S	26	Very low	39.6	Very low	93 Å²	93	109.6 Å²	109.6	65%	0.65	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-62.4	138.6	176.5	81.8	0	0	0	0	110.7	L372 N376	L372-S374 PolarHBondContact O-N 2.9Å; S374-N376 PolarHBondContact O-N 3.16Å
375	S	31.1	Very low	42	Very low	108 Å²	108	105.1 Å²	105.1	76%	0.755	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	15.1	-175.8	48.3	0	0	0	0	115.1
376	N	29.9	Very low	44.4	Very low	145 Å²	145	98.2 Å²	98.2	78%	0.775	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	15.8	-165.8	-78.2	2.9	0	0	0	115.9	S374	S374-N376 PolarHBondContact O-N 3.16Å
377	S	26.9	Very low	47	Very low	93 Å²	93	94.8 Å²	94.8	65%	0.65	56%	0.56	S	S	*	*			trans	-109	7.4	-176.6	71.6	0	0	0	0	116.6	N379	S377-N379 VanDerWaalsContact C-N 3.33Å; S377-N379 PolarHBondContact O-N 3.4Å
378	F	31.2	Very low	49.7	Very low	161 Å²	161	87.6 Å²	87.6	71%	0.706	52%	0.521	S	S	*	.			trans	-81.9	77.9	173.2	-73.9	-72.2	0	0	0	111.5	H380	F378-H380 AromaticContact CD1-CD2 3.87Å; F378-H380 AromaticContact CD1-CE1 3.92Å; F378-H380 AromaticContact CD1-NE2 3.23Å; F378-H380 WeakPolarHBondContact CD1-NE2 3.44Å; F378-H380 AromaticContact CE1-NE2 3.97Å; F378-H380 AromaticContact CG-NE2 3.84Å; F378-H380 PolarHBondContact O-N 3.39Å
379	N	31.8	Very low	52.4	Low	156 Å²	156	80.2 Å²	80.2	83%	0.834	49%	0.487	S	S	*	.			trans	-67.7	63.7	161.1	-86.2	-25.8	0	0	0	110	S377 V381	S377-N379 VanDerWaalsContact C-N 3.33Å; S377-N379 PolarHBondContact O-N 3.4Å; N379-V381 VanDerWaalsContact C-N 3.31Å; N379-V381 PolarHBondContact O-N 3.33Å
380	H	43	Very low	55.1	Low	96 Å²	96	74.3 Å²	74.3	44%	0.444	45%	0.449	S	S	.	.			trans	-71.9	92.4	167.3	-74.6	-57.3	0	0	0	107.8	F378 F382	F378-H380 AromaticContact CD1-CD2 3.87Å; F378-H380 AromaticContact CD1-CE1 3.92Å; F378-H380 AromaticContact CD1-NE2 3.23Å; F378-H380 WeakPolarHBondContact CD1-NE2 3.44Å; F378-H380 AromaticContact CE1-NE2 3.97Å; F378-H380 AromaticContact CG-NE2 3.84Å; F378-H380 PolarHBondContact O-N 3.39Å; H380-F382 HydrophobicContact CB-CE1 4.49Å; H380-F382 HydrophobicContact CB-CE2 3.87Å; H380-F382 HydrophobicContact CB-CZ 3.87Å; H380-F382 WeakPolarHBondContact O-CD2 3.29Å; H380-F382 WeakPolarHBondContact O-CE2 3.37Å; H380-F382 PolarHBondContact O-N 3.33Å
381	V	53.3	Low	58.2	Low	88 Å²	88	70.6 Å²	70.6	53%	0.533	41%	0.41	S	S	.	.			trans	-69	100.9	170.7	-178.9	0	0	0	0	107.4	N379 E403	N379-V381 VanDerWaalsContact C-N 3.31Å; N379-V381 PolarHBondContact O-N 3.33Å; V381-E403 HydrophobicContact CG1-CB 4.4Å
382	F	62.7	Low	60.9	Low	45 Å²	45	75.4 Å²	75.4	20%	0.197	41%	0.406	C	S	.	.			trans	-70.8	135.6	178.4	-66.1	-85	0	0	0	110.6	I314 Q315 H380 H384 R405	I314-F382 HydrophobicContact CB-CE2 4.43Å; I314-F382 HydrophobicContact CG2-CD2 3.66Å; I314-F382 HydrophobicContact CG2-CE2 3.07Å; I314-F382 HydrophobicContact CG2-CZ 3.59Å; I314-F382 VanDerWaalsContact O-CB 3.24Å; I314-F382 WeakPolarHBondContact O-CB 3.32Å; I314-F382 WeakPolarHBondContact O-CD1 3.4Å; I314-F382 WeakPolarHBondContact O-CD2 3.36Å; I314-F382 WeakPolarHBondContact O-CG 3.36Å; Q315-F382 HydrophobicContact CB-CD1 4.49Å; Q315-F382 HydrophobicContact CB-CE1 4.41Å; Q315-F382 HydrophobicContact CG-CD1 3.95Å; Q315-F382 HydrophobicContact CG-CE1 3.42Å; Q315-F382 VanDerWaalsContact CG-CE1 3.42Å; Q315-F382 HydrophobicContact CG-CZ 3.9Å; H380-F382 HydrophobicContact CB-CE1 4.49Å; H380-F382 HydrophobicContact CB-CE2 3.87Å; H380-F382 HydrophobicContact CB-CZ 3.87Å; H380-F382 WeakPolarHBondContact O-CD2 3.29Å; H380-F382 WeakPolarHBondContact O-CE2 3.37Å; H380-F382 PolarHBondContact O-N 3.33Å; F382-H384 PolarHBondContact O-N 2.79Å; F382-R405 PolarHBondContact O-NH2 2.71Å
383	P	77.3	Confident	63.5	Low	4 Å²	4	69.5 Å²	69.5	3%	0.026	38%	0.375	C	S	.	.			trans	-58.4	128.6	-176.9	24.7	-33.5	0	0	0	109.9	A316 L335 W338 I385 T401	A316-P383 HydrophobicContact CB-CG 4.29Å; L335-P383 HydrophobicContact CB-CG 4.05Å; L335-P383 WeakPolarHBondContact O-CG 3.46Å; W338-P383 HydrophobicContact CZ2-CB 3.92Å; P383-I385 PolarHBondContact O-N 3.26Å; P383-T401 HydrophobicContact CB-CG2 4.14Å
384	H	84.6	Confident	66.3	Low	26 Å²	26	63.5 Å²	63.5	12%	0.12	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	110.6	173.8	-176.5	59.3	0	0	0	109	F382 M386 T401 T402 R405	F382-H384 PolarHBondContact O-N 2.79Å; H384-M386 PolarHBondContact O-N 2.79Å; H384-T401 CarbonylContact O-C 3.58Å; H384-T401 VanDerWaalsContact O-CA 3.24Å; H384-T401 WeakPolarHBondContact O-CA 3.38Å; H384-T402 HydrophobicContact CB-CG2 4.03Å; H384-T402 WeakPolarHBondContact CB-O 3.4Å; H384-T402 PolarHBondContact N-O 3.15Å; H384-T402 PolarHBondContact O-N 2.84Å; H384-R405 HydrophobicContact CB-CG 3.76Å
385	I	89.2	Confident	69.2	Low	2 Å²	2	61 Å²	61	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.6	174.7	-51.5	173.8	0	0	0	108.3	L278 T293 A316 P383 I388 T401	L278-I385 HydrophobicContact CD1-CB 4.36Å; L278-I385 HydrophobicContact CD1-CG2 3.82Å; L278-I385 WeakPolarHBondContact CD1-O 3.11Å; T293-I385 HydrophobicContact CG2-CD1 3.93Å; T293-I385 HydrophobicContact CG2-CG2 4.35Å; A316-I385 HydrophobicContact CB-CD1 4Å; A316-I385 HydrophobicContact CB-CG1 4.16Å; P383-I385 PolarHBondContact O-N 3.26Å; I385-I388 HydrophobicContact CG2-CG2 3.83Å; I385-T401 HydrophobicContact CB-CG2 4.34Å; I385-T401 HydrophobicContact CG1-CG2 3.88Å
386	M	87.9	Confident	72.1	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.049	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-33.2	178.5	-63.5	-179.6	63	0	0	112.2	H384 I400 T402 L490 P514 Y522	H384-M386 PolarHBondContact O-N 2.79Å; M386-I400 HydrophobicContact CB-CG2 4.44Å; M386-I400 PolarHBondContact N-O 3.33Å; M386-T402 HydrophobicContact CG-CG2 3.94Å; M386-T402 HydrophobicContact SD-CG2 3.56Å; M386-T402 VanDerWaalsContact SD-CG2 3.56Å; M386-L490 HydrophobicContact SD-CD2 3.66Å; M386-P514 HydrophobicContact CE-CB 4.05Å; M386-P514 HydrophobicContact SD-CB 4.12Å; M386-Y522 HydrophobicContact CB-CE2 4.35Å; M386-Y522 HydrophobicContact CE-CD1 3.83Å; M386-Y522 HydrophobicContact CE-CD2 4.42Å; M386-Y522 HydrophobicContact CE-CE1 3.51Å; M386-Y522 HydrophobicContact CE-CE2 4.19Å; M386-Y522 HydrophobicContact CE-CG 4.26Å
387	N	90.4	Very high	75.2	Confident	25 Å²	25	49.8 Å²	49.8	13%	0.134	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	156.5	179.4	-149.3	-21.2	0	0	0	112.5	T399 I400 Y522 L523	N387-T399 WeakPolarHBondContact O-CA 3.47Å; N387-I400 HydrophobicContact CB-CB 4.5Å; N387-I400 PolarHBondContact N-O 2.91Å; N387-I400 PolarHBondContact O-N 3.29Å; N387-Y522 HydrophobicContact CB-CE2 4.27Å; N387-L523 HydrophobicContact CB-CD2 3.92Å; N387-L523 WeakPolarHBondContact ND2-CD2 3.38Å
388	I	93.8	Very high	78.4	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.026	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.8	170.6	65.2	162.8	0	0	0	111.1	L278 A280 A291 T293 I385 F398 T399	L278-I388 HydrophobicContact CB-CG1 4.15Å; A280-I388 HydrophobicContact CB-CD1 4.2Å; A280-I388 HydrophobicContact CB-CG1 4.17Å; A291-I388 HydrophobicContact CB-CD1 4.04Å; T293-I388 HydrophobicContact CG2-CD1 3.83Å; T293-I388 HydrophobicContact CG2-CG1 4.36Å; T293-I388 HydrophobicContact CG2-CG2 3.51Å; I385-I388 HydrophobicContact CG2-CG2 3.83Å; I388-F398 VanDerWaalsContact CA-O 3.26Å; I388-F398 WeakPolarHBondContact CA-O 3.49Å; I388-T399 HydrophobicContact CB-CG2 4.33Å; I388-T399 HydrophobicContact CG2-CG2 3.51Å
389	F	93.5	Very high	81.4	Confident	36 Å²	36	37.7 Å²	37.7	16%	0.158	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	154.5	177.5	58.1	-85.5	0	0	0	111.5	F398 I400 L523 P524 M526	F389-F398 HydrophobicContact CD1-CB 4.19Å; F389-F398 HydrophobicContact CD2-CB 3.91Å; F389-F398 AromaticContact CD2-CD2 3.82Å; F389-F398 HydrophobicContact CD2-CD2 3.82Å; F389-F398 HydrophobicContact CD2-CG 4.11Å; F389-F398 HydrophobicContact CE1-CB 3.75Å; F389-F398 HydrophobicContact CE2-CB 3.43Å; F389-F398 VanDerWaalsContact CE2-CB 3.43Å; F389-F398 HydrophobicContact CE2-CD1 4.25Å; F389-F398 AromaticContact CE2-CD2 3.5Å; F389-F398 HydrophobicContact CE2-CD2 3.5Å; F389-F398 VanDerWaalsContact CE2-CD2 3.5Å; F389-F398 HydrophobicContact CE2-CE2 4.31Å; F389-F398 AromaticContact CE2-CG 3.46Å; F389-F398 HydrophobicContact CE2-CG 3.46Å; F389-F398 VanDerWaalsContact CE2-CG 3.46Å; F389-F398 HydrophobicContact CG-CB 4.25Å; F389-F398 HydrophobicContact CZ-CB 3.33Å; F389-F398 HydrophobicContact CZ-CD1 4.35Å; F389-F398 HydrophobicContact CZ-CD2 4.26Å; F389-F398 AromaticContact CZ-CG 3.75Å; F389-F398 HydrophobicContact CZ-CG 3.75Å; F389-F398 PolarHBondContact N-O 3.3Å; F389-F398 PolarHBondContact O-N 2.7Å; F389-I400 HydrophobicContact CE1-CD1 4.05Å; F389-I400 HydrophobicContact CE1-CG1 4.07Å; F389-L523 HydrophobicContact CD1-CD2 4.14Å; F389-L523 HydrophobicContact CE1-CD2 4.05Å; F389-P524 HydrophobicContact CE1-CG 4.18Å; F389-P524 HydrophobicContact CE2-CG 4.21Å; F389-P524 HydrophobicContact CZ-CG 3.44Å; F389-P524 VanDerWaalsContact CZ-CG 3.44Å; F389-M526 HydrophobicContact CD2-CE 3.61Å; F389-M526 HydrophobicContact CE2-CE 3.42Å; F389-M526 VanDerWaalsContact CE2-CE 3.42Å
390	Y	93.1	Very high	84.3	Confident	20 Å²	20	30.3 Å²	30.3	8%	0.078	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	157.9	175.7	-73.9	-90.8	0	0	0	112.2	A280 F281 D282 A291 L320 F396 L397 M526	A280-Y390 HydrophobicContact CB-CD2 3.96Å; A280-Y390 HydrophobicContact CB-CE2 4Å; A280-Y390 WeakPolarHBondContact O-CE2 3.48Å; F281-Y390 WeakPolarHBondContact O-CD2 3.44Å; D282-Y390 HydrophobicContact CB-CE1 4.03Å; D282-Y390 HydrophobicContact CB-CE2 4.08Å; A291-Y390 HydrophobicContact CB-CE2 3.94Å; A291-Y390 VanDerWaalsContact CB-OH 3.24Å; A291-Y390 WeakPolarHBondContact CB-OH 3.36Å; A291-Y390 PolarHBondContact N-OH 2.73Å; L320-Y390 WeakPolarHBondContact CD2-OH 3.18Å; Y390-F396 CarbonylContact C-O 3.53Å; Y390-F396 VanDerWaalsContact CA-O 3.32Å; Y390-F396 WeakPolarHBondContact CA-O 2.88Å; Y390-L397 HydrophobicContact CD1-CB 4.28Å; Y390-L397 HydrophobicContact CD1-CD1 4.19Å; Y390-L397 HydrophobicContact CD2-CD1 4.09Å; Y390-L397 HydrophobicContact CE1-CB 4.14Å; Y390-L397 HydrophobicContact CE1-CD1 4.03Å; Y390-L397 HydrophobicContact CE2-CD1 3.91Å; Y390-L397 HydrophobicContact CG-CD1 4.23Å; Y390-M526 WeakPolarHBondContact O-CE 3.36Å
391	S	90.9	Very high	86.6	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.007	12%	0.118	C	C	.	.			trans	-59.4	156.7	158.6	55.1	0	0	0	0	110.8	D393 G394 Y395 F396	S391-D393 WeakPolarHBondContact CB-OD1 3.45Å; S391-D393 PolarHBondContact O-N 2.89Å; S391-D393 VanDerWaalsContact O-N 3.13Å; S391-D393 PolarHBondContact OG-OD1 3.22Å; S391-G394 WeakPolarHBondContact O-CA 3.43Å; S391-G394 PolarHBondContact O-N 2.86Å; S391-G394 PolarHBondContact OG-N 2.96Å; S391-Y395 PolarHBondContact OG-N 3.47Å; S391-F396 PolarHBondContact N-O 3.46Å; S391-F396 PolarHBondContact OG-N 3.2Å; S391-F396 PolarHBondContact OG-O 2.94Å
392	R	84.4	Confident	88.3	Confident	175 Å²	175	21.6 Å²	21.6	66%	0.66	9%	0.093	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.6	179.7	-174.2	175.1	179.7	159	5.6	113	R528	R392-R528 WeakPolarHBondContact CD-O 3.28Å; R392-R528 PolarHBondContact NH1-O 2.99Å
393	D	82.5	Confident	89.2	Confident	44 Å²	44	23.2 Å²	23.2	24%	0.235	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.9	177.4	58.7	4.8	0	0	0	113.7	R284 S391 Y395 P733	R284-D393 VanDerWaalsContact CD-O 3.27Å; R284-D393 WeakPolarHBondContact CD-O 3.32Å; R284-D393 WeakPolarHBondContact CG-O 3.27Å; S391-D393 WeakPolarHBondContact CB-OD1 3.45Å; S391-D393 PolarHBondContact O-N 2.89Å; S391-D393 VanDerWaalsContact O-N 3.13Å; S391-D393 PolarHBondContact OG-OD1 3.22Å; D393-Y395 VanDerWaalsContact C-N 3.33Å; D393-Y395 HydrophobicContact CB-CD2 3.79Å; D393-Y395 HydrophobicContact CB-CE2 3.9Å; D393-Y395 VanDerWaalsContact CG-CD2 3.44Å; D393-Y395 WeakPolarHBondContact O-CE2 2.83Å; D393-Y395 PolarHBondContact O-N 3.42Å; D393-Y395 PolarHBondContact OD1-N 3.08Å; D393-P733 WeakPolarHBondContact OD2-CB 3.43Å
394	G	89.3	Confident	89.3	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	77.1	-0.9	176	0	0	0	0	0	116.7	R284 S391 F396 S497	R284-G394 PolarHBondContact NE-O 3.42Å; R284-G394 VanDerWaalsContact NE-O 3.07Å; R284-G394 PolarHBondContact NH2-O 3.31Å; R284-G394 VanDerWaalsContact NH2-O 3.1Å; S391-G394 WeakPolarHBondContact O-CA 3.43Å; S391-G394 PolarHBondContact O-N 2.86Å; S391-G394 PolarHBondContact OG-N 2.96Å; G394-F396 VanDerWaalsContact C-N 3.31Å; G394-F396 PolarHBondContact O-N 3.47Å; G394-S497 WeakPolarHBondContact O-CB 3.23Å; G394-S497 PolarHBondContact O-OG 2.93Å
395	Y	87	Confident	88.9	Confident	42 Å²	42	26 Å²	26	17%	0.165	11%	0.112	C	C	.	.	S	Bend	trans	-75.6	-16.7	-178.7	-63.9	-69.1	0	0	0	114.7	S391 D393 S497 P733 P734 L739	S391-Y395 PolarHBondContact OG-N 3.47Å; D393-Y395 VanDerWaalsContact C-N 3.33Å; D393-Y395 HydrophobicContact CB-CD2 3.79Å; D393-Y395 HydrophobicContact CB-CE2 3.9Å; D393-Y395 VanDerWaalsContact CG-CD2 3.44Å; D393-Y395 WeakPolarHBondContact O-CE2 2.83Å; D393-Y395 PolarHBondContact O-N 3.42Å; D393-Y395 PolarHBondContact OD1-N 3.08Å; Y395-S497 WeakPolarHBondContact CA-OG 3.01Å; Y395-S497 PolarHBondContact O-N 2.85Å; Y395-S497 PolarHBondContact O-OG 3.04Å; Y395-P733 HydrophobicContact CD2-CB 4.1Å; Y395-P733 HydrophobicContact CE2-CB 4.31Å; Y395-P734 HydrophobicContact CD1-CG 3.55Å; Y395-P734 HydrophobicContact CD2-CG 4.04Å; Y395-P734 HydrophobicContact CE1-CG 3.45Å; Y395-P734 VanDerWaalsContact CE1-CG 3.45Å; Y395-P734 HydrophobicContact CE2-CG 3.97Å; Y395-P734 HydrophobicContact CG-CG 3.89Å; Y395-L739 HydrophobicContact CE1-CD2 3.51Å; Y395-L739 VanDerWaalsContact CZ-CD2 3.44Å; Y395-L739 WeakPolarHBondContact OH-CD1 3.19Å; Y395-L739 WeakPolarHBondContact OH-CD2 3.28Å
396	F	91.3	Very high	88.5	Confident	17 Å²	17	30.2 Å²	30.2	8%	0.075	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.3	176.1	-54.9	-60.8	0	0	0	110.2	Y390 S391 G394 F398 I494 F495 L503 P731	Y390-F396 CarbonylContact C-O 3.53Å; Y390-F396 VanDerWaalsContact CA-O 3.32Å; Y390-F396 WeakPolarHBondContact CA-O 2.88Å; S391-F396 PolarHBondContact N-O 3.46Å; S391-F396 PolarHBondContact OG-N 3.2Å; S391-F396 PolarHBondContact OG-O 2.94Å; G394-F396 VanDerWaalsContact C-N 3.31Å; G394-F396 PolarHBondContact O-N 3.47Å; F396-F398 HydrophobicContact CB-CD2 4.42Å; F396-F398 HydrophobicContact CB-CE2 3.65Å; F396-F398 HydrophobicContact CB-CZ 3.83Å; F396-I494 HydrophobicContact CB-CG2 4.09Å; F396-I494 HydrophobicContact CD1-CG2 4.14Å; F396-I494 HydrophobicContact CG-CG2 4.26Å; F396-F495 WeakPolarHBondContact CA-O 3.29Å; F396-L503 HydrophobicContact CD1-CD1 3.64Å; F396-L503 HydrophobicContact CE1-CD1 3.61Å; F396-P731 HydrophobicContact CE1-CB 4.34Å; F396-P731 HydrophobicContact CE1-CG 4.1Å; F396-P731 HydrophobicContact CE2-CB 4.41Å; F396-P731 HydrophobicContact CE2-CG 4.42Å; F396-P731 WeakPolarHBondContact CE2-O 3.24Å; F396-P731 HydrophobicContact CZ-CB 3.69Å; F396-P731 HydrophobicContact CZ-CG 3.79Å
397	L	94.4	Very high	88.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.5	167.5	176.2	65.9	0	0	0	108.3	A291 I318 Y390 F495 L500	A291-L397 HydrophobicContact CB-CD1 3.92Å; A291-L397 HydrophobicContact CB-CD2 3.74Å; I318-L397 HydrophobicContact CG2-CD2 3.73Å; Y390-L397 HydrophobicContact CD1-CB 4.28Å; Y390-L397 HydrophobicContact CD1-CD1 4.19Å; Y390-L397 HydrophobicContact CD2-CD1 4.09Å; Y390-L397 HydrophobicContact CE1-CB 4.14Å; Y390-L397 HydrophobicContact CE1-CD1 4.03Å; Y390-L397 HydrophobicContact CE2-CD1 3.91Å; Y390-L397 HydrophobicContact CG-CD1 4.23Å; L397-F495 HydrophobicContact CB-CB 4.25Å; L397-F495 PolarHBondContact N-O 2.84Å; L397-F495 PolarHBondContact O-N 3.42Å; L397-L500 HydrophobicContact CD2-CD2 3.7Å
398	F	94.4	Very high	87.7	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.7	179.8	-60.2	-95	0	0	0	109.9	I388 F389 F396 I492 T493 I494 M526 I533 L730	I388-F398 VanDerWaalsContact CA-O 3.26Å; I388-F398 WeakPolarHBondContact CA-O 3.49Å; F389-F398 HydrophobicContact CD1-CB 4.19Å; F389-F398 HydrophobicContact CD2-CB 3.91Å; F389-F398 AromaticContact CD2-CD2 3.82Å; F389-F398 HydrophobicContact CD2-CD2 3.82Å; F389-F398 HydrophobicContact CD2-CG 4.11Å; F389-F398 HydrophobicContact CE1-CB 3.75Å; F389-F398 HydrophobicContact CE2-CB 3.43Å; F389-F398 VanDerWaalsContact CE2-CB 3.43Å; F389-F398 HydrophobicContact CE2-CD1 4.25Å; F389-F398 AromaticContact CE2-CD2 3.5Å; F389-F398 HydrophobicContact CE2-CD2 3.5Å; F389-F398 VanDerWaalsContact CE2-CD2 3.5Å; F389-F398 HydrophobicContact CE2-CE2 4.31Å; F389-F398 AromaticContact CE2-CG 3.46Å; F389-F398 HydrophobicContact CE2-CG 3.46Å; F389-F398 VanDerWaalsContact CE2-CG 3.46Å; F389-F398 HydrophobicContact CG-CB 4.25Å; F389-F398 HydrophobicContact CZ-CB 3.33Å; F389-F398 HydrophobicContact CZ-CD1 4.35Å; F389-F398 HydrophobicContact CZ-CD2 4.26Å; F389-F398 AromaticContact CZ-CG 3.75Å; F389-F398 HydrophobicContact CZ-CG 3.75Å; F389-F398 PolarHBondContact N-O 3.3Å; F389-F398 PolarHBondContact O-N 2.7Å; F396-F398 HydrophobicContact CB-CD2 4.42Å; F396-F398 HydrophobicContact CB-CE2 3.65Å; F396-F398 HydrophobicContact CB-CZ 3.83Å; F398-I492 HydrophobicContact CD1-CG2 3.84Å; F398-T493 CarbonylContact C-O 3.12Å; F398-T493 WeakPolarHBondContact CA-O 3.49Å; F398-I494 HydrophobicContact CD1-CB 4.44Å; F398-I494 HydrophobicContact CD1-CD1 4.42Å; F398-I494 HydrophobicContact CD1-CG1 3.83Å; F398-I494 HydrophobicContact CD1-CG2 4.33Å; F398-I494 HydrophobicContact CE1-CB 4.35Å; F398-I494 HydrophobicContact CE1-CD1 3.85Å; F398-I494 HydrophobicContact CE1-CG1 3.72Å; F398-I494 HydrophobicContact CE1-CG2 3.93Å; F398-I494 HydrophobicContact CZ-CG2 4.33Å; F398-M526 HydrophobicContact CD2-CE 3.83Å; F398-M526 HydrophobicContact CE2-CE 3.5Å; F398-M526 HydrophobicContact CZ-CE 4.15Å; F398-I533 HydrophobicContact CD1-CD1 4.17Å; F398-I533 HydrophobicContact CE1-CD1 3.84Å; F398-I533 HydrophobicContact CZ-CD1 4.33Å; F398-L730 HydrophobicContact CE1-CD2 4.01Å; F398-L730 HydrophobicContact CZ-CD1 4.08Å; F398-L730 HydrophobicContact CZ-CD2 3.87Å
399	T	94.2	Very high	86.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.1	168.8	67.1	0	0	0	0	110.9	I318 N387 I388 I492 T493 F495	I318-T399 HydrophobicContact CD1-CG2 3.33Å; I318-T399 HydrophobicContact CG1-CG2 4.21Å; N387-T399 WeakPolarHBondContact O-CA 3.47Å; I388-T399 HydrophobicContact CB-CG2 4.33Å; I388-T399 HydrophobicContact CG2-CG2 3.51Å; T399-I492 WeakPolarHBondContact O-CA 3.44Å; T399-T493 PolarHBondContact N-O 2.98Å; T399-T493 PolarHBondContact O-N 2.86Å; T399-T493 WeakPolarHBondContact OG1-CB 3.38Å; T399-F495 HydrophobicContact CG2-CD2 4.25Å; T399-F495 HydrophobicContact CG2-CE2 3.82Å
400	I	92.6	Very high	86	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.5	171.9	-57.3	-177.5	0	0	0	108.3	M386 N387 F389 W491 I492 Y522 L523	M386-I400 HydrophobicContact CB-CG2 4.44Å; M386-I400 PolarHBondContact N-O 3.33Å; N387-I400 HydrophobicContact CB-CB 4.5Å; N387-I400 PolarHBondContact N-O 2.91Å; N387-I400 PolarHBondContact O-N 3.29Å; F389-I400 HydrophobicContact CE1-CD1 4.05Å; F389-I400 HydrophobicContact CE1-CG1 4.07Å; I400-W491 CarbonylContact C-O 3.38Å; I400-W491 WeakPolarHBondContact CA-O 3.36Å; I400-I492 HydrophobicContact CG1-CG1 4.05Å; I400-Y522 HydrophobicContact CD1-CD2 3.87Å; I400-Y522 HydrophobicContact CD1-CE2 4.29Å; I400-Y522 HydrophobicContact CG2-CD2 4.17Å; I400-L523 HydrophobicContact CD1-CD2 3.5Å; I400-L523 VanDerWaalsContact CD1-CD2 3.5Å; I400-L523 HydrophobicContact CD1-CG 4.34Å
401	T	91.5	Very high	84.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.9	-177.7	48.9	0	0	0	0	111.7	L335 W338 P383 H384 I385 W491	L335-T401 HydrophobicContact CD2-CG2 4.4Å; W338-T401 WeakPolarHBondContact CZ2-OG1 3.36Å; P383-T401 HydrophobicContact CB-CG2 4.14Å; H384-T401 CarbonylContact O-C 3.58Å; H384-T401 VanDerWaalsContact O-CA 3.24Å; H384-T401 WeakPolarHBondContact O-CA 3.38Å; I385-T401 HydrophobicContact CB-CG2 4.34Å; I385-T401 HydrophobicContact CG1-CG2 3.88Å; T401-W491 PolarHBondContact N-O 2.91Å; T401-W491 PolarHBondContact O-N 3.32Å; T401-W491 PolarHBondContact OG1-O 3.01Å
402	T	89.1	Confident	83.7	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	156.6	172.1	-171.4	0	0	0	0	110.7	H384 M386 S404 T488 T489 P514	H384-T402 HydrophobicContact CB-CG2 4.03Å; H384-T402 WeakPolarHBondContact CB-O 3.4Å; H384-T402 PolarHBondContact N-O 3.15Å; H384-T402 PolarHBondContact O-N 2.84Å; M386-T402 HydrophobicContact CG-CG2 3.94Å; M386-T402 HydrophobicContact SD-CG2 3.56Å; M386-T402 VanDerWaalsContact SD-CG2 3.56Å; T402-S404 VanDerWaalsContact CG2-O 3.25Å; T402-S404 WeakPolarHBondContact CG2-O 3.06Å; T402-S404 PolarHBondContact OG1-N 2.95Å; T402-T488 VanDerWaalsContact OG1-CG2 3.31Å; T402-T488 WeakPolarHBondContact OG1-CG2 3.41Å; T402-T489 PolarHBondContact OG1-O 2.77Å; T402-P514 HydrophobicContact CG2-CB 3.99Å
403	E	82	Confident	82.4	Confident	78 Å²	78	34.8 Å²	34.8	36%	0.364	20%	0.198	S	C	.	.	S	Bend	trans	-80.8	-23.3	169.9	-74	163.6	-179.8	0	0	111.8	W338 V381 R405 W491	W338-E403 HydrophobicContact CE3-CG 4.3Å; W338-E403 VanDerWaalsContact CE3-OE1 3.26Å; W338-E403 HydrophobicContact CH2-CG 3.81Å; W338-E403 VanDerWaalsContact CZ3-CD 3.45Å; W338-E403 HydrophobicContact CZ3-CG 3.44Å; W338-E403 VanDerWaalsContact CZ3-CG 3.44Å; W338-E403 WeakPolarHBondContact CZ3-OE1 3.17Å; V381-E403 HydrophobicContact CG1-CB 4.4Å; E403-R405 PolarHBondContact O-N 2.95Å; E403-W491 HydrophobicContact CG-CH2 4.44Å
404	S	79.1	Confident	80.6	Confident	11 Å²	11	38.8 Å²	38.8	8%	0.077	22%	0.219	C	C	.	.			trans	-86.3	114	-174.4	-172.2	0	0	0	0	111.5	T402 T406 R408 P514	T402-S404 VanDerWaalsContact CG2-O 3.25Å; T402-S404 WeakPolarHBondContact CG2-O 3.06Å; T402-S404 PolarHBondContact OG1-N 2.95Å; S404-T406 PolarHBondContact OG-OG1 3.45Å; S404-R408 PolarHBondContact OG-NE 3.02Å; S404-R408 VanDerWaalsContact OG-NE 3.15Å; S404-P514 WeakPolarHBondContact O-CB 3.34Å; S404-P514 WeakPolarHBondContact O-CG 3.11Å
405	R	77	Confident	78.6	Confident	78 Å²	78	40.8 Å²	40.8	29%	0.294	23%	0.229	S	C	.	.			trans	-95.6	-3.4	170.6	-64.5	-175.5	-172.9	-156.6	3	113.7	S275 F382 H384 E403 I515	S275-R405 PolarHBondContact OG-NH1 3.18Å; F382-R405 PolarHBondContact O-NH2 2.71Å; H384-R405 HydrophobicContact CB-CG 3.76Å; E403-R405 PolarHBondContact O-N 2.95Å; R405-I515 WeakPolarHBondContact O-CD1 3.45Å
406	T	79.9	Confident	76.3	Confident	91 Å²	91	41.3 Å²	41.3	56%	0.558	24%	0.235	S	C	*	.	S	Bend	trans	-95.3	152.2	-175.1	55.5	0	0	0	0	112.1	S404 P514	S404-T406 PolarHBondContact OG-OG1 3.45Å; T406-P514 VanDerWaalsContact O-CG 3.3Å; T406-P514 WeakPolarHBondContact O-CG 3.17Å
407	C	81.9	Confident	73.4	Confident	58 Å²	58	47.7 Å²	47.7	39%	0.392	27%	0.265	S	S	.	.			trans	-63.5	135.2	172.5	176.4	0	0	0	0	109.8	I515 H516	C407-I515 HydrophobicContact CB-CD1 4.05Å; C407-I515 VanDerWaalsContact N-CD1 3.34Å; C407-H516 PolarHBondContact SG-CE1 2.94Å; C407-H516 PolarHBondContact SG-ND1 3.17Å
408	R	79.9	Confident	70.3	Confident	77 Å²	77	51 Å²	51	29%	0.291	29%	0.288	S	S	.	.			trans	-119.2	14.4	177.4	-69.1	-159.4	179.3	-165.3	-5.5	114.2	S404 S410 S411 I412 C487 C513	S404-R408 PolarHBondContact OG-NE 3.02Å; S404-R408 VanDerWaalsContact OG-NE 3.15Å; R408-S410 VanDerWaalsContact C-N 3.28Å; R408-S410 PolarHBondContact O-N 2.84Å; R408-S411 PolarHBondContact O-N 3.11Å; R408-S411 VanDerWaalsContact O-N 3.1Å; R408-S411 PolarHBondContact O-OG 3.41Å; R408-I412 HydrophobicContact CB-CD1 4.12Å; R408-I412 WeakPolarHBondContact O-CD1 3.25Å; R408-I412 WeakPolarHBondContact O-CG1 3.46Å; R408-I412 PolarHBondContact O-N 3.07Å; R408-C487 PolarHBondContact NH1-O 3.5Å; R408-C513 PolarHBondContact N-SG 3.07Å
409	C	77.2	Confident	67.5	Low	51 Å²	51	54.3 Å²	54.3	35%	0.345	31%	0.308	S	S	.	.	H	α-helix	trans	-57.6	-38.5	-175	-66.7	0	0	0	0	113.3	S411 I412 G413 C513 H516	C409-S411 VanDerWaalsContact C-N 3.34Å; C409-S411 PolarHBondContact O-N 2.88Å; C409-I412 PolarHBondContact O-N 2.75Å; C409-G413 PolarHBondContact O-N 2.89Å; C409-C513 VanDerWaalsContact SG-SG 3.62Å; C409-H516 PolarHBondContact SG-ND1 3.43Å
410	S	74.4	Confident	64.4	Low	101 Å²	101	59.9 Å²	59.9	71%	0.706	34%	0.338	S	S	*	.	H	α-helix	trans	-61.6	-40.2	177	50.9	0	0	0	0	112.8	R408	R408-S410 VanDerWaalsContact C-N 3.28Å; R408-S410 PolarHBondContact O-N 2.84Å
411	S	68.4	Low	61.3	Low	47 Å²	47	64.2 Å²	64.2	33%	0.329	37%	0.368	S	S	.	.	H	α-helix	trans	-75.3	-26.5	-179.9	62.6	0	0	0	0	114.1	R408 C409	R408-S411 PolarHBondContact O-N 3.11Å; R408-S411 VanDerWaalsContact O-N 3.1Å; R408-S411 PolarHBondContact O-OG 3.41Å; C409-S411 VanDerWaalsContact C-N 3.34Å; C409-S411 PolarHBondContact O-N 2.88Å
412	I	68	Low	58.3	Low	7 Å²	7	68.9 Å²	68.9	4%	0.036	40%	0.401	C	S	.	.	H	α-helix	trans	-80.7	-35.3	-176.7	-64.9	160.7	0	0	0	111.1	R408 C409 N414 I415 C513	R408-I412 HydrophobicContact CB-CD1 4.12Å; R408-I412 WeakPolarHBondContact O-CD1 3.25Å; R408-I412 WeakPolarHBondContact O-CG1 3.46Å; R408-I412 PolarHBondContact O-N 3.07Å; C409-I412 PolarHBondContact O-N 2.75Å; I412-N414 VanDerWaalsContact C-N 3.33Å; I412-N414 PolarHBondContact O-N 3.46Å; I412-I415 PolarHBondContact O-N 3.34Å; I412-C513 HydrophobicContact CD1-CB 3.91Å; I412-C513 VanDerWaalsContact CD1-N 3.26Å
413	G	56.2	Low	55.5	Low	27 Å²	27	74.6 Å²	74.6	28%	0.278	43%	0.431	S	S	.	.	H	α-helix	trans	-59.8	-39.1	-178.8	0	0	0	0	0	113.5	C409 I415 H417	C409-G413 PolarHBondContact O-N 2.89Å; G413-I415 VanDerWaalsContact C-N 3.32Å; G413-I415 PolarHBondContact O-N 3.43Å; G413-H417 PolarHBondContact O-CD2 3.43Å; G413-H417 VanDerWaalsContact O-CD2 3.25Å
414	N	45	Very low	52.8	Low	128 Å²	128	75.4 Å²	75.4	68%	0.684	45%	0.445	S	S	*	.	H	α-helix	trans	-71.8	-21.6	-174.1	-72.5	-2.5	0	0	0	114.3	I412	I412-N414 VanDerWaalsContact C-N 3.33Å; I412-N414 PolarHBondContact O-N 3.46Å
415	I	47.2	Very low	50.3	Low	41 Å²	41	82.8 Å²	82.8	21%	0.21	48%	0.483	C	S	.	.	H	α-helix	trans	-91.4	-28.1	-172.4	-66.5	165.4	0	0	0	112.2	I412 G413 H417 S418 V419	I412-I415 PolarHBondContact O-N 3.34Å; G413-I415 VanDerWaalsContact C-N 3.32Å; G413-I415 PolarHBondContact O-N 3.43Å; I415-H417 VanDerWaalsContact C-N 3.31Å; I415-S418 PolarHBondContact O-OG 3.47Å; I415-V419 WeakPolarHBondContact O-CG2 3.4Å
416	N	38.9	Very low	48	Very low	53 Å²	53	86 Å²	86	28%	0.283	51%	0.512	S	S	.	.	H	α-helix	trans	-77.8	-20.6	179	-63	-26.5	0	0	0	112.2	Q61 R538	Q61-N416 PolarHBondContact NE2-ND2 2.79Å; N416-R538 PolarHBondContact OD1-NH2 2.91Å
417	H	30.8	Very low	45.7	Very low	151 Å²	151	87.5 Å²	87.5	70%	0.699	53%	0.526	S	S	*	.	H	α-helix	trans	-83.6	-28	175.7	-71.7	-65	0	0	0	113.4	G413 I415 V419	G413-H417 PolarHBondContact O-CD2 3.43Å; G413-H417 VanDerWaalsContact O-CD2 3.25Å; I415-H417 VanDerWaalsContact C-N 3.31Å; H417-V419 PolarHBondContact O-N 3.49Å
418	S	28.7	Very low	43	Very low	71 Å²	71	88 Å²	88	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-78.8	-16.3	-178.1	70.7	0	0	0	0	114.5	I415 S421	I415-S418 PolarHBondContact O-OG 3.47Å; S418-S421 PolarHBondContact O-OG 3.01Å
419	V	35	Very low	40.6	Very low	68 Å²	68	95.2 Å²	95.2	41%	0.412	57%	0.57	S	S	.	*	S	Bend	trans	-87	-17.2	-178.7	-176.1	0	0	0	0	112.2	I415 H417	I415-V419 WeakPolarHBondContact O-CG2 3.4Å; H417-V419 PolarHBondContact O-N 3.49Å
420	N	29.7	Very low	38.5	Very low	118 Å²	118	96.9 Å²	96.9	63%	0.631	58%	0.582	S	S	*	*	S	Bend	trans	-99.3	-6.5	178.8	-77	-5.4	0	0	0	114
421	S	27.8	Very low	36.4	Very low	90 Å²	90	98.4 Å²	98.4	63%	0.629	58%	0.582	S	S	*	*	S	Bend	trans	-97.2	8.4	-176.6	58.8	0	0	0	0	114.6	S418	S418-S421 PolarHBondContact O-OG 3.01Å
422	S	29.3	Very low	34.8	Very low	98 Å²	98	102.2 Å²	102.2	69%	0.685	60%	0.599	S	S	*	*	S	Bend	trans	-120.4	25	179.1	70.8	0	0	0	0	113.3
423	L	28.9	Very low	33.1	Very low	123 Å²	123	108.1 Å²	108.1	64%	0.644	63%	0.629	S	S	*	*			trans	-137.4	63.5	-175.3	-98	154.3	0	0	0	110
424	S	25.8	Very low	31.9	Very low	95 Å²	95	117.6 Å²	117.6	66%	0.664	66%	0.658	S	S	*	*			trans	-158	92.5	168.2	43.1	0	0	0	0	106.9
425	D	25.5	Very low	31.2	Very low	165 Å²	165	118.6 Å²	118.6	88%	0.882	66%	0.663	S	S	*	*			trans	-172	146.6	151.1	-87.1	-28.5	0	0	0	108.4
426	V	28.6	Very low	30.8	Very low	147 Å²	147	121 Å²	121	89%	0.891	68%	0.682	S	S	*	*			trans	98.6	78.9	175.3	-162.8	0	0	0	0	117
427	S	31.8	Very low	30.6	Very low	122 Å²	122	126 Å²	126	85%	0.853	71%	0.707	S	S	*	*			trans	176.5	123.4	132.1	60.3	0	0	0	0	107.9
428	G	26.9	Very low	30.6	Very low	69 Å²	69	124.1 Å²	124.1	71%	0.711	71%	0.712	S	S	*	*			cis	115.8	92.8	19.7	0	0	0	0	0	110.5
429	Y	29	Very low	30.9	Very low	228 Å²	228	126.7 Å²	126.7	89%	0.894	73%	0.729	S	S	*	*			trans	87	124.8	155.6	-83.3	-91.6	0	0	0	123.6
430	S	31.8	Very low	30.6	Very low	86 Å²	86	127 Å²	127	60%	0.601	75%	0.747	S	S	*	*			trans	69.7	138.6	140.5	-79.5	0	0	0	0	119.7
431	D	30.3	Very low	30.6	Very low	132 Å²	132	133 Å²	133	71%	0.706	76%	0.76	S	S	*	*			cis	-161.3	163.1	14.3	-96.2	-23.2	0	0	0	111.1
432	D	34.8	Very low	30.7	Very low	127 Å²	127	133.3 Å²	133.3	68%	0.679	76%	0.762	S	S	*	*			trans	89.8	97.6	146.7	-60.9	-22	0	0	0	125.7
433	I	32.2	Very low	30.9	Very low	131 Å²	131	134.1 Å²	134.1	67%	0.672	76%	0.763	S	S	*	*				53.7	107.7	116	-50.3	160.8	0	0	0	119.3
434	Y	31.6	Very low	30.9	Very low	227 Å²	227	134.9 Å²	134.9	89%	0.89	77%	0.768	S	S	*	*				179.7	122.6	107	-108.4	-80.6	0	0	0	111
435	N	30.1	Very low	31.1	Very low	148 Å²	148	138 Å²	138	79%	0.791	78%	0.777	S	S	*	*			trans	-104.5	-167.7	169	-129.9	-4.5	0	0	0	106.8
436	P	38.7	Very low	31.4	Very low	93 Å²	93	133.5 Å²	133.5	60%	0.604	77%	0.77	S	S	*	*			cis	-140.3	-168.4	-25.3	31.3	-7.9	0	0	0	112.9
437	L	35.3	Very low	31.5	Very low	156 Å²	156	131.2 Å²	131.2	82%	0.817	77%	0.767	S	S	*	*			trans	138.1	107.7	141.5	-72.8	154.2	0	0	0	111.5
438	S	30.3	Very low	31.7	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	77%	0.772	S	S	*	*				78	111.6	70	-82.3	0	0	0	0	116.6
439	S	35.3	Very low	32	Very low	124 Å²	124	140.1 Å²	140.1	87%	0.867	78%	0.78	S	S	*	*			trans	153.6	126.1	131.5	64	0	0	0	0	107.9
440	G	28	Very low	32.2	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	77%	0.769	S	S	*	*				106.4	102.6	50.1	0	0	0	0	0	108.5
441	R	31.1	Very low	32.2	Very low	244 Å²	244	140.4 Å²	140.4	92%	0.921	79%	0.786	S	S	*	*				173	124.9	115	-123.7	166.8	168.9	-175.4	-4	107.8
442	S	29.6	Very low	32.1	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	79%	0.794	S	S	*	*				48	124	78.5	-142.6	0	0	0	0	112.9
443	T	33.3	Very low	32.2	Very low	115 Å²	115	143.2 Å²	143.2	71%	0.706	80%	0.801	S	S	*	*				-174	137.1	58.9	40.8	0	0	0	0	112.7
444	N	29.1	Very low	32.2	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	80%	0.8	S	S	*	*				47.8	134.8	126	-69.3	-5	0	0	0	125.6
445	N	29.2	Very low	32.1	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	79%	0.792	S	S	*	*			trans	108.5	131.3	133.1	-67.5	-16.2	0	0	0	120.8
446	G	32.3	Very low	32.2	Very low	71 Å²	71	140.1 Å²	140.1	73%	0.732	79%	0.794	S	S	*	*			trans	121.4	77.2	159.9	0	0	0	0	0	113.7
447	A	31	Very low	31.6	Very low	100 Å²	100	142.3 Å²	142.3	83%	0.826	80%	0.8	S	S	*	*				63.4	97.6	86.8	0	0	0	0	0	114.5
448	E	36.1	Very low	31.4	Very low	204 Å²	204	141.8 Å²	141.8	95%	0.953	80%	0.803	S	S	*	*				-159.6	131.6	128.7	-112	-179.1	-171.9	0	0	111
449	I	33.7	Very low	31.1	Very low	173 Å²	173	140.7 Å²	140.7	89%	0.887	80%	0.795	S	S	*	*			trans	-107.4	141.7	-164.7	-77	166	0	0	0	109
450	G	32.3	Very low	30.8	Very low	64 Å²	64	140.1 Å²	140.1	66%	0.66	79%	0.786	S	S	*	*				118.9	99.4	128.5	0	0	0	0	0	118.3
451	R	31.3	Very low	30.9	Very low	256 Å²	256	144.6 Å²	144.6	97%	0.966	79%	0.787	S	S	*	*				178.1	116.5	106.8	-97.3	174.8	174.5	173.7	-0.5	111.4
452	T	28.7	Very low	30.5	Very low	140 Å²	140	139.2 Å²	139.2	86%	0.859	79%	0.785	S	S	*	*			trans	-128.5	124.6	164.6	33.6	0	0	0	0	109
453	Q	36.2	Very low	30.5	Very low	178 Å²	178	141.1 Å²	141.1	83%	0.832	79%	0.793	S	S	*	*			trans	-159.8	144.4	156.2	-70	-162.2	9.6	0	0	105.3
454	Q	33.3	Very low	30.1	Very low	141 Å²	141	144 Å²	144	66%	0.659	80%	0.799	S	S	*	*			cis	-171.3	148.2	0.7	-126.8	179.2	-13.1	0	0	106.5
455	K	29.2	Very low	30.2	Very low	166 Å²	166	142.3 Å²	142.3	72%	0.722	80%	0.795	S	S	*	*			trans	46.6	133.7	140.9	-74.4	174.7	173.9	178.2	0	119.4
456	T	31.4	Very low	30	Very low	134 Å²	134	141.8 Å²	141.8	82%	0.822	79%	0.792	S	S	*	*				-161.3	131.9	76	-61.7	0	0	0	0	112.7
457	L	27.5	Very low	30	Very low	140 Å²	140	145.3 Å²	145.3	73%	0.733	80%	0.8	S	S	*	*			trans	-70.2	147.3	167.5	-83.1	93.1	0	0	0	111.5
458	V	30.3	Very low	29.7	Very low	145 Å²	145	151.7 Å²	151.7	88%	0.879	80%	0.803	S	S	*	*			trans	-135.6	109.6	135.6	-178.1	0	0	0	0	108.8
459	S	24.3	Very low	29.4	Very low	90 Å²	90	152.8 Å²	152.8	63%	0.629	80%	0.799	S	S	*	*			trans	-103.6	137	159.5	168	0	0	0	0	106.2
460	T	29.5	Very low	29	Very low	111 Å²	111	151.2 Å²	151.2	68%	0.681	79%	0.793	S	S	*	*			trans	-171.3	123.7	133.2	11.1	0	0	0	0	113.3
461	Q	29.7	Very low	28.9	Very low	170 Å²	170	153.1 Å²	153.1	79%	0.794	80%	0.796	S	S	*	*			trans	77.2	116.3	133.7	-75.9	169.2	12.5	0	0	122
462	C	22.5	Very low	28.6	Very low	130 Å²	130	149.2 Å²	149.2	88%	0.878	79%	0.786	S	S	*	*			trans	-56.9	141	153.2	-55.8	0	0	0	0	112
463	T	28.7	Very low	28.6	Very low	136 Å²	136	148.7 Å²	148.7	83%	0.834	78%	0.783	S	S	*	*			trans	-155.4	111.5	159.3	-17.5	0	0	0	0	108.7
464	E	24.6	Very low	28	Very low	177 Å²	177	146.3 Å²	146.3	83%	0.827	78%	0.776	S	S	*	*			trans	-78.6	170.7	152	-78.4	-164.8	154.2	0	0	108.8
465	P	32.9	Very low	27.6	Very low	103 Å²	103	147.3 Å²	147.3	67%	0.669	79%	0.786	S	S	*	*			cis	-128	-173.8	-25.1	28.4	-6.6	0	0	0	111.8
466	N	24.9	Very low	27.6	Very low	148 Å²	148	145 Å²	145	79%	0.791	79%	0.786	S	S	*	*			trans	68.1	103.3	162.5	-71.2	-36.9	0	0	0	118.4
467	T	32.5	Very low	27.3	Very low	146 Å²	146	142.3 Å²	142.3	90%	0.896	77%	0.773	S	S	*	*			trans	-155.1	129.8	131.8	10.2	0	0	0	0	111.2	Y469	T467-Y469 PolarHBondContact O-N 2.86Å
468	R	24.9	Very low	27.2	Very low	234 Å²	234	140.5 Å²	140.5	88%	0.883	77%	0.769	S	S	*	*			trans	-57.5	127.2	176.7	-58.3	166.3	-162.4	167.2	4.7	109.6
469	Y	28.9	Very low	27.4	Very low	226 Å²	226	138.1 Å²	138.1	89%	0.886	75%	0.75	S	S	*	*			trans	-132	101.3	148.7	-108.8	-86.2	0	0	0	109.6	T467 S471	T467-Y469 PolarHBondContact O-N 2.86Å; Y469-S471 PolarHBondContact O-N 3.02Å
470	N	25.6	Very low	28.8	Very low	140 Å²	140	137.7 Å²	137.7	75%	0.749	74%	0.74	S	S	*	*			trans	-66.9	116.8	162.4	-94.5	-45.8	0	0	0	108.4
471	S	29	Very low	30.3	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	72%	0.715	S	S	*	*			trans	-133.1	86.5	147.5	51.9	0	0	0	0	108.2	Y469 T473	Y469-S471 PolarHBondContact O-N 3.02Å; S471-T473 PolarHBondContact O-N 3.2Å
472	K	25.8	Very low	32.2	Very low	174 Å²	174	131 Å²	131	76%	0.757	71%	0.714	S	S	*	*			trans	-56.3	104	166.9	-82.4	174.9	174.5	174	0	109
473	T	27.9	Very low	35	Very low	129 Å²	129	127.4 Å²	127.4	79%	0.791	69%	0.689	S	S	*	*			trans	-127	76.8	149.6	45.1	0	0	0	0	107.6	S471 N475	S471-T473 PolarHBondContact O-N 3.2Å; T473-N475 VanDerWaalsContact C-N 3.33Å; T473-N475 PolarHBondContact O-N 3.31Å
474	N	25.2	Very low	37.5	Very low	129 Å²	129	122.7 Å²	122.7	69%	0.69	66%	0.658	S	S	*	*			trans	-69.8	89.2	172.1	-81.5	-13	0	0	0	109.4
475	N	25.1	Very low	40.2	Very low	161 Å²	161	118.9 Å²	118.9	86%	0.861	65%	0.649	S	S	*	*			trans	-118.1	48.6	156.1	-80.3	-13.4	0	0	0	109.2	T473 S477	T473-N475 VanDerWaalsContact C-N 3.33Å; T473-N475 PolarHBondContact O-N 3.31Å; N475-S477 PolarHBondContact O-N 3.47Å; N475-S477 VanDerWaalsContact O-N 3.12Å
476	T	27.5	Very low	42.5	Very low	119 Å²	119	115 Å²	115	73%	0.73	63%	0.627	S	S	*	*			trans	-76.6	93.1	166.6	16.4	0	0	0	0	108.2	P478	T476-P478 WeakPolarHBondContact O-CD 3.38Å; T476-P478 VanDerWaalsContact O-N 3.15Å
477	S	26.5	Very low	45.5	Very low	77 Å²	77	107.9 Å²	107.9	54%	0.538	59%	0.589	S	S	.	*			trans	-53.6	117.3	163.7	-174.1	0	0	0	0	108	N475	N475-S477 PolarHBondContact O-N 3.47Å; N475-S477 VanDerWaalsContact O-N 3.12Å
478	P	25.3	Very low	48.2	Very low	101 Å²	101	101 Å²	101	66%	0.656	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	145.4	176.9	31.3	-31.2	0	0	0	106.9	T476	T476-P478 WeakPolarHBondContact O-CD 3.38Å; T476-P478 VanDerWaalsContact O-N 3.15Å
479	M	34.4	Very low	51.3	Low	96 Å²	96	90 Å²	90	47%	0.473	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.3	-5.2	160	-53	-137.5	74.7	0	0	119.5	P340	P340-M479 HydrophobicContact CG-SD 4.02Å
480	L	53	Low	54.3	Low	81 Å²	81	79.3 Å²	79.3	42%	0.424	46%	0.464	S	S	.	.			trans	-102.7	102	170.6	-70	169.5	0	0	0	110	W338 W491	W338-L480 HydrophobicContact CE3-CD2 4.48Å; L480-W491 HydrophobicContact CD2-CZ2 4.41Å
481	A	61.3	Low	57.5	Low	20 Å²	20	73.1 Å²	73.1	17%	0.165	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-51.5	142.2	166.4	0	0	0	0	0	109.4	T483 R507 S570	A481-T483 PolarHBondContact O-N 3.02Å; A481-R507 PolarHBondContact O-NH1 2.79Å; A481-R507 PolarHBondContact O-NH2 2.85Å; A481-S570 VanDerWaalsContact CB-CB 3.42Å
482	P	70.4	Confident	60.5	Low	119 Å²	119	68.2 Å²	68.2	77%	0.773	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-61.7	141.4	178.9	24.2	-32.1	0	0	0	110.2	L484 R507	P482-L484 PolarHBondContact O-N 3.1Å; P482-R507 PolarHBondContact O-NH2 2.86Å
483	T	80.3	Confident	63.6	Low	56 Å²	56	60.1 Å²	60.1	34%	0.344	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-60.7	133.5	170.7	-59.6	0	0	0	0	109.5	A481 C487 T489	A481-T483 PolarHBondContact O-N 3.02Å; T483-C487 HydrophobicContact CG2-CB 4.31Å; T483-C487 WeakPolarHBondContact CG2-O 3.47Å; T483-T489 VanDerWaalsContact CB-OG1 3.29Å; T483-T489 WeakPolarHBondContact CB-OG1 3.42Å; T483-T489 WeakPolarHBondContact CG2-OG1 3.36Å; T483-T489 PolarHBondContact OG1-OG1 3.25Å
484	L	82	Confident	66.6	Low	36 Å²	36	54.2 Å²	54.2	19%	0.188	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-60.2	138.8	177.5	-145.3	70.9	0	0	0	110.4	P482 G486 C487 D509 R538 A540 Q721	P482-L484 PolarHBondContact O-N 3.1Å; L484-G486 PolarHBondContact O-N 3.01Å; L484-C487 HydrophobicContact CB-CB 4.08Å; L484-C487 VanDerWaalsContact O-CB 3.29Å; L484-C487 WeakPolarHBondContact O-CB 3.4Å; L484-C487 PolarHBondContact O-N 3.24Å; L484-D509 HydrophobicContact CB-CB 4.47Å; L484-R538 HydrophobicContact CD2-CB 4.04Å; L484-A540 HydrophobicContact CD1-CB 4.26Å; L484-Q721 HydrophobicContact CD2-CG 3.84Å
485	P	80	Confident	69.8	Low	97 Å²	97	48.5 Å²	48.5	63%	0.63	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	130.8	-179.5	-28.5	35	0	0	0	112.2	C487 Q721	P485-C487 PolarHBondContact O-N 2.99Å; P485-Q721 PolarHBondContact O-NE2 2.84Å
486	G	82.1	Confident	72.8	Confident	21 Å²	21	42.5 Å²	42.5	22%	0.216	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	-0.5	-177.5	0	0	0	0	0	116.6	L484	L484-G486 PolarHBondContact O-N 3.01Å
487	C	87.7	Confident	75.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-96.7	156.4	176	-62.3	0	0	0	0	111.1	R408 T483 L484 P485 D509 R510 R538	R408-C487 PolarHBondContact NH1-O 3.5Å; T483-C487 HydrophobicContact CG2-CB 4.31Å; T483-C487 WeakPolarHBondContact CG2-O 3.47Å; L484-C487 HydrophobicContact CB-CB 4.08Å; L484-C487 VanDerWaalsContact O-CB 3.29Å; L484-C487 WeakPolarHBondContact O-CB 3.4Å; L484-C487 PolarHBondContact O-N 3.24Å; P485-C487 PolarHBondContact O-N 2.99Å; C487-D509 HydrophobicContact CB-CB 4.05Å; C487-R510 CarbonylContact C-O 3.6Å; C487-R510 WeakPolarHBondContact CA-O 3.31Å; C487-R538 VanDerWaalsContact SG-CD 3.52Å
488	T	88.7	Confident	78.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.4	160.8	-61.5	0	0	0	0	106.3	T402 L490 R510 V512	T402-T488 VanDerWaalsContact OG1-CG2 3.31Å; T402-T488 WeakPolarHBondContact OG1-CG2 3.41Å; T488-L490 HydrophobicContact CG2-CD2 4.07Å; T488-R510 PolarHBondContact N-O 3.34Å; T488-R510 PolarHBondContact O-N 3.46Å; T488-V512 WeakPolarHBondContact CB-O 3.47Å; T488-V512 PolarHBondContact OG1-O 3.09Å
489	T	91	Very high	81.6	Confident	4 Å²	4	33.6 Å²	33.6	3%	0.025	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.4	171.1	-54.1	0	0	0	0	109.3	T402 T483 W491 R507 D509	T402-T489 PolarHBondContact OG1-O 2.77Å; T483-T489 VanDerWaalsContact CB-OG1 3.29Å; T483-T489 WeakPolarHBondContact CB-OG1 3.42Å; T483-T489 WeakPolarHBondContact CG2-OG1 3.36Å; T483-T489 PolarHBondContact OG1-OG1 3.25Å; T489-W491 VanDerWaalsContact CB-CZ3 3.41Å; T489-W491 HydrophobicContact CG2-CD2 4Å; T489-W491 HydrophobicContact CG2-CE3 3.84Å; T489-W491 HydrophobicContact CG2-CH2 3.03Å; T489-W491 HydrophobicContact CG2-CZ2 3.14Å; T489-W491 HydrophobicContact CG2-CZ3 3.41Å; T489-W491 VanDerWaalsContact CG2-CZ3 3.41Å; T489-W491 WeakPolarHBondContact O-CZ3 3.43Å; T489-R507 HydrophobicContact CG2-CG 3.64Å; T489-R507 VanDerWaalsContact CG2-CZ 3.48Å; T489-R507 VanDerWaalsContact CG2-NE 3.26Å; T489-R507 PolarHBondContact OG1-NH2 3.22Å; T489-D509 VanDerWaalsContact CA-OD1 3.27Å; T489-D509 WeakPolarHBondContact CA-OD1 3.17Å; T489-D509 WeakPolarHBondContact CB-OD1 3.39Å; T489-D509 VanDerWaalsContact CG2-OD1 3.26Å; T489-D509 WeakPolarHBondContact CG2-OD1 3.38Å; T489-D509 PolarHBondContact OG1-OD1 3.21Å
490	L	91.9	Very high	84.3	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.8	-178.5	-59.8	175.3	0	0	0	109.4	M386 T488 R507 F508 R510 V512	M386-L490 HydrophobicContact SD-CD2 3.66Å; T488-L490 HydrophobicContact CG2-CD2 4.07Å; L490-R507 WeakPolarHBondContact O-CA 3.33Å; L490-F508 HydrophobicContact CB-CD1 3.98Å; L490-F508 HydrophobicContact CB-CD2 4.17Å; L490-F508 HydrophobicContact CB-CE1 3.47Å; L490-F508 VanDerWaalsContact CB-CE1 3.47Å; L490-F508 HydrophobicContact CB-CE2 3.74Å; L490-F508 HydrophobicContact CB-CG 4.29Å; L490-F508 HydrophobicContact CB-CZ 3.36Å; L490-F508 HydrophobicContact CD1-CD2 4.2Å; L490-F508 HydrophobicContact CD1-CE2 3.42Å; L490-F508 VanDerWaalsContact CD1-CE2 3.42Å; L490-F508 HydrophobicContact CD1-CZ 3.64Å; L490-F508 HydrophobicContact CG-CE2 4.22Å; L490-F508 HydrophobicContact CG-CZ 4.17Å; L490-F508 PolarHBondContact N-O 2.89Å; L490-F508 WeakPolarHBondContact O-CD1 3.47Å; L490-F508 PolarHBondContact O-N 3.05Å; L490-F508 VanDerWaalsContact O-O 3.07Å; L490-R510 HydrophobicContact CD1-CB 4.15Å; L490-R510 HydrophobicContact CD1-CG 4.31Å; L490-V512 HydrophobicContact CD1-CG2 4.02Å
491	W	92.2	Very high	85.9	Confident	11 Å²	11	29.6 Å²	29.6	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.2	-179.1	-67.5	-107	0	0	0	109.5	W338 I400 T401 E403 L480 T489 I505 L506 R507	W338-W491 AromaticContact CD2-CD1 3.85Å; W338-W491 HydrophobicContact CD2-CD2 4.01Å; W338-W491 AromaticContact CD2-CE2 3.85Å; W338-W491 HydrophobicContact CD2-CG 4Å; W338-W491 HydrophobicContact CD2-CZ2 4.36Å; W338-W491 AromaticContact CD2-NE1 3.74Å; W338-W491 AromaticContact CE2-CG 3.91Å; W338-W491 AromaticContact CE3-CD1 3.77Å; W338-W491 AromaticContact CE3-CD2 3.42Å; W338-W491 HydrophobicContact CE3-CD2 3.42Å; W338-W491 VanDerWaalsContact CE3-CD2 3.42Å; W338-W491 AromaticContact CE3-CE2 2.98Å; W338-W491 AromaticContact CE3-CE3 3.94Å; W338-W491 HydrophobicContact CE3-CE3 3.94Å; W338-W491 AromaticContact CE3-CG 3.88Å; W338-W491 HydrophobicContact CE3-CG 3.88Å; W338-W491 AromaticContact CE3-CH2 3.68Å; W338-W491 HydrophobicContact CE3-CH2 3.68Å; W338-W491 AromaticContact CE3-CZ2 3.15Å; W338-W491 HydrophobicContact CE3-CZ2 3.15Å; W338-W491 HydrophobicContact CE3-CZ3 4.04Å; W338-W491 AromaticContact CE3-NE1 3.24Å; W338-W491 HydrophobicContact CH2-CB 4.17Å; W338-W491 AromaticContact CH2-CD2 3.04Å; W338-W491 HydrophobicContact CH2-CD2 3.04Å; W338-W491 AromaticContact CH2-CE2 3.58Å; W338-W491 AromaticContact CH2-CE3 2.78Å; W338-W491 HydrophobicContact CH2-CE3 2.78Å; W338-W491 AromaticContact CH2-CG 3.66Å; W338-W491 HydrophobicContact CH2-CG 3.66Å; W338-W491 AromaticContact CH2-CH2 3.62Å; W338-W491 HydrophobicContact CH2-CH2 3.62Å; W338-W491 AromaticContact CH2-CZ2 3.86Å; W338-W491 HydrophobicContact CH2-CZ2 3.86Å; W338-W491 AromaticContact CH2-CZ3 3.08Å; W338-W491 HydrophobicContact CH2-CZ3 3.08Å; W338-W491 HydrophobicContact CZ2-CB 3.82Å; W338-W491 AromaticContact CZ2-CD2 3.6Å; W338-W491 HydrophobicContact CZ2-CD2 3.6Å; W338-W491 AromaticContact CZ2-CE3 3.67Å; W338-W491 HydrophobicContact CZ2-CE3 3.67Å; W338-W491 AromaticContact CZ2-CG 3.68Å; W338-W491 HydrophobicContact CZ2-CG 3.68Å; W338-W491 HydrophobicContact CZ2-CZ3 4.3Å; W338-W491 AromaticContact CZ3-CD2 2.99Å; W338-W491 HydrophobicContact CZ3-CD2 2.99Å; W338-W491 AromaticContact CZ3-CE2 2.93Å; W338-W491 AromaticContact CZ3-CE3 3.02Å; W338-W491 HydrophobicContact CZ3-CE3 3.02Å; W338-W491 AromaticContact CZ3-CG 3.81Å; W338-W491 HydrophobicContact CZ3-CG 3.81Å; W338-W491 AromaticContact CZ3-CH2 2.9Å; W338-W491 HydrophobicContact CZ3-CH2 2.9Å; W338-W491 AromaticContact CZ3-CZ2 2.91Å; W338-W491 HydrophobicContact CZ3-CZ2 2.91Å; W338-W491 AromaticContact CZ3-CZ3 2.95Å; W338-W491 HydrophobicContact CZ3-CZ3 2.95Å; W338-W491 AromaticContact CZ3-NE1 3.68Å; I400-W491 CarbonylContact C-O 3.38Å; I400-W491 WeakPolarHBondContact CA-O 3.36Å; T401-W491 PolarHBondContact N-O 2.91Å; T401-W491 PolarHBondContact O-N 3.32Å; T401-W491 PolarHBondContact OG1-O 3.01Å; E403-W491 HydrophobicContact CG-CH2 4.44Å; L480-W491 HydrophobicContact CD2-CZ2 4.41Å; T489-W491 VanDerWaalsContact CB-CZ3 3.41Å; T489-W491 HydrophobicContact CG2-CD2 4Å; T489-W491 HydrophobicContact CG2-CE3 3.84Å; T489-W491 HydrophobicContact CG2-CH2 3.03Å; T489-W491 HydrophobicContact CG2-CZ2 3.14Å; T489-W491 HydrophobicContact CG2-CZ3 3.41Å; T489-W491 VanDerWaalsContact CG2-CZ3 3.41Å; T489-W491 WeakPolarHBondContact O-CZ3 3.43Å; W491-I505 HydrophobicContact CB-CG2 4.28Å; W491-I505 HydrophobicContact CG-CG2 4.49Å; W491-L506 CarbonylContact C-O 3.58Å; W491-L506 VanDerWaalsContact CA-O 3.26Å; W491-L506 WeakPolarHBondContact CA-O 3.21Å; W491-R507 HydrophobicContact CZ2-CG 4.49Å
492	I	92.7	Very high	87.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.4	168.1	-72.2	149.8	0	0	0	107.2	F398 T399 I400 I494 I505 L506 F508 P524 L535	F398-I492 HydrophobicContact CD1-CG2 3.84Å; T399-I492 WeakPolarHBondContact O-CA 3.44Å; I400-I492 HydrophobicContact CG1-CG1 4.05Å; I492-I494 HydrophobicContact CG2-CG1 4.24Å; I492-I505 CarbonylContact O-C 3.37Å; I492-I505 WeakPolarHBondContact O-CA 3.24Å; I492-L506 HydrophobicContact CB-CB 4.37Å; I492-L506 PolarHBondContact N-O 2.94Å; I492-L506 PolarHBondContact O-N 2.85Å; I492-F508 HydrophobicContact CB-CE1 4.47Å; I492-F508 HydrophobicContact CD1-CD1 4Å; I492-F508 HydrophobicContact CD1-CE1 3.41Å; I492-F508 VanDerWaalsContact CD1-CE1 3.41Å; I492-F508 HydrophobicContact CD1-CZ 3.86Å; I492-F508 HydrophobicContact CG1-CD1 4.44Å; I492-F508 HydrophobicContact CG1-CE1 3.59Å; I492-F508 HydrophobicContact CG1-CZ 4.16Å; I492-P524 HydrophobicContact CD1-CB 4.34Å; I492-P524 HydrophobicContact CD1-CG 4.03Å; I492-L535 HydrophobicContact CD1-CD2 3.94Å
493	T	90.9	Very high	87.7	Confident	4 Å²	4	30.5 Å²	30.5	3%	0.025	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.8	170.1	-52.6	0	0	0	0	109	F398 T399 F495 R502 R504 I505	F398-T493 CarbonylContact C-O 3.12Å; F398-T493 WeakPolarHBondContact CA-O 3.49Å; T399-T493 PolarHBondContact N-O 2.98Å; T399-T493 PolarHBondContact O-N 2.86Å; T399-T493 WeakPolarHBondContact OG1-CB 3.38Å; T493-F495 HydrophobicContact CG2-CD2 4.04Å; T493-F495 HydrophobicContact CG2-CE1 3.94Å; T493-F495 HydrophobicContact CG2-CE2 3.36Å; T493-F495 HydrophobicContact CG2-CZ 3.32Å; T493-R502 HydrophobicContact CG2-CG 3.64Å; T493-R504 WeakPolarHBondContact CA-O 3.26Å; T493-I505 HydrophobicContact CG2-CG1 3.87Å
494	I	91.1	Very high	87.9	Confident	6 Å²	6	30.2 Å²	30.2	3%	0.031	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.7	179	-47.1	-177.6	0	0	0	107.6	F396 F398 I492 L503 R504 L506 L730	F396-I494 HydrophobicContact CB-CG2 4.09Å; F396-I494 HydrophobicContact CD1-CG2 4.14Å; F396-I494 HydrophobicContact CG-CG2 4.26Å; F398-I494 HydrophobicContact CD1-CB 4.44Å; F398-I494 HydrophobicContact CD1-CD1 4.42Å; F398-I494 HydrophobicContact CD1-CG1 3.83Å; F398-I494 HydrophobicContact CD1-CG2 4.33Å; F398-I494 HydrophobicContact CE1-CB 4.35Å; F398-I494 HydrophobicContact CE1-CD1 3.85Å; F398-I494 HydrophobicContact CE1-CG1 3.72Å; F398-I494 HydrophobicContact CE1-CG2 3.93Å; F398-I494 HydrophobicContact CZ-CG2 4.33Å; I492-I494 HydrophobicContact CG2-CG1 4.24Å; I494-L503 HydrophobicContact CG2-CD1 4.49Å; I494-L503 PolarHBondContact O-N 2.8Å; I494-R504 HydrophobicContact CB-CB 4.34Å; I494-R504 HydrophobicContact CD1-CB 4.19Å; I494-R504 HydrophobicContact CG1-CB 4.37Å; I494-R504 PolarHBondContact N-O 2.81Å; I494-R504 PolarHBondContact O-N 3.24Å; I494-L506 HydrophobicContact CD1-CD1 4.42Å; I494-L730 HydrophobicContact CD1-CD2 4.37Å
495	F	90.8	Very high	88	Confident	8 Å²	8	29.2 Å²	29.2	4%	0.035	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.5	177.3	-61.2	-87.2	0	0	0	110.6	I318 T332 L335 F396 L397 T399 T493 S497 L500 E501 R502	I318-F495 HydrophobicContact CD1-CD2 4.14Å; I318-F495 HydrophobicContact CD1-CE2 3.52Å; I318-F495 HydrophobicContact CD1-CZ 3.73Å; T332-F495 HydrophobicContact CG2-CE1 4.17Å; L335-F495 HydrophobicContact CD2-CZ 4.14Å; L335-F495 HydrophobicContact CG-CZ 4.44Å; F396-F495 WeakPolarHBondContact CA-O 3.29Å; L397-F495 HydrophobicContact CB-CB 4.25Å; L397-F495 PolarHBondContact N-O 2.84Å; L397-F495 PolarHBondContact O-N 3.42Å; T399-F495 HydrophobicContact CG2-CD2 4.25Å; T399-F495 HydrophobicContact CG2-CE2 3.82Å; T493-F495 HydrophobicContact CG2-CD2 4.04Å; T493-F495 HydrophobicContact CG2-CE1 3.94Å; T493-F495 HydrophobicContact CG2-CE2 3.36Å; T493-F495 HydrophobicContact CG2-CZ 3.32Å; F495-S497 PolarHBondContact O-N 2.83Å; F495-L500 WeakPolarHBondContact CD1-O 3.04Å; F495-E501 CarbonylContact C-O 3.45Å; F495-E501 VanDerWaalsContact CA-O 3.22Å; F495-E501 WeakPolarHBondContact CA-O 3.39Å; F495-R502 HydrophobicContact CD1-CB 4.05Å; F495-R502 HydrophobicContact CE1-CB 3.92Å; F495-R502 HydrophobicContact CE1-CG 4.29Å
496	N	89.6	Confident	88.4	Confident	36 Å²	36	24.9 Å²	24.9	19%	0.193	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	124.5	156.9	-178.6	-46.4	0	0	0	107.4	D498 T499 L500 E501 L503	N496-D498 VanDerWaalsContact C-N 3.26Å; N496-D498 PolarHBondContact O-N 3.47Å; N496-D498 PolarHBondContact OD1-N 2.97Å; N496-T499 WeakPolarHBondContact CB-OG1 3.37Å; N496-T499 PolarHBondContact OD1-N 3.41Å; N496-L500 WeakPolarHBondContact O-CA 3.42Å; N496-L500 PolarHBondContact O-N 3.06Å; N496-E501 HydrophobicContact CB-CB 4.33Å; N496-E501 PolarHBondContact N-O 2.92Å; N496-L503 HydrophobicContact CB-CD1 4.25Å; N496-L503 HydrophobicContact CB-CD2 4.29Å; N496-L503 HydrophobicContact CB-CG 4.33Å
497	S	90.7	Very high	88.7	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-7	-173.3	53.5	0	0	0	0	115.2	R284 L320 G394 Y395 F495	R284-S497 PolarHBondContact NH2-OG 2.82Å; L320-S497 WeakPolarHBondContact CD1-O 3.42Å; G394-S497 WeakPolarHBondContact O-CB 3.23Å; G394-S497 PolarHBondContact O-OG 2.93Å; Y395-S497 WeakPolarHBondContact CA-OG 3.01Å; Y395-S497 PolarHBondContact O-N 2.85Å; Y395-S497 PolarHBondContact O-OG 3.04Å; F495-S497 PolarHBondContact O-N 2.83Å
498	D	87.1	Confident	88.9	Confident	33 Å²	33	24.9 Å²	24.9	18%	0.176	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-41.3	175.5	-66.4	-40.3	0	0	0	111.7	R284 R289 N496 Q742	R284-D498 IonicContact CZ-OD1 2.82Å; R284-D498 IonicContact CZ-OD2 3.52Å; R284-D498 VanDerWaalsContact NH1-CG 3.32Å; R284-D498 IonicContact NH1-OD1 3.64Å; R284-D498 PolarHBondContact NH1-OD1 2.88Å; R284-D498 VanDerWaalsContact NH1-OD1 3.13Å; R284-D498 IonicContact NH1-OD2 3.13Å; R284-D498 PolarHBondContact NH1-OD2 3.34Å; R284-D498 IonicContact NH2-OD1 3.69Å; R284-D498 PolarHBondContact NH2-OD1 3.02Å; R284-D498 IonicContact NH2-OD2 3.96Å; R289-D498 IonicContact CZ-OD1 2.88Å; R289-D498 IonicContact NH1-OD1 3.93Å; R289-D498 PolarHBondContact NH1-OD1 3.06Å; R289-D498 IonicContact NH2-OD1 3.41Å; R289-D498 PolarHBondContact NH2-OD1 3.19Å; N496-D498 VanDerWaalsContact C-N 3.26Å; N496-D498 PolarHBondContact O-N 3.47Å; N496-D498 PolarHBondContact OD1-N 2.97Å; D498-Q742 PolarHBondContact OD2-NE2 3.29Å
499	T	86.5	Confident	88.9	Confident	76 Å²	76	25 Å²	25	47%	0.466	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-14	-177.7	61.5	0	0	0	0	113.6	N496 E501	N496-T499 WeakPolarHBondContact CB-OG1 3.37Å; N496-T499 PolarHBondContact OD1-N 3.41Å; T499-E501 PolarHBondContact O-N 3.49Å; T499-E501 VanDerWaalsContact OG1-CB 3.26Å; T499-E501 WeakPolarHBondContact OG1-CB 3.47Å; T499-E501 PolarHBondContact OG1-N 2.81Å
500	L	89.9	Confident	88.9	Confident	10 Å²	10	25.4 Å²	25.4	5%	0.052	12%	0.121	C	C	.	.			trans	55.7	22	-166.5	-61	179.2	0	0	0	113.5	I318 L320 T330 T332 L397 F495 N496 R502	I318-L500 HydrophobicContact CG2-CD1 4.36Å; I318-L500 HydrophobicContact CG2-CD2 4.07Å; I318-L500 WeakPolarHBondContact O-CD1 3.12Å; L320-L500 HydrophobicContact CD1-CD2 4.29Å; L320-L500 HydrophobicContact CD1-CG 4.19Å; L320-L500 HydrophobicContact CD2-CD2 3.89Å; L320-L500 HydrophobicContact CD2-CG 4.48Å; L320-L500 HydrophobicContact CG-CD1 4Å; L320-L500 HydrophobicContact CG-CD2 3.89Å; L320-L500 HydrophobicContact CG-CG 3.92Å; T330-L500 HydrophobicContact CG2-CD1 3.79Å; T330-L500 HydrophobicContact CG2-CG 3.88Å; T332-L500 HydrophobicContact CG2-CB 3.86Å; T332-L500 HydrophobicContact CG2-CD1 4.11Å; T332-L500 HydrophobicContact CG2-CG 4.5Å; L397-L500 HydrophobicContact CD2-CD2 3.7Å; F495-L500 WeakPolarHBondContact CD1-O 3.04Å; N496-L500 WeakPolarHBondContact O-CA 3.42Å; N496-L500 PolarHBondContact O-N 3.06Å; L500-R502 PolarHBondContact O-N 2.79Å
501	E	86.1	Confident	88.7	Confident	83 Å²	83	26.4 Å²	26.4	39%	0.388	13%	0.128	S	C	.	.			trans	-69	130.8	173.2	-174.3	-175.4	176.4	0	0	110.1	F495 N496 T499 L503	F495-E501 CarbonylContact C-O 3.45Å; F495-E501 VanDerWaalsContact CA-O 3.22Å; F495-E501 WeakPolarHBondContact CA-O 3.39Å; N496-E501 HydrophobicContact CB-CB 4.33Å; N496-E501 PolarHBondContact N-O 2.92Å; T499-E501 PolarHBondContact O-N 3.49Å; T499-E501 VanDerWaalsContact OG1-CB 3.26Å; T499-E501 WeakPolarHBondContact OG1-CB 3.47Å; T499-E501 PolarHBondContact OG1-N 2.81Å; E501-L503 PolarHBondContact O-N 2.92Å
502	R	86.8	Confident	88.4	Confident	94 Å²	94	26 Å²	26	36%	0.355	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	111.7	178.6	-175.9	174.8	69.3	-177.6	-7.3	110.4	T493 F495 L500 I505 S577	T493-R502 HydrophobicContact CG2-CG 3.64Å; F495-R502 HydrophobicContact CD1-CB 4.05Å; F495-R502 HydrophobicContact CE1-CB 3.92Å; F495-R502 HydrophobicContact CE1-CG 4.29Å; L500-R502 PolarHBondContact O-N 2.79Å; R502-I505 HydrophobicContact CG-CG1 4.46Å; R502-I505 VanDerWaalsContact NH1-CD1 3.29Å; R502-S577 VanDerWaalsContact NE-CB 3.33Å; R502-S577 PolarHBondContact NE-OG 3.48Å; R502-S577 PolarHBondContact O-OG 2.8Å
503	L	83.8	Confident	88	Confident	64 Å²	64	26 Å²	26	34%	0.335	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-41.8	-179.5	-57.7	178	0	0	0	112.2	F396 I494 N496 E501	F396-L503 HydrophobicContact CD1-CD1 3.64Å; F396-L503 HydrophobicContact CE1-CD1 3.61Å; I494-L503 HydrophobicContact CG2-CD1 4.49Å; I494-L503 PolarHBondContact O-N 2.8Å; N496-L503 HydrophobicContact CB-CD1 4.25Å; N496-L503 HydrophobicContact CB-CD2 4.29Å; N496-L503 HydrophobicContact CB-CG 4.33Å; E501-L503 PolarHBondContact O-N 2.92Å
504	R	83.6	Confident	87.6	Confident	50 Å²	50	26.4 Å²	26.4	19%	0.189	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	152.5	-174.8	-160.5	170.5	-173.1	136.7	0.7	112.1	P29 G30 T493 I494 L506 S574	P29-R504 PolarHBondContact O-NH1 3.44Å; G30-R504 VanDerWaalsContact C-CZ 3.47Å; G30-R504 PolarHBondContact O-NH1 3.27Å; G30-R504 PolarHBondContact O-NH2 3.36Å; T493-R504 WeakPolarHBondContact CA-O 3.26Å; I494-R504 HydrophobicContact CB-CB 4.34Å; I494-R504 HydrophobicContact CD1-CB 4.19Å; I494-R504 HydrophobicContact CG1-CB 4.37Å; I494-R504 PolarHBondContact N-O 2.81Å; I494-R504 PolarHBondContact O-N 3.24Å; R504-L506 HydrophobicContact CG-CD2 4.22Å; R504-S574 PolarHBondContact NH2-OG 3.12Å
505	I	85.9	Confident	87	Confident	16 Å²	16	28.8 Å²	28.8	8%	0.082	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.5	165.1	-61.8	166.7	0	0	0	108.7	W491 I492 T493 R502 S574	W491-I505 HydrophobicContact CB-CG2 4.28Å; W491-I505 HydrophobicContact CG-CG2 4.49Å; I492-I505 CarbonylContact O-C 3.37Å; I492-I505 WeakPolarHBondContact O-CA 3.24Å; T493-I505 HydrophobicContact CG2-CG1 3.87Å; R502-I505 HydrophobicContact CG-CG1 4.46Å; R502-I505 VanDerWaalsContact NH1-CD1 3.29Å; I505-S574 WeakPolarHBondContact O-CA 3.2Å
506	L	87.6	Confident	86.4	Confident	5 Å²	5	30.9 Å²	30.9	3%	0.026	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.6	172.5	-56.1	177.7	0	0	0	109	W491 I492 I494 R504 L535 Y728	W491-L506 CarbonylContact C-O 3.58Å; W491-L506 VanDerWaalsContact CA-O 3.26Å; W491-L506 WeakPolarHBondContact CA-O 3.21Å; I492-L506 HydrophobicContact CB-CB 4.37Å; I492-L506 PolarHBondContact N-O 2.94Å; I492-L506 PolarHBondContact O-N 2.85Å; I494-L506 HydrophobicContact CD1-CD1 4.42Å; R504-L506 HydrophobicContact CG-CD2 4.22Å; L506-L535 HydrophobicContact CD1-CD2 4.46Å; L506-Y728 HydrophobicContact CD1-CD1 4.19Å; L506-Y728 HydrophobicContact CD1-CD2 4.41Å; L506-Y728 HydrophobicContact CD1-CE1 4.22Å; L506-Y728 HydrophobicContact CD1-CE2 4.46Å; L506-Y728 HydrophobicContact CD1-CG 4.28Å; L506-Y728 HydrophobicContact CD2-CD1 4.32Å; L506-Y728 HydrophobicContact CD2-CE1 3.88Å
507	R	89	Confident	85.9	Confident	19 Å²	19	29.8 Å²	29.8	7%	0.072	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	140.7	174.3	178.9	-179.2	166.2	144.2	-0.1	110.5	A481 P482 T489 L490 W491 D509	A481-R507 PolarHBondContact O-NH1 2.79Å; A481-R507 PolarHBondContact O-NH2 2.85Å; P482-R507 PolarHBondContact O-NH2 2.86Å; T489-R507 HydrophobicContact CG2-CG 3.64Å; T489-R507 VanDerWaalsContact CG2-CZ 3.48Å; T489-R507 VanDerWaalsContact CG2-NE 3.26Å; T489-R507 PolarHBondContact OG1-NH2 3.22Å; L490-R507 WeakPolarHBondContact O-CA 3.33Å; W491-R507 HydrophobicContact CZ2-CG 4.49Å; R507-D509 IonicContact NH2-OD1 3.57Å
508	F	90.2	Very high	85.4	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.009	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	153.5	173.1	63.7	-69.9	0	0	0	110.6	L490 I492 R510 L535 I536	L490-F508 HydrophobicContact CB-CD1 3.98Å; L490-F508 HydrophobicContact CB-CD2 4.17Å; L490-F508 HydrophobicContact CB-CE1 3.47Å; L490-F508 VanDerWaalsContact CB-CE1 3.47Å; L490-F508 HydrophobicContact CB-CE2 3.74Å; L490-F508 HydrophobicContact CB-CG 4.29Å; L490-F508 HydrophobicContact CB-CZ 3.36Å; L490-F508 HydrophobicContact CD1-CD2 4.2Å; L490-F508 HydrophobicContact CD1-CE2 3.42Å; L490-F508 VanDerWaalsContact CD1-CE2 3.42Å; L490-F508 HydrophobicContact CD1-CZ 3.64Å; L490-F508 HydrophobicContact CG-CE2 4.22Å; L490-F508 HydrophobicContact CG-CZ 4.17Å; L490-F508 PolarHBondContact N-O 2.89Å; L490-F508 WeakPolarHBondContact O-CD1 3.47Å; L490-F508 PolarHBondContact O-N 3.05Å; L490-F508 VanDerWaalsContact O-O 3.07Å; I492-F508 HydrophobicContact CB-CE1 4.47Å; I492-F508 HydrophobicContact CD1-CD1 4Å; I492-F508 HydrophobicContact CD1-CE1 3.41Å; I492-F508 VanDerWaalsContact CD1-CE1 3.41Å; I492-F508 HydrophobicContact CD1-CZ 3.86Å; I492-F508 HydrophobicContact CG1-CD1 4.44Å; I492-F508 HydrophobicContact CG1-CE1 3.59Å; I492-F508 HydrophobicContact CG1-CZ 4.16Å; F508-R510 HydrophobicContact CD2-CG 3.95Å; F508-R510 HydrophobicContact CE2-CG 4.15Å; F508-L535 HydrophobicContact CB-CD1 3.85Å; F508-L535 HydrophobicContact CD2-CD1 4.4Å; F508-L535 HydrophobicContact CG-CD1 4.14Å; F508-I536 WeakPolarHBondContact CD2-O 3.2Å
509	D	90.6	Very high	85.2	Confident	5 Å²	5	29 Å²	29	3%	0.027	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.5	-176.5	-72	-45.8	0	0	0	110.1	L484 C487 T489 R507 T537 R538	L484-D509 HydrophobicContact CB-CB 4.47Å; C487-D509 HydrophobicContact CB-CB 4.05Å; T489-D509 VanDerWaalsContact CA-OD1 3.27Å; T489-D509 WeakPolarHBondContact CA-OD1 3.17Å; T489-D509 WeakPolarHBondContact CB-OD1 3.39Å; T489-D509 VanDerWaalsContact CG2-OD1 3.26Å; T489-D509 WeakPolarHBondContact CG2-OD1 3.38Å; T489-D509 PolarHBondContact OG1-OD1 3.21Å; R507-D509 IonicContact NH2-OD1 3.57Å; D509-T537 PolarHBondContact N-OG1 3.46Å; D509-T537 CarbonylContact O-C 3.21Å; D509-T537 WeakPolarHBondContact O-CA 2.94Å; D509-T537 PolarHBondContact O-OG1 2.81Å; D509-R538 PolarHBondContact O-N 3.26Å
510	R	89.8	Confident	85	Confident	12 Å²	12	25.5 Å²	25.5	5%	0.045	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145	176.8	-70.6	-65.6	-76.2	-70.9	4.7	112.5	C487 T488 L490 F508 V512 N521 I536	C487-R510 CarbonylContact C-O 3.6Å; C487-R510 WeakPolarHBondContact CA-O 3.31Å; T488-R510 PolarHBondContact N-O 3.34Å; T488-R510 PolarHBondContact O-N 3.46Å; L490-R510 HydrophobicContact CD1-CB 4.15Å; L490-R510 HydrophobicContact CD1-CG 4.31Å; F508-R510 HydrophobicContact CD2-CG 3.95Å; F508-R510 HydrophobicContact CE2-CG 4.15Å; R510-V512 HydrophobicContact CB-CG1 3.86Å; R510-V512 HydrophobicContact CB-CG2 4.01Å; R510-V512 PolarHBondContact O-N 2.88Å; R510-N521 PolarHBondContact NH1-O 3.36Å; R510-N521 PolarHBondContact NH2-O 3.39Å; R510-I536 WeakPolarHBondContact CD-O 3.3Å; R510-I536 PolarHBondContact NH1-O 3.19Å
511	S	87.1	Confident	84.8	Confident	20 Å²	20	25.5 Å²	25.5	14%	0.14	12%	0.121	C	C	.	.	S	Bend	trans	-76	70.7	171	57.4	0	0	0	0	111	R538	S511-R538 PolarHBondContact OG-NE 2.88Å; S511-R538 PolarHBondContact OG-NH2 3.11Å
512	V	86.6	Confident	84.9	Confident	4 Å²	4	22.4 Å²	22.4	2%	0.024	11%	0.106	C	C	.	.			trans	-129.7	144.2	-177.7	-60	0	0	0	0	110.2	T488 L490 R510 T517 N521	T488-V512 WeakPolarHBondContact CB-O 3.47Å; T488-V512 PolarHBondContact OG1-O 3.09Å; L490-V512 HydrophobicContact CD1-CG2 4.02Å; R510-V512 HydrophobicContact CB-CG1 3.86Å; R510-V512 HydrophobicContact CB-CG2 4.01Å; R510-V512 PolarHBondContact O-N 2.88Å; V512-T517 HydrophobicContact CB-CG2 3.77Å; V512-T517 HydrophobicContact CG1-CG2 3.72Å; V512-N521 HydrophobicContact CG1-CB 4.15Å
513	C	85.3	Confident	85	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.			trans	-85.6	123.1	168.4	179.6	0	0	0	0	108.1	R408 C409 I412 I515 H516 T517	R408-C513 PolarHBondContact N-SG 3.07Å; C409-C513 VanDerWaalsContact SG-SG 3.62Å; I412-C513 HydrophobicContact CD1-CB 3.91Å; I412-C513 VanDerWaalsContact CD1-N 3.26Å; C513-I515 PolarHBondContact O-N 3.26Å; C513-I515 VanDerWaalsContact O-N 3.13Å; C513-H516 HydrophobicContact CB-CB 4.12Å; C513-H516 PolarHBondContact O-N 3.35Å; C513-H516 PolarHBondContact SG-N 3.24Å; C513-T517 PolarHBondContact N-OG1 3.31Å; C513-T517 WeakPolarHBondContact O-CB 3.24Å; C513-T517 PolarHBondContact O-N 2.93Å; C513-T517 PolarHBondContact O-OG1 2.76Å
514	P	81.4	Confident	85.3	Confident	12 Å²	12	16.7 Å²	16.7	8%	0.078	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.7	-177	26.7	-34.6	0	0	0	113.5	M386 T402 S404 T406	M386-P514 HydrophobicContact CE-CB 4.05Å; M386-P514 HydrophobicContact SD-CB 4.12Å; T402-P514 HydrophobicContact CG2-CB 3.99Å; S404-P514 WeakPolarHBondContact O-CB 3.34Å; S404-P514 WeakPolarHBondContact O-CG 3.11Å; T406-P514 VanDerWaalsContact O-CG 3.3Å; T406-P514 WeakPolarHBondContact O-CG 3.17Å
515	I	79.1	Confident	85.6	Confident	56 Å²	56	15 Å²	15	29%	0.287	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-42.8	178.6	-50.3	-178.4	0	0	0	111.5	R405 C407 C513	R405-I515 WeakPolarHBondContact O-CD1 3.45Å; C407-I515 HydrophobicContact CB-CD1 4.05Å; C407-I515 VanDerWaalsContact N-CD1 3.34Å; C513-I515 PolarHBondContact O-N 3.26Å; C513-I515 VanDerWaalsContact O-N 3.13Å
516	H	77.4	Confident	85.7	Confident	52 Å²	52	15.9 Å²	15.9	24%	0.241	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-12.8	-163.6	-60.3	133.5	0	0	0	114.3	L62 P63 C407 C409 C513	L62-H516 CarbonylContact C-O 2.8Å; L62-H516 WeakPolarHBondContact CA-O 3.39Å; P63-H516 WeakPolarHBondContact CA-O 3.37Å; P63-H516 WeakPolarHBondContact CB-O 3.34Å; P63-H516 WeakPolarHBondContact CD-O 3.3Å; P63-H516 HydrophobicContact CG-CB 4.15Å; C407-H516 PolarHBondContact SG-CE1 2.94Å; C407-H516 PolarHBondContact SG-ND1 3.17Å; C409-H516 PolarHBondContact SG-ND1 3.43Å; C513-H516 HydrophobicContact CB-CB 4.12Å; C513-H516 PolarHBondContact O-N 3.35Å; C513-H516 PolarHBondContact SG-N 3.24Å
517	T	80.1	Confident	85.7	Confident	13 Å²	13	15.8 Å²	15.8	8%	0.08	8%	0.083	C	C	.	.	S	Bend	trans	-82.7	135.2	-176.5	-66.1	0	0	0	0	112.2	V512 C513 N521	V512-T517 HydrophobicContact CB-CG2 3.77Å; V512-T517 HydrophobicContact CG1-CG2 3.72Å; C513-T517 PolarHBondContact N-OG1 3.31Å; C513-T517 WeakPolarHBondContact O-CB 3.24Å; C513-T517 PolarHBondContact O-N 2.93Å; C513-T517 PolarHBondContact O-OG1 2.76Å; T517-N521 HydrophobicContact CG2-CB 3.57Å
518	C	80.3	Confident	85.4	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.			trans	-47.6	129.4	171.8	174.9	0	0	0	0	111.6	C58 C66 T520 N521	C58-C518 HydrophobicContact CB-CB 4.12Å; C66-C518 HydrophobicContact CB-CB 3.95Å; C66-C518 WeakPolarHBondContact CB-SG 3.25Å; C518-T520 PolarHBondContact O-N 3.05Å; C518-T520 VanDerWaalsContact O-N 3.11Å; C518-N521 WeakPolarHBondContact O-CB 3.39Å; C518-N521 PolarHBondContact O-N 3.18Å
519	P	81.9	Confident	84.9	Confident	17 Å²	17	23.2 Å²	23.2	11%	0.11	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-54.7	-32.2	-179	-28.9	36.4	0	0	0	115.4	N521 Y522 L523	P519-N521 PolarHBondContact O-N 3.18Å; P519-Y522 VanDerWaalsContact CA-CE1 3.42Å; P519-Y522 VanDerWaalsContact CA-CZ 3.49Å; P519-Y522 HydrophobicContact CB-CE1 4.16Å; P519-Y522 HydrophobicContact CB-CE2 4.27Å; P519-Y522 WeakPolarHBondContact CB-OH 3.37Å; P519-Y522 HydrophobicContact CG-CE1 4.43Å; P519-Y522 PolarHBondContact O-N 2.8Å; P519-L523 HydrophobicContact CB-CD1 3.59Å; P519-L523 HydrophobicContact CB-CG 4.24Å; P519-L523 WeakPolarHBondContact O-CB 3.18Å; P519-L523 VanDerWaalsContact O-CG 3.24Å; P519-L523 WeakPolarHBondContact O-CG 3.29Å; P519-L523 PolarHBondContact O-N 3.12Å
520	T	82.7	Confident	84.5	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.012	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-51	-31.3	173	-63.2	0	0	0	0	112.9	C58 C71 R74 C518 Y522	C58-T520 HydrophobicContact CB-CG2 3.82Å; C71-T520 WeakPolarHBondContact CB-OG1 3.23Å; C71-T520 PolarHBondContact SG-OG1 3.3Å; R74-T520 HydrophobicContact CG-CG2 4.18Å; C518-T520 PolarHBondContact O-N 3.05Å; C518-T520 VanDerWaalsContact O-N 3.11Å; T520-Y522 VanDerWaalsContact C-N 3.32Å; T520-Y522 PolarHBondContact O-N 3.2Å
521	N	85.9	Confident	84.1	Confident	9 Å²	9	23.8 Å²	23.8	5%	0.048	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-79.7	-7.3	-178	-72.7	-35.3	0	0	0	114.4	V57 C58 R510 V512 T517 C518 P519	V57-N521 WeakPolarHBondContact CG1-OD1 3.36Å; C58-N521 PolarHBondContact N-OD1 3.33Å; C58-N521 PolarHBondContact O-ND2 3.07Å; C58-N521 PolarHBondContact O-OD1 2.89Å; R510-N521 PolarHBondContact NH1-O 3.36Å; R510-N521 PolarHBondContact NH2-O 3.39Å; V512-N521 HydrophobicContact CG1-CB 4.15Å; T517-N521 HydrophobicContact CG2-CB 3.57Å; C518-N521 WeakPolarHBondContact O-CB 3.39Å; C518-N521 PolarHBondContact O-N 3.18Å; P519-N521 PolarHBondContact O-N 3.18Å
522	Y	88	Confident	84.2	Confident	18 Å²	18	24.8 Å²	24.8	7%	0.071	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-15.2	175.2	61.3	-107.3	0	0	0	113.7	M386 N387 I400 P519 T520	M386-Y522 HydrophobicContact CB-CE2 4.35Å; M386-Y522 HydrophobicContact CE-CD1 3.83Å; M386-Y522 HydrophobicContact CE-CD2 4.42Å; M386-Y522 HydrophobicContact CE-CE1 3.51Å; M386-Y522 HydrophobicContact CE-CE2 4.19Å; M386-Y522 HydrophobicContact CE-CG 4.26Å; N387-Y522 HydrophobicContact CB-CE2 4.27Å; I400-Y522 HydrophobicContact CD1-CD2 3.87Å; I400-Y522 HydrophobicContact CD1-CE2 4.29Å; I400-Y522 HydrophobicContact CG2-CD2 4.17Å; P519-Y522 VanDerWaalsContact CA-CE1 3.42Å; P519-Y522 VanDerWaalsContact CA-CZ 3.49Å; P519-Y522 HydrophobicContact CB-CE1 4.16Å; P519-Y522 HydrophobicContact CB-CE2 4.27Å; P519-Y522 WeakPolarHBondContact CB-OH 3.37Å; P519-Y522 HydrophobicContact CG-CE1 4.43Å; P519-Y522 PolarHBondContact O-N 2.8Å; T520-Y522 VanDerWaalsContact C-N 3.32Å; T520-Y522 PolarHBondContact O-N 3.2Å
523	L	89.2	Confident	84.4	Confident	24 Å²	24	24.6 Å²	24.6	13%	0.126	12%	0.124	C	C	.	.			trans	-71.5	130.3	176.6	-74.6	168.1	0	0	0	110.6	N387 F389 I400 P519	N387-L523 HydrophobicContact CB-CD2 3.92Å; N387-L523 WeakPolarHBondContact ND2-CD2 3.38Å; F389-L523 HydrophobicContact CD1-CD2 4.14Å; F389-L523 HydrophobicContact CE1-CD2 4.05Å; I400-L523 HydrophobicContact CD1-CD2 3.5Å; I400-L523 VanDerWaalsContact CD1-CD2 3.5Å; I400-L523 HydrophobicContact CD1-CG 4.34Å; P519-L523 HydrophobicContact CB-CD1 3.59Å; P519-L523 HydrophobicContact CB-CG 4.24Å; P519-L523 WeakPolarHBondContact O-CB 3.18Å; P519-L523 VanDerWaalsContact O-CG 3.24Å; P519-L523 WeakPolarHBondContact O-CG 3.29Å; P519-L523 PolarHBondContact O-N 3.12Å
524	P	90.6	Very high	84.7	Confident	14 Å²	14	24.6 Å²	24.6	9%	0.091	12%	0.124	C	C	.	.			trans	-69.9	163.2	169.7	32.6	-34.8	0	0	0	110.5	F389 I492 I533 A534 L535	F389-P524 HydrophobicContact CE1-CG 4.18Å; F389-P524 HydrophobicContact CE2-CG 4.21Å; F389-P524 HydrophobicContact CZ-CG 3.44Å; F389-P524 VanDerWaalsContact CZ-CG 3.44Å; I492-P524 HydrophobicContact CD1-CB 4.34Å; I492-P524 HydrophobicContact CD1-CG 4.03Å; P524-I533 HydrophobicContact CB-CD1 3.73Å; P524-I533 HydrophobicContact CB-CG1 3.61Å; P524-I533 HydrophobicContact CG-CD1 3.67Å; P524-I533 HydrophobicContact CG-CG1 4.13Å; P524-A534 CarbonylContact C-O 3.54Å; P524-A534 VanDerWaalsContact CA-O 3.25Å; P524-A534 WeakPolarHBondContact CA-O 3.26Å; P524-A534 VanDerWaalsContact CB-O 3.31Å; P524-A534 WeakPolarHBondContact CB-O 3.49Å; P524-L535 HydrophobicContact CB-CB 4.25Å
525	V	88.3	Confident	85.2	Confident	14 Å²	14	24.2 Å²	24.2	9%	0.085	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.1	174.6	179.1	0	0	0	0	109	F51 D53 M56 I533 A534	F51-V525 HydrophobicContact CD1-CB 4.48Å; F51-V525 HydrophobicContact CD1-CG1 3.95Å; F51-V525 HydrophobicContact CE1-CG1 4.39Å; F51-V525 WeakPolarHBondContact CE1-O 3.34Å; D53-V525 HydrophobicContact CB-CG1 3.9Å; M56-V525 HydrophobicContact CE-CB 3.81Å; M56-V525 HydrophobicContact CE-CG2 3.64Å; M56-V525 HydrophobicContact SD-CB 3.51Å; M56-V525 VanDerWaalsContact SD-CB 3.51Å; M56-V525 HydrophobicContact SD-CG1 4.17Å; M56-V525 HydrophobicContact SD-CG2 3.23Å; M56-V525 WeakPolarHBondContact SD-CG2 3.3Å; V525-I533 CarbonylContact O-C 3.33Å; V525-I533 WeakPolarHBondContact O-CA 3.38Å; V525-A534 PolarHBondContact N-O 3.38Å; V525-A534 PolarHBondContact O-N 2.96Å
526	M	87.9	Confident	85.8	Confident	36 Å²	36	21.7 Å²	21.7	18%	0.177	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	150.4	175.9	-64.8	-175.9	-171.9	0	0	111.3	F51 F389 Y390 F398 R532	F51-M526 WeakPolarHBondContact CD1-O 3.4Å; F389-M526 HydrophobicContact CD2-CE 3.61Å; F389-M526 HydrophobicContact CE2-CE 3.42Å; F389-M526 VanDerWaalsContact CE2-CE 3.42Å; Y390-M526 WeakPolarHBondContact O-CE 3.36Å; F398-M526 HydrophobicContact CD2-CE 3.83Å; F398-M526 HydrophobicContact CE2-CE 3.5Å; F398-M526 HydrophobicContact CZ-CE 4.15Å; M526-R532 WeakPolarHBondContact CA-O 3.15Å
527	S	88.1	Confident	86.5	Confident	3 Å²	3	19.3 Å²	19.3	2%	0.021	10%	0.097	C	C	.	.			trans	-63.5	159.5	167.2	61.7	0	0	0	0	110.5	N50 F51 C529 G530 S531 R532	N50-S527 CarbonylContact O-C 3.56Å; N50-S527 WeakPolarHBondContact O-CA 3.2Å; N50-S527 WeakPolarHBondContact O-CB 3.14Å; F51-S527 VanDerWaalsContact CE1-N 3.31Å; S527-C529 PolarHBondContact O-N 2.97Å; S527-C529 PolarHBondContact OG-SG 3.19Å; S527-G530 PolarHBondContact O-N 3.31Å; S527-G530 PolarHBondContact OG-N 3.46Å; S527-S531 PolarHBondContact OG-N 2.91Å; S527-R532 PolarHBondContact N-O 3.03Å; S527-R532 PolarHBondContact OG-N 3.37Å; S527-R532 VanDerWaalsContact OG-N 3.15Å
528	R	82.6	Confident	86.9	Confident	129 Å²	129	19.9 Å²	19.9	49%	0.487	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-39.1	176.9	-64.1	-177.4	-170.9	175.5	-3.2	111.3	N50 R392 G530	N50-R528 WeakPolarHBondContact O-CG 3.31Å; N50-R528 PolarHBondContact O-N 3.26Å; N50-R528 WeakPolarHBondContact OD1-CD 3.47Å; R392-R528 WeakPolarHBondContact CD-O 3.28Å; R392-R528 PolarHBondContact NH1-O 2.99Å; R528-G530 VanDerWaalsContact C-N 3.27Å; R528-G530 PolarHBondContact O-N 2.82Å
529	C	79.7	Confident	87.1	Confident	48 Å²	48	21 Å²	21	32%	0.324	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.7	176.3	55.6	0	0	0	0	114.5	S527 S531	S527-C529 PolarHBondContact O-N 2.97Å; S527-C529 PolarHBondContact OG-SG 3.19Å; C529-S531 PolarHBondContact O-N 3.13Å; C529-S531 VanDerWaalsContact O-N 3.16Å; C529-S531 PolarHBondContact SG-OG 3.21Å
530	G	82.6	Confident	86.9	Confident	3 Å²	3	22.5 Å²	22.5	3%	0.031	12%	0.117	C	C	.	.	S	Bend	trans	71.7	-0.1	-178.7	0	0	0	0	0	115.1	S527 R528 L730	S527-G530 PolarHBondContact O-N 3.31Å; S527-G530 PolarHBondContact OG-N 3.46Å; R528-G530 VanDerWaalsContact C-N 3.27Å; R528-G530 PolarHBondContact O-N 2.82Å; G530-L730 WeakPolarHBondContact O-CD1 3.42Å
531	S	82.4	Confident	86.4	Confident	25 Å²	25	24.3 Å²	24.3	18%	0.175	13%	0.128	C	C	.	.	S	Bend	trans	-85.9	-4.8	-176.1	74.6	0	0	0	0	114.1	S527 C529 Q729 L730	S527-S531 PolarHBondContact OG-N 2.91Å; C529-S531 PolarHBondContact O-N 3.13Å; C529-S531 VanDerWaalsContact O-N 3.16Å; C529-S531 PolarHBondContact SG-OG 3.21Å; S531-Q729 PolarHBondContact O-NE2 3.44Å; S531-L730 WeakPolarHBondContact O-CB 3.43Å; S531-L730 PolarHBondContact O-N 2.93Å
532	R	88.4	Confident	85.4	Confident	41 Å²	41	25.4 Å²	25.4	16%	0.155	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.5	-177.3	-62.8	166.6	-175.9	158.3	0.6	109.9	I33 F49 F51 M526 S527 V727 Y728	I33-R532 HydrophobicContact CD1-CG 4.01Å; F49-R532 PolarHBondContact O-NH1 2.92Å; F49-R532 VanDerWaalsContact O-NH1 3.07Å; F51-R532 HydrophobicContact CE2-CB 4.24Å; F51-R532 HydrophobicContact CZ-CB 4.06Å; M526-R532 WeakPolarHBondContact CA-O 3.15Å; S527-R532 PolarHBondContact N-O 3.03Å; S527-R532 PolarHBondContact OG-N 3.37Å; S527-R532 VanDerWaalsContact OG-N 3.15Å; R532-V727 HydrophobicContact CB-CG1 4.21Å; R532-Y728 VanDerWaalsContact CA-O 3.25Å; R532-Y728 WeakPolarHBondContact CA-O 3.45Å
533	I	91.3	Very high	83.5	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.2	176.2	-168.3	168.4	0	0	0	109.2	F398 P524 V525 Y728 L730	F398-I533 HydrophobicContact CD1-CD1 4.17Å; F398-I533 HydrophobicContact CE1-CD1 3.84Å; F398-I533 HydrophobicContact CZ-CD1 4.33Å; P524-I533 HydrophobicContact CB-CD1 3.73Å; P524-I533 HydrophobicContact CB-CG1 3.61Å; P524-I533 HydrophobicContact CG-CD1 3.67Å; P524-I533 HydrophobicContact CG-CG1 4.13Å; V525-I533 CarbonylContact O-C 3.33Å; V525-I533 WeakPolarHBondContact O-CA 3.38Å; I533-Y728 PolarHBondContact N-O 3.32Å; I533-Y728 PolarHBondContact O-N 3.35Å; I533-L730 HydrophobicContact CB-CD1 4.19Å; I533-L730 HydrophobicContact CB-CD2 4.25Å; I533-L730 HydrophobicContact CB-CG 4.22Å; I533-L730 HydrophobicContact CG2-CD2 3.74Å; I533-L730 HydrophobicContact CG2-CG 4.06Å
534	A	91.6	Very high	81.1	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.7	176.9	0	0	0	0	0	109.8	W41 F51 M56 P524 V525 L725 L726 V727	W41-A534 HydrophobicContact CH2-CB 4.19Å; W41-A534 HydrophobicContact CZ2-CB 4.16Å; F51-A534 HydrophobicContact CD1-CB 4.27Å; F51-A534 HydrophobicContact CE1-CB 3.47Å; F51-A534 VanDerWaalsContact CE1-CB 3.47Å; F51-A534 HydrophobicContact CZ-CB 3.62Å; M56-A534 HydrophobicContact CE-CB 4.12Å; P524-A534 CarbonylContact C-O 3.54Å; P524-A534 VanDerWaalsContact CA-O 3.25Å; P524-A534 WeakPolarHBondContact CA-O 3.26Å; P524-A534 VanDerWaalsContact CB-O 3.31Å; P524-A534 WeakPolarHBondContact CB-O 3.49Å; V525-A534 PolarHBondContact N-O 3.38Å; V525-A534 PolarHBondContact O-N 2.96Å; A534-L725 HydrophobicContact CB-CD2 4.31Å; A534-L726 CarbonylContact C-O 3.57Å; A534-L726 VanDerWaalsContact CA-O 3.3Å; A534-L726 WeakPolarHBondContact CA-O 3Å; A534-V727 HydrophobicContact CB-CG2 4.4Å
535	L	92.1	Very high	78.5	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148.2	175.9	67.3	86.3	0	0	0	110	I492 L506 F508 P524 L725 L726 Y728	I492-L535 HydrophobicContact CD1-CD2 3.94Å; L506-L535 HydrophobicContact CD1-CD2 4.46Å; F508-L535 HydrophobicContact CB-CD1 3.85Å; F508-L535 HydrophobicContact CD2-CD1 4.4Å; F508-L535 HydrophobicContact CG-CD1 4.14Å; P524-L535 HydrophobicContact CB-CB 4.25Å; L535-L725 WeakPolarHBondContact O-CA 3.31Å; L535-L726 HydrophobicContact CD1-CB 4.15Å; L535-L726 HydrophobicContact CD1-CD1 4.08Å; L535-L726 HydrophobicContact CD1-CG 4.36Å; L535-L726 HydrophobicContact CG-CB 4.3Å; L535-L726 PolarHBondContact N-O 3.45Å; L535-L726 PolarHBondContact O-N 3.49Å; L535-Y728 HydrophobicContact CD1-CE2 4.39Å; L535-Y728 HydrophobicContact CD2-CD2 3.91Å; L535-Y728 HydrophobicContact CD2-CE2 3.49Å; L535-Y728 VanDerWaalsContact CD2-CE2 3.49Å; L535-Y728 HydrophobicContact CG-CD2 4.3Å; L535-Y728 HydrophobicContact CG-CE2 3.88Å
536	I	91.3	Very high	76	Confident	4 Å²	4	48 Å²	48	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	138.8	171.9	-61.8	163.5	0	0	0	107.3	L38 M56 V57 F508 R510 D723 V724 L725	L38-I536 HydrophobicContact CD1-CD1 3.78Å; M56-I536 HydrophobicContact CB-CD1 3.54Å; V57-I536 HydrophobicContact CG2-CD1 3.48Å; V57-I536 VanDerWaalsContact CG2-CD1 3.48Å; F508-I536 WeakPolarHBondContact CD2-O 3.2Å; R510-I536 WeakPolarHBondContact CD-O 3.3Å; R510-I536 PolarHBondContact NH1-O 3.19Å; I536-D723 HydrophobicContact CG2-CB 4.09Å; I536-V724 CarbonylContact C-O 3.49Å; I536-V724 WeakPolarHBondContact CA-O 3.25Å; I536-L725 HydrophobicContact CG1-CB 4.38Å; I536-L725 HydrophobicContact CG1-CD1 4.11Å; I536-L725 HydrophobicContact CG1-CG 4.43Å
537	T	92.1	Very high	73.3	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.6	174.2	-169.9	0	0	0	0	109.6	D509 L571 V724 L726	D509-T537 PolarHBondContact N-OG1 3.46Å; D509-T537 CarbonylContact O-C 3.21Å; D509-T537 WeakPolarHBondContact O-CA 2.94Å; D509-T537 PolarHBondContact O-OG1 2.81Å; T537-L571 HydrophobicContact CG2-CD2 4.12Å; T537-V724 HydrophobicContact CG2-CB 4.41Å; T537-V724 PolarHBondContact N-O 3.44Å; T537-V724 PolarHBondContact O-N 2.84Å; T537-V724 VanDerWaalsContact O-O 3.13Å; T537-L726 HydrophobicContact CG2-CD1 3.76Å; T537-L726 HydrophobicContact CG2-CG 4.06Å
538	R	89	Confident	70.8	Confident	26 Å²	26	57.4 Å²	57.4	10%	0.098	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	142.1	166.4	-82.9	-171	174	-174.3	3.2	110.8	N416 L484 C487 D509 S511 I722 D723	N416-R538 PolarHBondContact OD1-NH2 2.91Å; L484-R538 HydrophobicContact CD2-CB 4.04Å; C487-R538 VanDerWaalsContact SG-CD 3.52Å; D509-R538 PolarHBondContact O-N 3.26Å; S511-R538 PolarHBondContact OG-NE 2.88Å; S511-R538 PolarHBondContact OG-NH2 3.11Å; R538-I722 WeakPolarHBondContact CA-O 2.97Å; R538-D723 WeakPolarHBondContact CG-OD1 3.34Å; R538-D723 IonicContact NE-OD1 3.49Å; R538-D723 PolarHBondContact NE-OD1 2.8Å
539	Q	83.5	Confident	68.2	Low	23 Å²	23	59 Å²	59	11%	0.107	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137.9	174.3	-171.2	174.5	7.3	0	0	109.6	P568 Q721 I722 V724	Q539-P568 HydrophobicContact CG-CG 4.32Å; Q539-Q721 WeakPolarHBondContact O-CA 3.43Å; Q539-I722 PolarHBondContact N-O 3.46Å; Q539-I722 PolarHBondContact O-N 2.88Å; Q539-V724 HydrophobicContact CB-CG2 3.91Å
540	A	78.2	Confident	66.1	Low	48 Å²	48	66 Å²	66	40%	0.397	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.4	168.6	0	0	0	0	0	109.8	L484 V720	L484-A540 HydrophobicContact CD1-CB 4.26Å; A540-V720 CarbonylContact C-O 3.5Å; A540-V720 WeakPolarHBondContact CA-O 3.44Å
541	V	72.7	Confident	63.5	Low	40 Å²	40	74.2 Å²	74.2	24%	0.242	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.5	177.8	-179.3	0	0	0	0	108	T719 V720 I722	V541-T719 WeakPolarHBondContact O-CA 3.5Å; V541-V720 PolarHBondContact N-O 3.04Å; V541-V720 PolarHBondContact O-N 2.82Å; V541-I722 HydrophobicContact CG2-CD1 3.65Å; V541-I722 HydrophobicContact CG2-CG1 3.72Å
542	G	62.9	Low	61	Low	33 Å²	33	77.3 Å²	77.3	34%	0.34	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	141.6	173.2	0	0	0	0	0	111
543	Y	48.7	Very low	58.1	Low	87 Å²	87	80.6 Å²	80.6	34%	0.341	46%	0.461	S	S	.	.			trans	-78.4	129.7	166.6	-69.2	-73.5	0	0	0	109.9	Y559 S718 V720	Y543-Y559 HydrophobicContact CE1-CE1 4.25Å; Y543-S718 WeakPolarHBondContact CD2-O 3.5Å; Y543-S718 PolarHBondContact N-O 2.76Å; Y543-V720 HydrophobicContact CD2-CG2 4.35Å; Y543-V720 HydrophobicContact CE2-CB 4.11Å; Y543-V720 HydrophobicContact CE2-CG2 3.37Å
544	Y	39.6	Very low	55.2	Low	199 Å²	199	87.5 Å²	87.5	78%	0.78	50%	0.498	S	S	*	.			trans	-112.2	106.5	162.6	-66.7	-83.7	0	0	0	107.3	S546	Y544-S546 PolarHBondContact O-N 2.99Å
545	N	34.7	Very low	52.1	Low	152 Å²	152	96.3 Å²	96.3	81%	0.813	55%	0.545	S	S	*	.			trans	-77.4	96.9	163.9	-87.6	-1.9	0	0	0	107.3	T547	N545-T547 VanDerWaalsContact C-N 3.3Å; N545-T547 PolarHBondContact O-N 3.18Å
546	S	36.6	Very low	49.1	Very low	105 Å²	105	100.1 Å²	100.1	73%	0.734	57%	0.572	S	S	*	*			trans	-75.5	86	167	43.2	0	0	0	0	109.1	Y544 S548	Y544-S546 PolarHBondContact O-N 2.99Å; S546-S548 PolarHBondContact O-N 3.37Å; S546-S548 VanDerWaalsContact O-N 3.07Å
547	T	31.6	Very low	46.3	Very low	139 Å²	139	108.2 Å²	108.2	85%	0.853	60%	0.602	S	S	*	*			trans	-74.7	80.6	161.1	44.2	0	0	0	0	108.6	N545	N545-T547 VanDerWaalsContact C-N 3.3Å; N545-T547 PolarHBondContact O-N 3.18Å
548	S	34.6	Very low	43.3	Very low	98 Å²	98	115.2 Å²	115.2	69%	0.685	64%	0.635	S	S	*	*			trans	-126.6	106.4	160.3	65.7	0	0	0	0	108.2	S546 Q550	S546-S548 PolarHBondContact O-N 3.37Å; S546-S548 VanDerWaalsContact O-N 3.07Å; S548-Q550 PolarHBondContact O-N 3.41Å
549	N	28.2	Very low	40.8	Very low	164 Å²	164	119.4 Å²	119.4	88%	0.877	65%	0.651	S	S	*	*			trans	-23.8	110.3	170.2	-68.9	-20.6	0	0	0	113.5
550	Q	35.8	Very low	38.3	Very low	193 Å²	193	125.3 Å²	125.3	90%	0.902	68%	0.683	S	S	*	*			trans	-155.7	130	134.3	-71.7	-147.5	3.3	0	0	109.6	S548 A552	S548-Q550 PolarHBondContact O-N 3.41Å; Q550-A552 PolarHBondContact O-N 3.43Å
551	N	28.1	Very low	36.4	Very low	176 Å²	176	126.3 Å²	126.3	94%	0.941	68%	0.678	S	S	*	*			trans	-56.8	110.9	177.3	-65.8	-35.8	0	0	0	111.3
552	A	31	Very low	34.4	Very low	91 Å²	91	128.1 Å²	128.1	75%	0.752	69%	0.693	S	S	*	*			trans	-160.1	108.9	155.4	0	0	0	0	0	109.2	Q550 N554	Q550-A552 PolarHBondContact O-N 3.43Å; A552-N554 PolarHBondContact O-N 3.38Å
553	S	26.6	Very low	32.9	Very low	109 Å²	109	131.1 Å²	131.1	76%	0.762	71%	0.709	S	S	*	*			trans	-52.9	113.5	163.7	51.5	0	0	0	0	110
554	N	30.3	Very low	32	Very low	146 Å²	146	132.1 Å²	132.1	78%	0.781	73%	0.727	S	S	*	*			trans	-177.3	119.8	146.9	-90.5	-22.8	0	0	0	110.6	A552 S556	A552-N554 PolarHBondContact O-N 3.38Å; N554-S556 VanDerWaalsContact C-N 3.28Å; N554-S556 PolarHBondContact O-N 3Å
555	N	27.3	Very low	31.7	Very low	185 Å²	185	131 Å²	131	99%	0.989	73%	0.726	S	S	*	*			trans	-63.7	73.5	177.1	-75.6	-27.6	0	0	0	112.9
556	S	28.3	Very low	31.5	Very low	84 Å²	84	128 Å²	128	59%	0.587	71%	0.714	S	S	*	*			trans	-116.8	97	171.5	58.3	0	0	0	0	110.6	N554 E558	N554-S556 VanDerWaalsContact C-N 3.28Å; N554-S556 PolarHBondContact O-N 3Å; S556-E558 VanDerWaalsContact C-N 3.26Å; S556-E558 PolarHBondContact O-N 3.32Å
557	R	33.1	Very low	31.4	Very low	174 Å²	174	124.5 Å²	124.5	66%	0.657	69%	0.686	S	S	*	*			trans	-70.1	85.8	164.1	-92.7	-179.1	164.9	174	-3.5	108.1	Y559	R557-Y559 PolarHBondContact O-N 3.09Å
558	E	28.9	Very low	31.6	Very low	147 Å²	147	120.3 Å²	120.3	69%	0.687	66%	0.662	S	S	*	*			trans	-79.3	109.9	172.2	-74.2	-165.7	153.3	0	0	110.5	S556 L560	S556-E558 VanDerWaalsContact C-N 3.26Å; S556-E558 PolarHBondContact O-N 3.32Å; E558-L560 VanDerWaalsContact C-N 3.34Å; E558-L560 PolarHBondContact O-N 3.19Å
559	Y	35.5	Very low	31.5	Very low	114 Å²	114	120.3 Å²	120.3	45%	0.447	66%	0.657	S	S	.	*			trans	-72.6	91	164.7	-63.6	-85.1	0	0	0	108.4	Y543 R557 F561	Y543-Y559 HydrophobicContact CE1-CE1 4.25Å; R557-Y559 PolarHBondContact O-N 3.09Å; Y559-F561 PolarHBondContact O-N 3.09Å
560	L	31.8	Very low	31.9	Very low	148 Å²	148	113.6 Å²	113.6	78%	0.775	62%	0.624	S	S	*	*			trans	-69	98.4	171.8	-81.4	165.2	0	0	0	109.2	E558 S562	E558-L560 VanDerWaalsContact C-N 3.34Å; E558-L560 PolarHBondContact O-N 3.19Å; L560-S562 VanDerWaalsContact C-N 3.26Å; L560-S562 PolarHBondContact O-N 3.49Å
561	F	38.3	Very low	32.1	Very low	68 Å²	68	105.2 Å²	105.2	30%	0.298	59%	0.585	S	S	.	*			trans	-62.7	94.6	160.1	-71.6	-81.8	0	0	0	107.3	T37 Y559 S563 I722 V724	T37-F561 HydrophobicContact CG2-CE2 3.71Å; T37-F561 HydrophobicContact CG2-CZ 3.67Å; Y559-F561 PolarHBondContact O-N 3.09Å; F561-S563 PolarHBondContact O-N 3.2Å; F561-I722 HydrophobicContact CE1-CD1 3.86Å; F561-I722 HydrophobicContact CZ-CD1 3.69Å; F561-V724 HydrophobicContact CE1-CG1 4.4Å; F561-V724 HydrophobicContact CE1-CG2 3.9Å; F561-V724 HydrophobicContact CZ-CG2 4.38Å
562	S	30.3	Very low	32.6	Very low	78 Å²	78	103.2 Å²	103.2	55%	0.545	56%	0.564	S	S	.	*			trans	-52.2	115	179.4	-171.9	0	0	0	0	109.6	L560 C564 T566	L560-S562 VanDerWaalsContact C-N 3.26Å; L560-S562 PolarHBondContact O-N 3.49Å; S562-C564 PolarHBondContact O-N 3.2Å; S562-T566 VanDerWaalsContact CB-OG1 3.26Å; S562-T566 WeakPolarHBondContact CB-OG1 3.21Å; S562-T566 PolarHBondContact OG-OG1 3.5Å
563	S	30.7	Very low	33	Very low	96 Å²	96	101.1 Å²	101.1	67%	0.671	54%	0.539	S	S	*	.			trans	-35.4	107.1	176.5	168.8	0	0	0	0	112.3	F561 K565	F561-S563 PolarHBondContact O-N 3.2Å; S563-K565 WeakPolarHBondContact O-CB 3.39Å; S563-K565 PolarHBondContact O-N 3.07Å
564	C	31.7	Very low	33.5	Very low	109 Å²	109	97.9 Å²	97.9	74%	0.736	52%	0.516	S	S	*	.	S	Bend	trans	35.7	-1.6	161.6	-70.2	0	0	0	0	121.2	S562	S562-C564 PolarHBondContact O-N 3.2Å
565	K	31.5	Very low	33.4	Very low	175 Å²	175	93.9 Å²	93.9	76%	0.761	50%	0.496	S	S	*	.	S	Bend	trans	-105.7	-14.3	-171.2	-68.1	-174	178.1	-178.9	0	111.9	S563 R572	S563-K565 WeakPolarHBondContact O-CB 3.39Å; S563-K565 PolarHBondContact O-N 3.07Å; K565-R572 PolarHBondContact O-NH2 2.67Å
566	T	31	Very low	33.5	Very low	89 Å²	89	89.2 Å²	89.2	55%	0.546	48%	0.476	S	S	.	.			trans	-125.5	26.3	-177.4	50.7	0	0	0	0	113.5	S562	S562-T566 VanDerWaalsContact CB-OG1 3.26Å; S562-T566 WeakPolarHBondContact CB-OG1 3.21Å; S562-T566 PolarHBondContact OG-OG1 3.5Å
567	L	35.8	Very low	33.6	Very low	31 Å²	31	86.6 Å²	86.6	16%	0.162	46%	0.458	C	S	.	.			trans	-56.8	126.6	164.5	-83	159.2	0	0	0	108.9	V569 L571 R572	L567-V569 PolarHBondContact O-N 3.27Å; L567-L571 HydrophobicContact CD2-CB 4.12Å; L567-L571 HydrophobicContact CD2-CD1 3.79Å; L567-R572 HydrophobicContact CB-CG 4.35Å; L567-R572 PolarHBondContact O-NE 2.9Å; L567-R572 PolarHBondContact O-NH2 2.88Å
568	P	34.7	Very low	33.3	Very low	52 Å²	52	83 Å²	83	34%	0.338	46%	0.455	S	S	.	.			trans	-54.6	141	173.7	21.7	-30.5	0	0	0	108.3	Q539 S570 L571	Q539-P568 HydrophobicContact CG-CG 4.32Å; P568-S570 PolarHBondContact O-N 2.71Å; P568-L571 HydrophobicContact CG-CD1 4.1Å; P568-L571 PolarHBondContact O-N 2.8Å
569	V	32.3	Very low	33.1	Very low	97 Å²	97	81.3 Å²	81.3	59%	0.588	46%	0.46	S	S	*	.	H	α-helix	trans	-48.4	-30.9	-176.6	172.8	0	0	0	0	111.4	L567 L571 R572 H573	L567-V569 PolarHBondContact O-N 3.27Å; V569-L571 PolarHBondContact O-N 3.14Å; V569-L571 VanDerWaalsContact O-N 3.15Å; V569-R572 PolarHBondContact O-N 2.71Å; V569-R572 VanDerWaalsContact O-N 3.09Å; V569-H573 WeakPolarHBondContact CG1-NE2 3.49Å; V569-H573 PolarHBondContact O-CD2 3.01Å; V569-H573 PolarHBondContact O-NE2 3.35Å; V569-H573 VanDerWaalsContact O-NE2 3.13Å
570	S	36.7	Very low	32.7	Very low	24 Å²	24	81.3 Å²	81.3	17%	0.168	47%	0.471	C	S	.	.	H	α-helix	trans	-55.9	-29.2	175.8	76.4	0	0	0	0	115.5	A481 P568	A481-S570 VanDerWaalsContact CB-CB 3.42Å; P568-S570 PolarHBondContact O-N 2.71Å
571	L	41.4	Very low	32.2	Very low	16 Å²	16	82.5 Å²	82.5	8%	0.084	47%	0.473	C	S	.	.	H	α-helix	trans	-96	-9.5	-179.3	-70.4	171.3	0	0	0	113.4	T537 L567 P568 V569 L726	T537-L571 HydrophobicContact CG2-CD2 4.12Å; L567-L571 HydrophobicContact CD2-CB 4.12Å; L567-L571 HydrophobicContact CD2-CD1 3.79Å; P568-L571 HydrophobicContact CG-CD1 4.1Å; P568-L571 PolarHBondContact O-N 2.8Å; V569-L571 PolarHBondContact O-N 3.14Å; V569-L571 VanDerWaalsContact O-N 3.15Å; L571-L726 HydrophobicContact CD2-CD1 4.02Å
572	R	37.3	Very low	31.6	Very low	134 Å²	134	84.2 Å²	84.2	51%	0.506	49%	0.493	S	S	.	.	H	α-helix	trans	-84.1	-11.6	177.5	-64.3	-168.2	-164.3	-155.2	2.7	113.4	K565 L567 V569 S574	K565-R572 PolarHBondContact O-NH2 2.67Å; L567-R572 HydrophobicContact CB-CG 4.35Å; L567-R572 PolarHBondContact O-NE 2.9Å; L567-R572 PolarHBondContact O-NH2 2.88Å; V569-R572 PolarHBondContact O-N 2.71Å; V569-R572 VanDerWaalsContact O-N 3.09Å; R572-S574 PolarHBondContact O-N 3.03Å
573	H	40.3	Very low	31.3	Very low	48 Å²	48	86.2 Å²	86.2	22%	0.222	51%	0.506	C	S	.	.			trans	-85.9	78.2	-176.7	-56.2	-53.3	0	0	0	111.3	V569	V569-H573 WeakPolarHBondContact CG1-NE2 3.49Å; V569-H573 PolarHBondContact O-CD2 3.01Å; V569-H573 PolarHBondContact O-NE2 3.35Å; V569-H573 VanDerWaalsContact O-NE2 3.13Å
574	S	36	Very low	31.1	Very low	40 Å²	40	87.2 Å²	87.2	28%	0.28	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	112.9	138	52.4	0	0	0	0	107.2	R504 I505 R572 P576	R504-S574 PolarHBondContact NH2-OG 3.12Å; I505-S574 WeakPolarHBondContact O-CA 3.2Å; R572-S574 PolarHBondContact O-N 3.03Å; S574-P576 WeakPolarHBondContact O-CD 3.37Å
575	V	29.5	Very low	30.7	Very low	62 Å²	62	89.9 Å²	89.9	38%	0.376	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	105.9	169.3	-176.9	0	0	0	0	106.6	S577	V575-S577 PolarHBondContact O-N 2.73Å
576	P	29.4	Very low	30.6	Very low	87 Å²	87	86.8 Å²	86.8	57%	0.565	52%	0.52	S	S	*	.			trans	-65.2	121.4	162.6	26.7	-30.1	0	0	0	107.1	S574 V578	S574-P576 WeakPolarHBondContact O-CD 3.37Å; P576-V578 PolarHBondContact O-N 3.49Å
577	S	29.3	Very low	30.1	Very low	29 Å²	29	91.3 Å²	91.3	20%	0.203	54%	0.535	C	S	.	.			trans	-94.8	84.5	178.2	55.2	0	0	0	0	110.8	R502 V575	R502-S577 VanDerWaalsContact NE-CB 3.33Å; R502-S577 PolarHBondContact NE-OG 3.48Å; R502-S577 PolarHBondContact O-OG 2.8Å; V575-S577 PolarHBondContact O-N 2.73Å
578	V	28	Very low	29.7	Very low	98 Å²	98	102 Å²	102	59%	0.594	57%	0.573	S	S	*	*			trans	-144.1	119.2	161.3	-175.8	0	0	0	0	107.5	P576 V580	P576-V578 PolarHBondContact O-N 3.49Å; V578-V580 HydrophobicContact CG1-CG2 4.17Å
579	S	24.6	Very low	29.4	Very low	113 Å²	113	105.2 Å²	105.2	79%	0.79	59%	0.592	S	S	*	*			trans	-105.5	117.4	167.8	59.3	0	0	0	0	108.5
580	V	26.6	Very low	28.9	Very low	114 Å²	114	107.7 Å²	107.7	69%	0.691	60%	0.602	S	S	*	*			trans	-131.3	119.3	162.3	179.5	0	0	0	0	107	V578	V578-V580 HydrophobicContact CG1-CG2 4.17Å
581	E	21.7	Very low	28.6	Very low	172 Å²	172	113.9 Å²	113.9	80%	0.804	63%	0.633	S	S	*	*			trans	-71.3	130.2	170.1	-74.6	157.5	139.4	0	0	110.1
582	S	25.3	Very low	27.9	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	67%	0.672	S	S	*	*			trans	158.3	128	134.9	53.1	0	0	0	0	112.4
583	C	24.1	Very low	27.5	Very low	120 Å²	120	120.3 Å²	120.3	81%	0.811	69%	0.687	S	S	*	*			trans	48.9	129.5	141.7	-54	0	0	0	0	119.1
584	S	26.8	Very low	26.7	Very low	117 Å²	117	123.2 Å²	123.2	82%	0.818	72%	0.719	S	S	*	*			cis	-171.9	161.2	31.7	-28.1	0	0	0	0	110.2
585	N	21.8	Very low	26.5	Very low	165 Å²	165	127.4 Å²	127.4	88%	0.882	75%	0.749	S	S	*	*			trans	-38.7	140.6	172.1	-73.2	-30.4	0	0	0	118.2
586	S	29.1	Very low	26.4	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	77%	0.769	S	S	*	*			trans	-159.9	111.1	131.5	61.3	0	0	0	0	111.7
587	Q	21.9	Very low	26.4	Very low	183 Å²	183	138.1 Å²	138.1	86%	0.855	79%	0.787	S	S	*	*			trans	-63.9	135.9	162.1	-79.6	170.9	-49.2	0	0	110
588	W	26.9	Very low	26.4	Very low	255 Å²	255	143.5 Å²	143.5	97%	0.966	81%	0.813	S	S	*	*			trans	-135.4	140	149.8	-96.5	75.3	0	0	0	111
589	V	28.3	Very low	26.7	Very low	120 Å²	120	144.2 Å²	144.2	73%	0.727	82%	0.823	S	S	*	*			trans	-90.8	147.8	-153.9	169.3	0	0	0	0	111.7
590	N	22.6	Very low	27	Very low	149 Å²	149	148.5 Å²	148.5	80%	0.797	83%	0.827	S	S	*	*			trans	-82.3	129.7	172.1	-155.2	10.1	0	0	0	108.8
591	N	29.4	Very low	27.4	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	83%	0.834	S	S	*	*			trans	-141.3	117.8	164.3	-112.1	-6.4	0	0	0	111.1
592	K	27.2	Very low	27.9	Very low	205 Å²	205	150.6 Å²	150.6	89%	0.891	83%	0.833	S	S	*	*			trans	-79.5	136.3	162.9	-78.4	-179.8	172.9	-179.7	0	108.3
593	G	28.6	Very low	28.3	Very low	80 Å²	80	150.1 Å²	150.1	83%	0.825	83%	0.83	S	S	*	*			trans	-144.1	112.6	164.1	0	0	0	0	0	108.8
594	A	24.6	Very low	28.8	Very low	108 Å²	108	149.8 Å²	149.8	89%	0.893	82%	0.824	S	S	*	*			trans	-92.1	133.9	167.4	0	0	0	0	0	108.1
595	S	30.7	Very low	29.2	Very low	129 Å²	129	153.2 Å²	153.2	90%	0.902	82%	0.824	S	S	*	*			trans	-151.1	144.1	149.7	73.9	0	0	0	0	109.7
596	Q	26.6	Very low	29.7	Very low	171 Å²	171	155.7 Å²	155.7	80%	0.799	82%	0.821	S	S	*	*			trans	-108.3	137.5	-168.9	179.1	-173.9	25.8	0	0	106.6
597	E	30.7	Very low	29.9	Very low	202 Å²	202	155.5 Å²	155.5	94%	0.944	82%	0.815	S	S	*	*			trans	-155.2	139.7	158.5	-121.8	170.6	-170.4	0	0	112.3
598	N	28.1	Very low	30.3	Very low	142 Å²	142	154.6 Å²	154.6	76%	0.759	81%	0.811	S	S	*	*			trans	-97.5	149.8	-167.2	-75.9	-41.1	0	0	0	112.3
599	S	34.3	Very low	30.4	Very low	114 Å²	114	147.3 Å²	147.3	80%	0.797	80%	0.799	S	S	*	*			trans	171.1	102.2	138.9	50.8	0	0	0	0	109.8
600	K	32.4	Very low	30.5	Very low	202 Å²	202	150.5 Å²	150.5	88%	0.878	80%	0.803	S	S	*	*				53.2	111	88.9	-86.4	-172.2	178.1	179.2	0	116.6
601	E	33.7	Very low	30.7	Very low	179 Å²	179	152.1 Å²	152.1	84%	0.836	80%	0.803	S	S	*	*				170.5	107.1	125.1	-94.9	-178.2	164.7	0	0	110
602	I	33.7	Very low	30.6	Very low	152 Å²	152	153.7 Å²	153.7	78%	0.779	81%	0.805	S	S	*	*				64.5	111.2	93.1	-58.2	169.6	0	0	0	114.3
603	S	33.5	Very low	30.6	Very low	94 Å²	94	152.2 Å²	152.2	66%	0.657	80%	0.802	S	S	*	*				167.2	109.3	107.7	-154.1	0	0	0	0	115.2
604	T	33.6	Very low	30.8	Very low	112 Å²	112	152.6 Å²	152.6	69%	0.687	79%	0.79	S	S	*	*			trans	61.6	131.4	133.2	62.1	0	0	0	0	126.2
605	K	34.7	Very low	30.8	Very low	190 Å²	190	156 Å²	156	83%	0.826	79%	0.785	S	S	*	*			trans	80.8	138.8	140.8	-74.5	167.1	-178.5	-179.3	0	118.1
606	R	32.2	Very low	30.9	Very low	216 Å²	216	156.9 Å²	156.9	82%	0.815	78%	0.778	S	S	*	*			cis	-178.9	139.6	-14.3	-161.4	-168	179.9	161.7	-1.3	104.5
607	T	33.7	Very low	30.8	Very low	107 Å²	107	153.6 Å²	153.6	66%	0.656	77%	0.773	S	S	*	*			trans	56.5	147.5	151.3	33.3	0	0	0	0	119.8
608	E	29.8	Very low	30.9	Very low	165 Å²	165	150.1 Å²	150.1	77%	0.771	77%	0.769	S	S	*	*			cis	-172.7	149.6	-15.7	-140.5	172.1	-178.9	0	0	106.2
609	S	29.9	Very low	30.8	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	77%	0.768	S	S	*	*			trans	58.3	116.4	147.8	61.9	0	0	0	0	123.8
610	K	29.6	Very low	30.6	Very low	187 Å²	187	150 Å²	150	81%	0.813	77%	0.773	S	S	*	*				73.8	114.4	128	-97.7	175.9	177.1	170.7	0	121.9
611	K	27	Very low	30.3	Very low	184 Å²	184	147.5 Å²	147.5	80%	0.8	77%	0.768	S	S	*	*				52.3	109.2	128.6	-80	-174.6	173.4	-176.6	0	118.4
612	Q	27.6	Very low	30.1	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	77%	0.766	S	S	*	*				172.2	143.4	107.8	-100	169	-17.9	0	0	111.9
613	Q	27.5	Very low	30.1	Very low	174 Å²	174	145.9 Å²	145.9	81%	0.813	76%	0.764	S	S	*	*			trans	69.6	169.2	154.4	-86.9	-154.9	-2.3	0	0	119.3
614	P	32.2	Very low	29.7	Very low	88 Å²	88	149.5 Å²	149.5	57%	0.571	77%	0.771	S	S	*	*			cis	-142.6	-177.1	-39.3	38.1	-19.7	0	0	0	114.3
615	F	26.1	Very low	29.6	Very low	179 Å²	179	150.2 Å²	150.2	79%	0.785	78%	0.777	S	S	*	*			trans	71.6	134.8	138.8	-90.3	-57.3	0	0	0	124.6
616	I	31.2	Very low	29.4	Very low	148 Å²	148	151.3 Å²	151.3	76%	0.759	78%	0.776	S	S	*	*			trans	86.7	130.4	137.7	-58.8	161.2	0	0	0	120.5
617	S	25.4	Very low	29.3	Very low	101 Å²	101	147.5 Å²	147.5	71%	0.706	77%	0.772	S	S	*	*			trans	-52.7	178.3	176.7	-53	0	0	0	0	116.7
618	P	31.8	Very low	29.2	Very low	130 Å²	130	150.7 Å²	150.7	84%	0.844	78%	0.784	S	S	*	*				-143.6	153	96.3	34.9	-18.1	0	0	0	116.4
619	T	27.2	Very low	29.1	Very low	120 Å²	120	150 Å²	150	74%	0.736	79%	0.786	S	S	*	*			trans	-61.3	146.2	167.7	-42.4	0	0	0	0	112.2
620	C	30.4	Very low	29.2	Very low	134 Å²	134	152.7 Å²	152.7	91%	0.905	79%	0.791	S	S	*	*			trans	-137.7	123.3	151.8	-99.8	0	0	0	0	110.8
621	L	24.9	Very low	29.1	Very low	149 Å²	149	147.4 Å²	147.4	78%	0.78	78%	0.778	S	S	*	*			trans	-70.6	155	175.1	-67.2	153.1	0	0	0	110.8
622	L	30.9	Very low	29.3	Very low	152 Å²	152	147.4 Å²	147.4	80%	0.796	78%	0.781	S	S	*	*				-178.2	112.8	123.1	-112.9	86.8	0	0	0	112.5
623	I	32.5	Very low	29.4	Very low	144 Å²	144	146.5 Å²	146.5	74%	0.738	78%	0.776	S	S	*	*			trans	70.2	106.7	131.6	-55.3	170.9	0	0	0	120.4
624	Q	25.2	Very low	29.6	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.794	78%	0.776	S	S	*	*			trans	-79.2	162.3	148.7	-82.6	-176.7	-30.6	0	0	111
625	P	32.4	Very low	29.3	Very low	128 Å²	128	146.8 Å²	146.8	83%	0.831	79%	0.787	S	S	*	*			trans	-124.1	149.3	130.4	34.2	-24.5	0	0	0	113.5
626	R	30.6	Very low	29.6	Very low	212 Å²	212	143.8 Å²	143.8	80%	0.8	78%	0.783	S	S	*	*			trans	-79.1	158.1	-176.7	-91.2	174.7	166.7	155	-4.8	113.6
627	N	29.5	Very low	29.4	Very low	136 Å²	136	141.6 Å²	141.6	73%	0.727	78%	0.781	S	S	*	*			trans	69.6	118.9	143.6	-70.2	-28.6	0	0	0	119.4
628	L	32.4	Very low	29.6	Very low	175 Å²	175	145 Å²	145	92%	0.916	79%	0.79	S	S	*	*				-149.9	128.5	110.1	-97.6	166.5	0	0	0	109.3
629	N	26.9	Very low	29.4	Very low	149 Å²	149	143.8 Å²	143.8	80%	0.797	78%	0.782	S	S	*	*			trans	-92.3	123	-176.1	-154.5	3.7	0	0	0	107.1
630	L	31.9	Very low	29.5	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	78%	0.778	S	S	*	*			trans	-152.3	101.7	159.9	-106.7	137.2	0	0	0	108.4
631	S	27.2	Very low	29.5	Very low	77 Å²	77	142.1 Å²	142.1	54%	0.538	77%	0.774	S	S	.	*			trans	-21.1	127.8	155.5	44.6	0	0	0	0	114.6
632	H	32.4	Very low	29.8	Very low	183 Å²	183	142 Å²	142	85%	0.847	77%	0.773	S	S	*	*				-162.5	127.5	122.7	-91.4	-66.8	0	0	0	109.4	L634	H632-L634 PolarHBondContact O-N 3.15Å
633	H	28.8	Very low	29.8	Very low	169 Å²	169	138.3 Å²	138.3	78%	0.782	76%	0.76	S	S	*	*			trans	-64.4	121.2	176.7	-62.7	-104.1	0	0	0	110.7
634	L	31.6	Very low	29.7	Very low	156 Å²	156	139.9 Å²	139.9	82%	0.817	76%	0.762	S	S	*	*			trans	-140.4	81.2	152.2	-81.7	177.2	0	0	0	109.5	H632 T636	H632-L634 PolarHBondContact O-N 3.15Å; L634-T636 PolarHBondContact O-N 3.13Å
635	S	26.5	Very low	30	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	75%	0.75	S	S	*	*			trans	-64.6	106.9	151.9	-48.3	0	0	0	0	107.8
636	T	31.3	Very low	29.8	Very low	115 Å²	115	137.3 Å²	137.3	71%	0.706	75%	0.745	S	S	*	*			trans	-119.7	87.9	161.4	51.8	0	0	0	0	108.9	L634 L638	L634-T636 PolarHBondContact O-N 3.13Å; T636-L638 PolarHBondContact O-N 3.06Å
637	S	28.1	Very low	29.9	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	75%	0.745	S	S	*	*			trans	-42.4	126.1	148.2	49	0	0	0	0	110.6	P639	S637-P639 VanDerWaalsContact O-CD 3.24Å; S637-P639 WeakPolarHBondContact O-CD 3.36Å
638	L	29.8	Very low	29.9	Very low	173 Å²	173	133.8 Å²	133.8	91%	0.906	75%	0.75	S	S	*	*			trans	-96.5	98.2	154.5	-92.3	146.8	0	0	0	106.8	T636	T636-L638 PolarHBondContact O-N 3.06Å
639	P	26.8	Very low	30	Very low	103 Å²	103	131 Å²	131	67%	0.669	75%	0.745	S	S	*	*			trans	-74.5	136.3	166.1	31.4	-29.5	0	0	0	108.3	S637	S637-P639 VanDerWaalsContact O-CD 3.24Å; S637-P639 WeakPolarHBondContact O-CD 3.36Å
640	S	30.7	Very low	30.2	Very low	94 Å²	94	127 Å²	127	66%	0.657	74%	0.74	S	S	*	*			trans	-33.4	135.2	158.4	-42.4	0	0	0	0	111.5	L642	S640-L642 PolarHBondContact O-N 3.09Å
641	P	30.1	Very low	30.2	Very low	125 Å²	125	125.1 Å²	125.1	81%	0.812	74%	0.74	S	S	*	*			trans	-76.4	77.3	166.6	31.9	-29.9	0	0	0	108.2	S643	P641-S643 PolarHBondContact O-N 2.92Å
642	L	30.2	Very low	30.5	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	75%	0.754	S	S	*	*			trans	-69.1	89.5	155.9	-88.5	164.1	0	0	0	106.6	S640 K644	S640-L642 PolarHBondContact O-N 3.09Å; L642-K644 PolarHBondContact O-N 3.43Å
643	S	32.1	Very low	30.4	Very low	75 Å²	75	123.8 Å²	123.8	52%	0.524	75%	0.748	S	S	.	*			trans	-67.3	90.8	166.2	-55.2	0	0	0	0	107.6	P641 V645	P641-S643 PolarHBondContact O-N 2.92Å; S643-V645 VanDerWaalsContact C-N 3.25Å; S643-V645 PolarHBondContact O-N 3.15Å
644	K	29.7	Very low	30.5	Very low	177 Å²	177	124.9 Å²	124.9	77%	0.77	75%	0.751	S	S	*	*			trans	-67.9	88.9	165.5	-161.1	175.8	-174.4	179.4	0	106.7	L642 H646	L642-K644 PolarHBondContact O-N 3.43Å; K644-H646 VanDerWaalsContact C-N 3.34Å; K644-H646 PolarHBondContact O-N 3.36Å
645	V	31.5	Very low	30.6	Very low	92 Å²	92	127.3 Å²	127.3	56%	0.558	75%	0.749	S	S	*	*			trans	-73.9	92.6	172.3	178.7	0	0	0	0	107.3	S643 L647	S643-V645 VanDerWaalsContact C-N 3.25Å; S643-V645 PolarHBondContact O-N 3.15Å; V645-L647 HydrophobicContact CG1-CD1 4.19Å; V645-L647 HydrophobicContact CG1-CG 3.93Å
646	H	27.6	Very low	30.7	Very low	153 Å²	153	128.7 Å²	128.7	71%	0.708	74%	0.743	S	S	*	*			trans	-77.7	106.9	157.4	-101.1	-90.6	0	0	0	107	K644	K644-H646 VanDerWaalsContact C-N 3.34Å; K644-H646 PolarHBondContact O-N 3.36Å
647	L	33.2	Very low	30.8	Very low	153 Å²	153	131.2 Å²	131.2	80%	0.801	75%	0.749	S	S	*	*			trans	-92.3	106.3	159	-79.4	163.7	0	0	0	106.9	V645 S649	V645-L647 HydrophobicContact CG1-CD1 4.19Å; V645-L647 HydrophobicContact CG1-CG 3.93Å; L647-S649 PolarHBondContact O-N 2.56Å
648	S	28.8	Very low	30.8	Very low	120 Å²	120	132.4 Å²	132.4	84%	0.839	75%	0.752	S	S	*	*			trans	-65.4	104	165.6	23.9	0	0	0	0	109
649	S	34.5	Very low	30.9	Very low	116 Å²	116	128 Å²	128	81%	0.811	75%	0.748	S	S	*	*			trans	-89.3	112.1	161.9	56.4	0	0	0	0	108.7	L647	L647-S649 PolarHBondContact O-N 2.56Å
650	G	32.4	Very low	30.8	Very low	67 Å²	67	129 Å²	129	69%	0.691	76%	0.756	S	S	*	*			trans	-70.4	138.9	170.1	0	0	0	0	0	112.3
651	S	31.6	Very low	30.9	Very low	118 Å²	118	130.1 Å²	130.1	83%	0.825	76%	0.764	S	S	*	*			trans	52.4	105	145	59.8	0	0	0	0	119.9
652	S	33.1	Very low	30.7	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	76%	0.762	S	S	*	*				-174.9	148.7	100.5	45	0	0	0	0	111
653	P	30.1	Very low	30.8	Very low	112 Å²	112	130.8 Å²	130.8	73%	0.727	77%	0.77	S	S	*	*			trans	-99.2	146.5	-165	36.6	-29.1	0	0	0	111.6
654	F	31.5	Very low	30.4	Very low	193 Å²	193	135.8 Å²	135.8	85%	0.846	79%	0.785	S	S	*	*			trans	-162	121.6	138.9	-115.7	-82.8	0	0	0	111.3
655	R	32.7	Very low	30.4	Very low	207 Å²	207	135 Å²	135	78%	0.781	79%	0.788	S	S	*	*			trans	-1.6	153.3	151.5	-68.8	-177.2	179.3	-142.6	5.2	117.6
656	Q	28.6	Very low	30	Very low	142 Å²	142	135.5 Å²	135.5	66%	0.664	80%	0.796	S	S	*	*			cis	167.8	136.6	-0.3	178.4	173.2	7.3	0	0	102.7
657	M	33.3	Very low	29.9	Very low	168 Å²	168	135.4 Å²	135.4	83%	0.828	81%	0.805	S	S	*	*			trans	162.2	86.4	143.6	-85.8	-58.6	-117.8	0	0	110.5
658	T	29.5	Very low	29.5	Very low	128 Å²	128	132.9 Å²	132.9	79%	0.785	80%	0.8	S	S	*	*			trans	18	133.3	131.1	42	0	0	0	0	121.2
659	G	31	Very low	29.3	Very low	79 Å²	79	132 Å²	132	81%	0.814	79%	0.794	S	S	*	*			trans	-178.2	82.3	156.9	0	0	0	0	0	112.5
660	C	25.6	Very low	28.9	Very low	124 Å²	124	137 Å²	137	84%	0.838	80%	0.797	S	S	*	*			trans	-58.5	146.1	177.2	-70.8	0	0	0	0	114.1
661	S	32.3	Very low	28.4	Very low	119 Å²	119	144.1 Å²	144.1	83%	0.832	80%	0.803	S	S	*	*				-176.6	127.6	106.2	-75.3	0	0	0	0	112
662	S	25.1	Very low	28.2	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	80%	0.803	S	S	*	*			trans	-60.2	151.1	173	46.6	0	0	0	0	114.2
663	L	31.6	Very low	27.9	Very low	175 Å²	175	147.1 Å²	147.1	92%	0.916	80%	0.804	S	S	*	*				-161.4	118.3	127.9	-99.7	164.5	0	0	0	108.9
664	E	24.6	Very low	27.6	Very low	180 Å²	180	145.5 Å²	145.5	84%	0.841	80%	0.8	S	S	*	*			trans	-64.2	149.4	166.8	-64	-156.1	142.5	0	0	111
665	L	28.6	Very low	27.4	Very low	161 Å²	161	140.6 Å²	140.6	84%	0.843	79%	0.785	S	S	*	*			trans	-171.1	103.6	146.1	-97.2	152.6	0	0	0	110.1
666	S	25	Very low	26.9	Very low	102 Å²	102	136 Å²	136	71%	0.713	79%	0.785	S	S	*	*				53.7	111	124.5	-46.1	0	0	0	0	121.3
667	V	24.6	Very low	26.8	Very low	151 Å²	151	137.1 Å²	137.1	92%	0.915	79%	0.788	S	S	*	*			trans	-1.7	120	141.6	-174.5	0	0	0	0	116.8
668	S	25.1	Very low	26.4	Very low	99 Å²	99	137.4 Å²	137.4	69%	0.692	79%	0.787	S	S	*	*			trans	-152.4	131.3	156.1	172.2	0	0	0	0	110.8	Y670	S668-Y670 PolarHBondContact O-N 2.7Å
669	S	24.3	Very low	26.3	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	79%	0.788	S	S	*	*			trans	-60.7	124.4	-175.3	67.1	0	0	0	0	112.9	R671	S669-R671 PolarHBondContact O-N 2.66Å
670	Y	25.2	Very low	26	Very low	221 Å²	221	137.2 Å²	137.2	87%	0.867	78%	0.779	S	S	*	*			trans	-92	101.5	168.2	-96.2	-90.3	0	0	0	111.1	S668	S668-Y670 PolarHBondContact O-N 2.7Å
671	R	23.8	Very low	26	Very low	217 Å²	217	140.4 Å²	140.4	82%	0.819	78%	0.779	S	S	*	*			trans	-68.2	138.8	155.5	-76.8	-177.5	173.3	-175.9	-0.8	108.7	S669 M673	S669-R671 PolarHBondContact O-N 2.66Å; R671-M673 PolarHBondContact O-N 3.32Å; R671-M673 VanDerWaalsContact O-N 3.12Å
672	P	27.2	Very low	25.8	Very low	128 Å²	128	141.4 Å²	141.4	83%	0.831	77%	0.773	S	S	*	*			trans	-73.5	108.5	172.2	28.2	-28.7	0	0	0	109.2	A674	P672-A674 PolarHBondContact O-N 2.91Å
673	M	25.8	Very low	25.7	Very low	172 Å²	172	139.6 Å²	139.6	85%	0.847	77%	0.772	S	S	*	*			trans	-59.4	123.5	169.8	-99.2	-166.2	-87.1	0	0	110.1	R671 V675	R671-M673 PolarHBondContact O-N 3.32Å; R671-M673 VanDerWaalsContact O-N 3.12Å; M673-V675 PolarHBondContact O-N 3.17Å
674	A	24.6	Very low	25.5	Very low	78 Å²	78	137.1 Å²	137.1	65%	0.645	76%	0.764	S	S	*	*			trans	-74.8	99.2	168.7	0	0	0	0	0	109.3	P672	P672-A674 PolarHBondContact O-N 2.91Å
675	V	26	Very low	25.5	Very low	89 Å²	89	137 Å²	137	54%	0.539	76%	0.764	S	S	.	*			trans	-86.2	114.8	163.4	-94.5	0	0	0	0	109	M673	M673-V675 PolarHBondContact O-N 3.17Å
676	S	23.7	Very low	25.3	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	76%	0.759	S	S	*	*			trans	-68.8	129.5	166.8	-82.6	0	0	0	0	109.4
677	F	25.9	Very low	25.3	Very low	166 Å²	166	137 Å²	137	73%	0.728	76%	0.764	S	S	*	*			trans	-91.4	97.5	159.3	-89.2	-87.3	0	0	0	107.7	S679	F677-S679 PolarHBondContact O-N 3.28Å
678	E	25.3	Very low	25.5	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	76%	0.758	S	S	*	*			trans	-72.2	112.7	154.6	-122.2	164.9	177.4	0	0	106.6	S680	E678-S680 PolarHBondContact O-N 2.9Å
679	S	26.8	Very low	25.6	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	77%	0.768	S	S	*	*			trans	-75.2	79.3	165.7	52.6	0	0	0	0	107.6	F677	F677-S679 PolarHBondContact O-N 3.28Å
680	S	25.8	Very low	25.8	Very low	88 Å²	88	135.4 Å²	135.4	62%	0.615	77%	0.772	S	S	*	*			trans	-72.3	121.3	162.2	37.4	0	0	0	0	108.3	E678 I682	E678-S680 PolarHBondContact O-N 2.9Å; S680-I682 PolarHBondContact O-N 3.02Å; S680-I682 VanDerWaalsContact O-N 3.15Å
681	F	25	Very low	25.9	Very low	191 Å²	191	129.7 Å²	129.7	84%	0.838	77%	0.765	S	S	*	*			trans	-47.5	114.3	157.3	-86.8	-106.5	0	0	0	108.7
682	I	27	Very low	26.1	Very low	139 Å²	139	125.8 Å²	125.8	71%	0.713	77%	0.769	S	S	*	*			trans	-129.8	107.7	157.1	-62.1	-177.9	0	0	0	105.3	S680 T684	S680-I682 PolarHBondContact O-N 3.02Å; S680-I682 VanDerWaalsContact O-N 3.15Å; I682-T684 PolarHBondContact O-N 2.76Å
683	G	24.8	Very low	26	Very low	73 Å²	73	126.1 Å²	126.1	75%	0.753	77%	0.769	S	S	*	*			trans	-61.3	119	169.3	0	0	0	0	0	108.9
684	T	26.5	Very low	26.2	Very low	122 Å²	122	122.9 Å²	122.9	75%	0.748	77%	0.769	S	S	*	*			trans	-91.6	103.9	162.3	-21.1	0	0	0	0	106.7	I682 C686	I682-T684 PolarHBondContact O-N 2.76Å; T684-C686 PolarHBondContact O-N 3.35Å
685	Q	23.6	Very low	26.3	Very low	178 Å²	178	123.7 Å²	123.7	83%	0.832	78%	0.776	S	S	*	*			trans	-49.9	124.7	159.8	-75.5	179.8	3.5	0	0	108.3
686	C	26.2	Very low	26.3	Very low	110 Å²	110	126 Å²	126	74%	0.743	79%	0.79	S	S	*	*			trans	-131.1	93.3	164.5	-62.9	0	0	0	0	106.7	T684 S688	T684-C686 PolarHBondContact O-N 3.35Å; C686-S688 PolarHBondContact O-N 3.04Å
687	N	23.9	Very low	26.5	Very low	152 Å²	152	125.9 Å²	125.9	81%	0.813	79%	0.789	S	S	*	*			trans	-55.5	114.8	164	-76.1	-22.4	0	0	0	109.4
688	S	30.2	Very low	26.4	Very low	113 Å²	113	124.3 Å²	124.3	79%	0.79	79%	0.793	S	S	*	*			trans	-157.8	117.7	148.5	-39.1	0	0	0	0	109.3	C686	C686-S688 PolarHBondContact O-N 3.04Å
689	S	26.8	Very low	26.6	Very low	129 Å²	129	121.9 Å²	121.9	90%	0.902	79%	0.794	S	S	*	*			trans	-53.6	144.1	178.4	30.5	0	0	0	0	114.8
690	G	28.1	Very low	26.5	Very low	77 Å²	77	122.9 Å²	122.9	79%	0.794	80%	0.795	S	S	*	*			trans	170.8	74.1	173.1	0	0	0	0	0	113.4
691	S	26.9	Very low	26.9	Very low	102 Å²	102	124 Å²	124	71%	0.713	80%	0.803	S	S	*	*			trans	-34.2	129.4	174.5	-179.6	0	0	0	0	116.1
692	C	28.7	Very low	27	Very low	135 Å²	135	123 Å²	123	91%	0.912	81%	0.807	S	S	*	*			trans	-154	99.5	143.5	-80.7	0	0	0	0	107.6
693	T	25.2	Very low	27.3	Very low	134 Å²	134	121.7 Å²	121.7	82%	0.822	81%	0.81	S	S	*	*			trans	-82.3	133.6	179.9	38.6	0	0	0	0	111.6
694	A	30	Very low	27.5	Very low	104 Å²	104	124.4 Å²	124.4	86%	0.86	82%	0.817	S	S	*	*			trans	-143.9	114.6	151.8	0	0	0	0	0	108.1
695	A	26.2	Very low	27.7	Very low	95 Å²	95	122.2 Å²	122.2	79%	0.785	82%	0.819	S	S	*	*			trans	-74.3	142.7	-169.5	0	0	0	0	0	112.8
696	V	26.7	Very low	27.8	Very low	139 Å²	139	117.4 Å²	117.4	84%	0.842	82%	0.818	S	S	*	*			trans	-114.3	110.5	155.3	177.9	0	0	0	0	106.4
697	S	27.3	Very low	28	Very low	106 Å²	106	118.8 Å²	118.8	74%	0.741	82%	0.822	S	S	*	*			trans	-72.3	122.3	174.3	-62	0	0	0	0	110.4
698	T	23.9	Very low	28.1	Very low	134 Å²	134	116 Å²	116	82%	0.822	82%	0.821	S	S	*	*			trans	-84.9	122.9	164.2	7.9	0	0	0	0	108.9
699	C	29.1	Very low	28	Very low	123 Å²	123	117 Å²	117	83%	0.831	82%	0.822	S	S	*	*			trans	-110.6	103.9	165.9	-62.2	0	0	0	0	108.7
700	T	25.3	Very low	28	Very low	136 Å²	136	117 Å²	117	83%	0.834	82%	0.822	S	S	*	*			trans	-79.8	128.3	161.5	41.8	0	0	0	0	109.3
701	S	32.7	Very low	28	Very low	111 Å²	111	118 Å²	118	78%	0.776	82%	0.823	S	S	*	*			trans	-142.4	107.3	158.5	56.6	0	0	0	0	109.7
702	N	27.7	Very low	28	Very low	171 Å²	171	116.8 Å²	116.8	91%	0.914	83%	0.827	S	S	*	*			trans	-69	127.7	161.8	-80.2	-18.6	0	0	0	109
703	S	33.8	Very low	28	Very low	111 Å²	111	116.9 Å²	116.9	78%	0.776	82%	0.823	S	S	*	*			trans	-154	115.8	148.5	45.7	0	0	0	0	110.2
704	S	29.7	Very low	28.1	Very low	130 Å²	130	115.4 Å²	115.4	91%	0.909	82%	0.818	S	S	*	*			trans	-56.5	134	165.4	47	0	0	0	0	111.6
705	G	30.2	Very low	28.2	Very low	77 Å²	77	115.8 Å²	115.8	79%	0.794	81%	0.81	S	S	*	*			trans	170.3	93.1	170.8	0	0	0	0	0	110.5
706	G	26.2	Very low	28.7	Very low	77 Å²	77	118.1 Å²	118.1	79%	0.794	81%	0.807	S	S	*	*			trans	-71.2	138.4	178.3	0	0	0	0	0	112
707	V	29.1	Very low	29.4	Very low	138 Å²	138	116.6 Å²	116.6	84%	0.836	79%	0.794	S	S	*	*			trans	-151.7	126.2	143.3	-178.7	0	0	0	0	107.1	T709	V707-T709 PolarHBondContact O-N 2.88Å
708	A	27.3	Very low	30.6	Very low	95 Å²	95	114.9 Å²	114.9	79%	0.785	78%	0.782	S	S	*	*			trans	-63.8	126.2	177.1	0	0	0	0	0	111.5
709	T	28.1	Very low	32.4	Very low	134 Å²	134	113.4 Å²	113.4	82%	0.822	77%	0.773	S	S	*	*			trans	-148.7	134.4	151	41.8	0	0	0	0	110	V707	V707-T709 PolarHBondContact O-N 2.88Å
710	S	26.6	Very low	34.6	Very low	127 Å²	127	109.4 Å²	109.4	89%	0.888	75%	0.745	S	S	*	*			trans	-51.9	125	179.2	48	0	0	0	0	114.4
711	A	27.8	Very low	37.1	Very low	99 Å²	99	105.2 Å²	105.2	82%	0.818	72%	0.716	S	S	*	*			trans	-147.6	128.8	165.1	0	0	0	0	0	110.9
712	G	26.9	Very low	39.5	Very low	77 Å²	77	101.4 Å²	101.4	79%	0.794	69%	0.687	S	S	*	*			trans	-63.9	146.9	-169.6	0	0	0	0	0	115.1	S714	G712-S714 PolarHBondContact O-N 2.75Å; G712-S714 VanDerWaalsContact O-N 3.14Å
713	T	27.7	Very low	42.3	Very low	137 Å²	137	95.4 Å²	95.4	84%	0.84	65%	0.654	S	S	*	*			trans	-72.8	98.4	178.7	-21	0	0	0	0	110.3	V715	T713-V715 PolarHBondContact O-N 2.8Å
714	S	27.4	Very low	45	Very low	103 Å²	103	90.1 Å²	90.1	72%	0.72	62%	0.618	S	S	*	*			trans	-78.7	104.2	166.7	68.5	0	0	0	0	109.6	G712 I716	G712-S714 PolarHBondContact O-N 2.75Å; G712-S714 VanDerWaalsContact O-N 3.14Å; S714-I716 PolarHBondContact O-N 3.32Å
715	V	33.5	Very low	47.9	Very low	112 Å²	112	84 Å²	84	68%	0.679	58%	0.575	S	S	*	*			trans	-72.5	108.6	173.9	-177.9	0	0	0	0	108.9	T713 N717	T713-V715 PolarHBondContact O-N 2.8Å; V715-N717 PolarHBondContact O-N 2.81Å
716	I	35	Very low	50.8	Low	144 Å²	144	80.3 Å²	80.3	74%	0.738	54%	0.537	S	S	*	.			trans	-78.5	101.3	173	-55.8	174.4	0	0	0	107.8	S714 S718	S714-I716 PolarHBondContact O-N 3.32Å; I716-S718 PolarHBondContact O-N 3.06Å; I716-S718 VanDerWaalsContact O-N 3.07Å
717	N	41.8	Very low	53.9	Low	106 Å²	106	76.7 Å²	76.7	57%	0.567	50%	0.499	S	S	*	.			trans	-75.1	90	175.1	-74.7	-22.6	0	0	0	110.5	V715 T719	V715-N717 PolarHBondContact O-N 2.81Å; N717-T719 PolarHBondContact O-N 2.85Å
718	S	52	Low	56.8	Low	70 Å²	70	70.7 Å²	70.7	49%	0.49	46%	0.462	S	S	.	.			trans	-71.4	120.4	170.9	-63.6	0	0	0	0	110.5	Y543 I716	Y543-S718 WeakPolarHBondContact CD2-O 3.5Å; Y543-S718 PolarHBondContact N-O 2.76Å; I716-S718 PolarHBondContact O-N 3.06Å; I716-S718 VanDerWaalsContact O-N 3.07Å
719	T	61.7	Low	59.7	Low	103 Å²	103	67.6 Å²	67.6	63%	0.632	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.4	172.7	58.3	0	0	0	0	110.6	V541 N717	V541-T719 WeakPolarHBondContact O-CA 3.5Å; N717-T719 PolarHBondContact O-N 2.85Å
720	V	76.8	Confident	62.3	Low	40 Å²	40	61.4 Å²	61.4	24%	0.242	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.8	175	170.4	0	0	0	0	110.2	A540 V541 Y543 I722	A540-V720 CarbonylContact C-O 3.5Å; A540-V720 WeakPolarHBondContact CA-O 3.44Å; V541-V720 PolarHBondContact N-O 3.04Å; V541-V720 PolarHBondContact O-N 2.82Å; Y543-V720 HydrophobicContact CD2-CG2 4.35Å; Y543-V720 HydrophobicContact CE2-CB 4.11Å; Y543-V720 HydrophobicContact CE2-CG2 3.37Å; V720-I722 HydrophobicContact CG1-CG2 4.19Å
721	Q	78.2	Confident	64.7	Low	47 Å²	47	57.1 Å²	57.1	22%	0.22	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129	171.8	-62	-175	8.9	0	0	109.9	L484 P485 Q539	L484-Q721 HydrophobicContact CD2-CG 3.84Å; P485-Q721 PolarHBondContact O-NE2 2.84Å; Q539-Q721 WeakPolarHBondContact O-CA 3.43Å
722	I	83	Confident	66.8	Low	32 Å²	32	56.5 Å²	56.5	16%	0.164	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	152.8	174.8	63.5	166.2	0	0	0	111.1	R538 Q539 V541 F561 V720 V724	R538-I722 WeakPolarHBondContact CA-O 2.97Å; Q539-I722 PolarHBondContact N-O 3.46Å; Q539-I722 PolarHBondContact O-N 2.88Å; V541-I722 HydrophobicContact CG2-CD1 3.65Å; V541-I722 HydrophobicContact CG2-CG1 3.72Å; F561-I722 HydrophobicContact CE1-CD1 3.86Å; F561-I722 HydrophobicContact CZ-CD1 3.69Å; V720-I722 HydrophobicContact CG1-CG2 4.19Å; I722-V724 HydrophobicContact CD1-CG2 3.9Å; I722-V724 HydrophobicContact CG1-CG2 3.85Å
723	D	86.5	Confident	68.7	Low	44 Å²	44	55.8 Å²	55.8	24%	0.235	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.3	169.4	-82.1	-0.5	0	0	0	109.7	I536 R538	I536-D723 HydrophobicContact CG2-CB 4.09Å; R538-D723 WeakPolarHBondContact CG-OD1 3.34Å; R538-D723 IonicContact NE-OD1 3.49Å; R538-D723 PolarHBondContact NE-OD1 2.8Å
724	V	88.5	Confident	70.7	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.4	179.9	-179.3	0	0	0	0	108.8	Q35 I536 T537 Q539 F561 I722 L726	Q35-V724 HydrophobicContact CG-CG1 3.45Å; Q35-V724 VanDerWaalsContact CG-CG1 3.45Å; I536-V724 CarbonylContact C-O 3.49Å; I536-V724 WeakPolarHBondContact CA-O 3.25Å; T537-V724 HydrophobicContact CG2-CB 4.41Å; T537-V724 PolarHBondContact N-O 3.44Å; T537-V724 PolarHBondContact O-N 2.84Å; T537-V724 VanDerWaalsContact O-O 3.13Å; Q539-V724 HydrophobicContact CB-CG2 3.91Å; F561-V724 HydrophobicContact CE1-CG1 4.4Å; F561-V724 HydrophobicContact CE1-CG2 3.9Å; F561-V724 HydrophobicContact CZ-CG2 4.38Å; I722-V724 HydrophobicContact CD1-CG2 3.9Å; I722-V724 HydrophobicContact CG1-CG2 3.85Å; V724-L726 HydrophobicContact CG1-CD2 3.96Å
725	L	91.3	Very high	73	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.3	172.3	-173.6	143.6	0	0	0	110.2	Q35 C36 W41 M56 A534 L535 I536 V727	Q35-L725 WeakPolarHBondContact CA-O 3.46Å; C36-L725 PolarHBondContact N-O 3.38Å; C36-L725 PolarHBondContact O-N 3.38Å; W41-L725 HydrophobicContact CB-CD1 4.02Å; W41-L725 HydrophobicContact CD2-CD1 3.47Å; W41-L725 VanDerWaalsContact CD2-CD1 3.47Å; W41-L725 HydrophobicContact CD2-CD2 3.74Å; W41-L725 HydrophobicContact CD2-CG 4.22Å; W41-L725 HydrophobicContact CE3-CD1 4.07Å; W41-L725 HydrophobicContact CE3-CD2 3.38Å; W41-L725 HydrophobicContact CE3-CG 4.33Å; W41-L725 HydrophobicContact CG-CD1 3.44Å; W41-L725 VanDerWaalsContact CG-CD1 3.44Å; W41-L725 HydrophobicContact CG-CD2 4.38Å; W41-L725 HydrophobicContact CG-CG 4.44Å; W41-L725 HydrophobicContact CH2-CD2 4.06Å; W41-L725 HydrophobicContact CZ2-CD1 4.3Å; W41-L725 HydrophobicContact CZ2-CD2 4.39Å; W41-L725 HydrophobicContact CZ3-CD2 3.57Å; M56-L725 HydrophobicContact CE-CD1 4.23Å; M56-L725 HydrophobicContact CG-CD1 4.36Å; A534-L725 HydrophobicContact CB-CD2 4.31Å; L535-L725 WeakPolarHBondContact O-CA 3.31Å; I536-L725 HydrophobicContact CG1-CB 4.38Å; I536-L725 HydrophobicContact CG1-CD1 4.11Å; I536-L725 HydrophobicContact CG1-CG 4.43Å; L725-V727 HydrophobicContact CD2-CG2 3.62Å
726	L	91.4	Very high	75	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.6	176.6	-56.4	-178.2	0	0	0	109.5	I32 Q35 A534 L535 T537 L571 V724 Y728	I32-L726 HydrophobicContact CD1-CD1 4.19Å; I32-L726 HydrophobicContact CD1-CD2 4.41Å; I32-L726 HydrophobicContact CG2-CD2 4.49Å; Q35-L726 HydrophobicContact CB-CD2 3.97Å; Q35-L726 HydrophobicContact CG-CD2 3.73Å; A534-L726 CarbonylContact C-O 3.57Å; A534-L726 VanDerWaalsContact CA-O 3.3Å; A534-L726 WeakPolarHBondContact CA-O 3Å; L535-L726 HydrophobicContact CD1-CB 4.15Å; L535-L726 HydrophobicContact CD1-CD1 4.08Å; L535-L726 HydrophobicContact CD1-CG 4.36Å; L535-L726 HydrophobicContact CG-CB 4.3Å; L535-L726 PolarHBondContact N-O 3.45Å; L535-L726 PolarHBondContact O-N 3.49Å; T537-L726 HydrophobicContact CG2-CD1 3.76Å; T537-L726 HydrophobicContact CG2-CG 4.06Å; L571-L726 HydrophobicContact CD2-CD1 4.02Å; V724-L726 HydrophobicContact CG1-CD2 3.96Å; L726-Y728 HydrophobicContact CB-CD2 4.31Å; L726-Y728 HydrophobicContact CB-CE2 3.7Å; L726-Y728 HydrophobicContact CD1-CE2 4.19Å
727	V	90.9	Very high	77.1	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.2	172.5	-172.3	0	0	0	0	108.8	I32 I33 H34 W41 F51 R532 A534 L725	I32-V727 CarbonylContact C-O 3.54Å; I32-V727 WeakPolarHBondContact CA-O 3.46Å; I33-V727 HydrophobicContact CD1-CG1 3.84Å; I33-V727 HydrophobicContact CG1-CB 4Å; I33-V727 HydrophobicContact CG1-CG1 3.76Å; I33-V727 WeakPolarHBondContact CG1-O 3.35Å; I33-V727 PolarHBondContact N-O 2.82Å; H34-V727 HydrophobicContact CB-CB 3.96Å; H34-V727 HydrophobicContact CB-CG2 3.98Å; H34-V727 PolarHBondContact N-O 3.44Å; H34-V727 PolarHBondContact O-N 3.07Å; W41-V727 HydrophobicContact CH2-CG2 3.93Å; W41-V727 HydrophobicContact CZ3-CG2 3.64Å; F51-V727 HydrophobicContact CE2-CG1 4.16Å; F51-V727 HydrophobicContact CZ-CG1 4.26Å; R532-V727 HydrophobicContact CB-CG1 4.21Å; A534-V727 HydrophobicContact CB-CG2 4.4Å; L725-V727 HydrophobicContact CD2-CG2 3.62Å
728	Y	89.7	Confident	78.5	Confident	13 Å²	13	50.5 Å²	50.5	5%	0.051	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.8	175.1	-68.6	-98.6	0	0	0	110.3	G30 R31 I32 L506 R532 I533 L535 L726	G30-Y728 WeakPolarHBondContact O-CD1 3.39Å; R31-Y728 WeakPolarHBondContact O-CA 3.37Å; I32-Y728 HydrophobicContact CD1-CE1 4.19Å; I32-Y728 HydrophobicContact CG1-CD1 3.92Å; I32-Y728 HydrophobicContact CG1-CE1 3.38Å; I32-Y728 HydrophobicContact CG1-CE2 4.11Å; I32-Y728 HydrophobicContact CG1-CG 4.49Å; I32-Y728 VanDerWaalsContact CG1-CZ 3.5Å; L506-Y728 HydrophobicContact CD1-CD1 4.19Å; L506-Y728 HydrophobicContact CD1-CD2 4.41Å; L506-Y728 HydrophobicContact CD1-CE1 4.22Å; L506-Y728 HydrophobicContact CD1-CE2 4.46Å; L506-Y728 HydrophobicContact CD1-CG 4.28Å; L506-Y728 HydrophobicContact CD2-CD1 4.32Å; L506-Y728 HydrophobicContact CD2-CE1 3.88Å; R532-Y728 VanDerWaalsContact CA-O 3.25Å; R532-Y728 WeakPolarHBondContact CA-O 3.45Å; I533-Y728 PolarHBondContact N-O 3.32Å; I533-Y728 PolarHBondContact O-N 3.35Å; L535-Y728 HydrophobicContact CD1-CE2 4.39Å; L535-Y728 HydrophobicContact CD2-CD2 3.91Å; L535-Y728 HydrophobicContact CD2-CE2 3.49Å; L535-Y728 VanDerWaalsContact CD2-CE2 3.49Å; L535-Y728 HydrophobicContact CG-CD2 4.3Å; L535-Y728 HydrophobicContact CG-CE2 3.88Å; L726-Y728 HydrophobicContact CB-CD2 4.31Å; L726-Y728 HydrophobicContact CB-CE2 3.7Å; L726-Y728 HydrophobicContact CD1-CE2 4.19Å
729	Q	88	Confident	79.5	Confident	30 Å²	30	49.5 Å²	49.5	14%	0.14	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	124.5	166.4	-179.7	65.9	37.8	0	0	109.1	V27 G30 R31 I33 S531	V27-Q729 HydrophobicContact CB-CG 4.3Å; V27-Q729 HydrophobicContact CG1-CB 3.41Å; V27-Q729 VanDerWaalsContact CG1-CB 3.41Å; V27-Q729 HydrophobicContact CG1-CG 3.42Å; V27-Q729 VanDerWaalsContact CG1-CG 3.42Å; G30-Q729 WeakPolarHBondContact CA-O 3.43Å; G30-Q729 PolarHBondContact N-O 3.19Å; R31-Q729 PolarHBondContact O-N 3.37Å; I33-Q729 HydrophobicContact CG2-CB 3.81Å; S531-Q729 PolarHBondContact O-NE2 3.44Å
730	L	84.4	Confident	80.3	Confident	3 Å²	3	48 Å²	48	2%	0.016	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-78.1	154.5	171.3	-68.2	173.6	0	0	0	110.4	F398 I494 G530 S531 I533	F398-L730 HydrophobicContact CE1-CD2 4.01Å; F398-L730 HydrophobicContact CZ-CD1 4.08Å; F398-L730 HydrophobicContact CZ-CD2 3.87Å; I494-L730 HydrophobicContact CD1-CD2 4.37Å; G530-L730 WeakPolarHBondContact O-CD1 3.42Å; S531-L730 WeakPolarHBondContact O-CB 3.43Å; S531-L730 PolarHBondContact O-N 2.93Å; I533-L730 HydrophobicContact CB-CD1 4.19Å; I533-L730 HydrophobicContact CB-CD2 4.25Å; I533-L730 HydrophobicContact CB-CG 4.22Å; I533-L730 HydrophobicContact CG2-CD2 3.74Å; I533-L730 HydrophobicContact CG2-CG 4.06Å
731	P	76.4	Confident	80.3	Confident	38 Å²	38	47.3 Å²	47.3	25%	0.247	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-55.4	141.3	171.2	-13.3	25.1	0	0	0	109.8	P29 F396	P29-P731 HydrophobicContact CB-CB 3.92Å; P29-P731 HydrophobicContact CB-CG 4.04Å; P29-P731 HydrophobicContact CG-CB 4.31Å; F396-P731 HydrophobicContact CE1-CB 4.34Å; F396-P731 HydrophobicContact CE1-CG 4.1Å; F396-P731 HydrophobicContact CE2-CB 4.41Å; F396-P731 HydrophobicContact CE2-CG 4.42Å; F396-P731 WeakPolarHBondContact CE2-O 3.24Å; F396-P731 HydrophobicContact CZ-CB 3.69Å; F396-P731 HydrophobicContact CZ-CG 3.79Å
732	P	71.2	Confident	79.9	Confident	86 Å²	86	48 Å²	48	56%	0.558	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-60.8	144.4	-179.6	26.6	-33.9	0	0	0	109.5
733	P	66.9	Low	79.5	Confident	61 Å²	61	53 Å²	53	40%	0.396	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-58	151.3	172.2	22.7	-31.1	0	0	0	110.2	D393 Y395 K735	D393-P733 WeakPolarHBondContact OD2-CB 3.43Å; Y395-P733 HydrophobicContact CD2-CB 4.1Å; Y395-P733 HydrophobicContact CE2-CB 4.31Å; P733-K735 PolarHBondContact O-N 3.39Å
734	P	69.7	Low	79	Confident	42 Å²	42	53.4 Å²	53.4	27%	0.273	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-50.3	135.3	170.1	22	-34.6	0	0	0	110.7	Y395 A738 L739	Y395-P734 HydrophobicContact CD1-CG 3.55Å; Y395-P734 HydrophobicContact CD2-CG 4.04Å; Y395-P734 HydrophobicContact CE1-CG 3.45Å; Y395-P734 VanDerWaalsContact CE1-CG 3.45Å; Y395-P734 HydrophobicContact CE2-CG 3.97Å; Y395-P734 HydrophobicContact CG-CG 3.89Å; P734-A738 HydrophobicContact CB-CB 3.83Å; P734-L739 HydrophobicContact CB-CD2 3.98Å; P734-L739 HydrophobicContact CB-CG 4.32Å; P734-L739 HydrophobicContact CG-CD2 3.53Å; P734-L739 HydrophobicContact CG-CG 4.21Å
735	K	75.9	Confident	78.2	Confident	158 Å²	158	56.9 Å²	56.9	69%	0.687	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-60.1	156.6	175.4	-66.3	-177.5	179.3	178.9	0	109.8	P733 Q737 A738 L739	P733-K735 PolarHBondContact O-N 3.39Å; K735-Q737 PolarHBondContact O-N 2.66Å; K735-Q737 VanDerWaalsContact O-N 3.09Å; K735-A738 WeakPolarHBondContact O-CA 3.4Å; K735-A738 WeakPolarHBondContact O-CB 3.24Å; K735-A738 PolarHBondContact O-N 3.5Å; K735-L739 PolarHBondContact O-N 3.11Å
736	L	76	Confident	77.1	Confident	131 Å²	131	61.6 Å²	61.6	69%	0.686	31%	0.311	S	S	*	.	H	α-helix	trans	-49.7	-40.3	175.6	179.5	64.1	0	0	0	112	A738 L739 V740	L736-A738 VanDerWaalsContact C-N 3.33Å; L736-A738 PolarHBondContact O-N 3.48Å; L736-L739 WeakPolarHBondContact O-CB 3.42Å; L736-L739 PolarHBondContact O-N 3.46Å; L736-V740 HydrophobicContact CD1-CG2 4.12Å; L736-V740 HydrophobicContact CG-CG2 4.23Å; L736-V740 WeakPolarHBondContact O-CB 3.4Å; L736-V740 VanDerWaalsContact O-CG2 3.31Å; L736-V740 WeakPolarHBondContact O-CG2 3.45Å; L736-V740 PolarHBondContact O-N 3.37Å
737	Q	78.3	Confident	76.4	Confident	129 Å²	129	67.8 Å²	67.8	60%	0.603	34%	0.343	S	S	*	.	H	α-helix	trans	-57.5	-43.9	174.4	-65.6	173.6	-24	0	0	112.3	K735 L739 R741 Y765	K735-Q737 PolarHBondContact O-N 2.66Å; K735-Q737 VanDerWaalsContact O-N 3.09Å; Q737-L739 VanDerWaalsContact C-N 3.32Å; Q737-L739 PolarHBondContact O-N 2.97Å; Q737-R741 VanDerWaalsContact O-CB 3.22Å; Q737-R741 WeakPolarHBondContact O-CB 3.2Å; Q737-R741 PolarHBondContact O-N 3.47Å; Q737-Y765 HydrophobicContact CB-CE1 4.17Å; Q737-Y765 VanDerWaalsContact CB-OH 3.25Å; Q737-Y765 WeakPolarHBondContact CB-OH 3.48Å; Q737-Y765 PolarHBondContact O-OH 3.15Å
738	A	72.6	Confident	75.7	Confident	32 Å²	32	68.7 Å²	68.7	26%	0.264	35%	0.349	S	S	.	.	H	α-helix	trans	-68.4	-34.1	178.4	0	0	0	0	0	111.5	P734 K735 L736 Q742 Y765	P734-A738 HydrophobicContact CB-CB 3.83Å; K735-A738 WeakPolarHBondContact O-CA 3.4Å; K735-A738 WeakPolarHBondContact O-CB 3.24Å; K735-A738 PolarHBondContact O-N 3.5Å; L736-A738 VanDerWaalsContact C-N 3.33Å; L736-A738 PolarHBondContact O-N 3.48Å; A738-Q742 WeakPolarHBondContact O-CB 3.41Å; A738-Q742 PolarHBondContact O-N 3.48Å; A738-Y765 WeakPolarHBondContact CA-OH 3.26Å; A738-Y765 PolarHBondContact N-OH 3.48Å
739	L	72.4	Confident	75.1	Confident	48 Å²	48	75 Å²	75	25%	0.251	38%	0.377	S	S	.	.	H	α-helix	trans	-68.1	-49.1	174.3	-64.6	-179.1	0	0	0	112.9	Y395 P734 K735 L736 Q737 R741 Q742 R743	Y395-L739 HydrophobicContact CE1-CD2 3.51Å; Y395-L739 VanDerWaalsContact CZ-CD2 3.44Å; Y395-L739 WeakPolarHBondContact OH-CD1 3.19Å; Y395-L739 WeakPolarHBondContact OH-CD2 3.28Å; P734-L739 HydrophobicContact CB-CD2 3.98Å; P734-L739 HydrophobicContact CB-CG 4.32Å; P734-L739 HydrophobicContact CG-CD2 3.53Å; P734-L739 HydrophobicContact CG-CG 4.21Å; K735-L739 PolarHBondContact O-N 3.11Å; L736-L739 WeakPolarHBondContact O-CB 3.42Å; L736-L739 PolarHBondContact O-N 3.46Å; Q737-L739 VanDerWaalsContact C-N 3.32Å; Q737-L739 PolarHBondContact O-N 2.97Å; L739-R741 VanDerWaalsContact C-N 3.25Å; L739-R741 PolarHBondContact O-N 3.45Å; L739-Q742 PolarHBondContact O-N 2.94Å; L739-R743 WeakPolarHBondContact O-CB 3.27Å; L739-R743 PolarHBondContact O-N 2.74Å
740	V	77.2	Confident	74.4	Confident	72 Å²	72	77.3 Å²	77.3	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-58.2	-44.7	175.5	169.6	0	0	0	0	109.3	L736 R743 I744	L736-V740 HydrophobicContact CD1-CG2 4.12Å; L736-V740 HydrophobicContact CG-CG2 4.23Å; L736-V740 WeakPolarHBondContact O-CB 3.4Å; L736-V740 VanDerWaalsContact O-CG2 3.31Å; L736-V740 WeakPolarHBondContact O-CG2 3.45Å; L736-V740 PolarHBondContact O-N 3.37Å; V740-R743 PolarHBondContact O-N 2.93Å; V740-I744 HydrophobicContact CG1-CD1 3.66Å; V740-I744 HydrophobicContact CG1-CG1 4.37Å; V740-I744 VanDerWaalsContact O-CG1 3.26Å; V740-I744 WeakPolarHBondContact O-CG1 3.17Å; V740-I744 PolarHBondContact O-N 2.77Å
741	R	78.3	Confident	74.2	Confident	25 Å²	25	84.2 Å²	84.2	9%	0.094	42%	0.422	C	S	.	.	H	α-helix	trans	-58.1	-50.5	174.3	169.8	174	179.1	-138	-6.3	112.9	Q737 L739 R743 I744 R745 Y765 L766 F768	Q737-R741 VanDerWaalsContact O-CB 3.22Å; Q737-R741 WeakPolarHBondContact O-CB 3.2Å; Q737-R741 PolarHBondContact O-N 3.47Å; L739-R741 VanDerWaalsContact C-N 3.25Å; L739-R741 PolarHBondContact O-N 3.45Å; R741-R743 PolarHBondContact O-N 2.97Å; R741-I744 PolarHBondContact O-N 3.11Å; R741-R745 PolarHBondContact O-N 3.1Å; R741-Y765 HydrophobicContact CB-CD1 4.44Å; R741-Y765 HydrophobicContact CB-CE1 3.75Å; R741-Y765 WeakPolarHBondContact CD-O 3.34Å; R741-Y765 HydrophobicContact CG-CE1 4.37Å; R741-Y765 VanDerWaalsContact CZ-O 3.3Å; R741-Y765 PolarHBondContact NE-O 3.27Å; R741-L766 HydrophobicContact CB-CD2 3.98Å; R741-L766 HydrophobicContact CG-CD2 3.87Å; R741-L766 VanDerWaalsContact CZ-O 3.29Å; R741-L766 PolarHBondContact NE-O 3.44Å; R741-L766 PolarHBondContact NH2-O 3.23Å; R741-F768 PolarHBondContact NH1-O 3.49Å; R741-F768 PolarHBondContact NH2-O 3.21Å
742	Q	70.1	Confident	74.4	Confident	61 Å²	61	87.8 Å²	87.8	29%	0.285	43%	0.432	S	S	.	.	H	α-helix	trans	-59.9	-40.8	179	-173.3	179.3	-2.5	0	0	110.5	D498 A738 L739 R745 Q746	D498-Q742 PolarHBondContact OD2-NE2 3.29Å; A738-Q742 WeakPolarHBondContact O-CB 3.41Å; A738-Q742 PolarHBondContact O-N 3.48Å; L739-Q742 PolarHBondContact O-N 2.94Å; Q742-R745 PolarHBondContact O-N 3.44Å; Q742-Q746 VanDerWaalsContact O-CG 3.29Å; Q742-Q746 WeakPolarHBondContact O-CG 3.19Å; Q742-Q746 PolarHBondContact O-N 3.24Å
743	R	73.3	Confident	74.8	Confident	139 Å²	139	83.7 Å²	83.7	53%	0.525	41%	0.405	S	S	.	.	H	α-helix	trans	-65.7	-40.8	177.1	-171.1	58.2	175.1	175.8	1.6	112.4	L739 V740 R741 Q746 L747	L739-R743 WeakPolarHBondContact O-CB 3.27Å; L739-R743 PolarHBondContact O-N 2.74Å; V740-R743 PolarHBondContact O-N 2.93Å; R741-R743 PolarHBondContact O-N 2.97Å; R743-Q746 PolarHBondContact O-N 2.78Å; R743-L747 HydrophobicContact CG-CD1 4.29Å; R743-L747 WeakPolarHBondContact O-CG 3.29Å; R743-L747 PolarHBondContact O-N 3.45Å
744	I	76.6	Confident	75.3	Confident	51 Å²	51	87.6 Å²	87.6	26%	0.262	42%	0.418	S	S	.	.	H	α-helix	trans	-63.3	-49.1	175.2	-69.7	165.4	0	0	0	110.1	V740 R741 Q746 L747 C748 L753 L766	V740-I744 HydrophobicContact CG1-CD1 3.66Å; V740-I744 HydrophobicContact CG1-CG1 4.37Å; V740-I744 VanDerWaalsContact O-CG1 3.26Å; V740-I744 WeakPolarHBondContact O-CG1 3.17Å; V740-I744 PolarHBondContact O-N 2.77Å; R741-I744 PolarHBondContact O-N 3.11Å; I744-Q746 PolarHBondContact O-N 3.47Å; I744-L747 PolarHBondContact O-N 3.3Å; I744-C748 HydrophobicContact CG2-CB 4.42Å; I744-C748 WeakPolarHBondContact O-CB 3.13Å; I744-C748 PolarHBondContact O-N 3Å; I744-L753 HydrophobicContact CG2-CD2 4.12Å; I744-L766 HydrophobicContact CB-CD2 4.09Å; I744-L766 HydrophobicContact CD1-CD2 3.93Å; I744-L766 HydrophobicContact CG2-CD1 4.03Å; I744-L766 HydrophobicContact CG2-CD2 3.99Å
745	R	72.1	Confident	75.8	Confident	75 Å²	75	92.1 Å²	92.1	28%	0.283	44%	0.435	S	S	.	.	H	α-helix	trans	-62.5	-26.7	177.9	-71.3	-167.4	81.2	-171.8	1.9	113.6	R741 Q742 D750 L766 E769	R741-R745 PolarHBondContact O-N 3.1Å; Q742-R745 PolarHBondContact O-N 3.44Å; R745-D750 IonicContact CZ-OD1 3.47Å; R745-D750 IonicContact CZ-OD2 3.99Å; R745-D750 IonicContact NE-OD1 3.9Å; R745-D750 PolarHBondContact NE-OD1 3.36Å; R745-D750 IonicContact NH2-OD1 3.16Å; R745-D750 PolarHBondContact NH2-OD1 2.59Å; R745-D750 IonicContact NH2-OD2 2.83Å; R745-D750 PolarHBondContact NH2-OD2 3.22Å; R745-L766 WeakPolarHBondContact CD-O 3.36Å; R745-E769 IonicContact CZ-OE1 2.82Å; R745-E769 IonicContact NH1-OE1 2.79Å; R745-E769 PolarHBondContact NH1-OE1 3.07Å; R745-E769 IonicContact NH2-OE1 3.87Å; R745-E769 PolarHBondContact NH2-OE1 3.2Å
746	Q	68.2	Low	75.8	Confident	100 Å²	100	88 Å²	88	47%	0.467	42%	0.421	S	S	.	.	H	α-helix	trans	-73	-27.7	173.6	-77.6	173.9	-4.3	0	0	113.2	Q742 R743 I744	Q742-Q746 VanDerWaalsContact O-CG 3.29Å; Q742-Q746 WeakPolarHBondContact O-CG 3.19Å; Q742-Q746 PolarHBondContact O-N 3.24Å; R743-Q746 PolarHBondContact O-N 2.78Å; I744-Q746 PolarHBondContact O-N 3.47Å
747	L	75.3	Confident	76.1	Confident	129 Å²	129	89.5 Å²	89.5	68%	0.675	43%	0.429	S	S	*	.	H	α-helix	trans	-99.9	-29.9	-175.8	-66.1	173.2	0	0	0	112.6	R743 I744	R743-L747 HydrophobicContact CG-CD1 4.29Å; R743-L747 WeakPolarHBondContact O-CG 3.29Å; R743-L747 PolarHBondContact O-N 3.45Å; I744-L747 PolarHBondContact O-N 3.3Å
748	C	77.6	Confident	76.5	Confident	20 Å²	20	86.3 Å²	86.3	14%	0.135	42%	0.416	C	S	.	.	S	Bend	trans	-118.5	118.5	-176.5	-170.3	0	0	0	0	108.7	I744 Y752 L753	I744-C748 HydrophobicContact CG2-CB 4.42Å; I744-C748 WeakPolarHBondContact O-CB 3.13Å; I744-C748 PolarHBondContact O-N 3Å; C748-Y752 VanDerWaalsContact SG-CB 3.55Å; C748-L753 HydrophobicContact CB-CD2 4.27Å
749	K	76.4	Confident	77.2	Confident	146 Å²	146	88.7 Å²	88.7	64%	0.635	43%	0.429	S	S	*	.			trans	-64.2	152.2	174	-55.8	-175.2	179	178.1	0	109.6	E751 Y752 L753	K749-E751 PolarHBondContact O-N 2.91Å; K749-E751 VanDerWaalsContact O-N 3.09Å; K749-Y752 HydrophobicContact CB-CD2 3.88Å; K749-Y752 HydrophobicContact CB-CE2 4.28Å; K749-Y752 HydrophobicContact CD-CE2 4.24Å; K749-Y752 HydrophobicContact CG-CD2 4.39Å; K749-Y752 HydrophobicContact CG-CE2 4.44Å; K749-Y752 PolarHBondContact O-N 2.96Å; K749-L753 PolarHBondContact O-N 3.29Å
750	D	73.6	Confident	77.9	Confident	78 Å²	78	96.9 Å²	96.9	42%	0.417	46%	0.457	S	S	.	.	H	α-helix	trans	-57	-30.7	-175.6	-69.6	-25.6	0	0	0	112.8	R745 Y752 L753	R745-D750 IonicContact CZ-OD1 3.47Å; R745-D750 IonicContact CZ-OD2 3.99Å; R745-D750 IonicContact NE-OD1 3.9Å; R745-D750 PolarHBondContact NE-OD1 3.36Å; R745-D750 IonicContact NH2-OD1 3.16Å; R745-D750 PolarHBondContact NH2-OD1 2.59Å; R745-D750 IonicContact NH2-OD2 2.83Å; R745-D750 PolarHBondContact NH2-OD2 3.22Å; D750-Y752 VanDerWaalsContact C-N 3.32Å; D750-Y752 PolarHBondContact O-N 3.49Å; D750-L753 HydrophobicContact CB-CD1 4.34Å; D750-L753 WeakPolarHBondContact O-CB 3.36Å; D750-L753 PolarHBondContact O-N 3.19Å; D750-L753 WeakPolarHBondContact OD1-CD1 3.36Å
751	E	79.7	Confident	78.2	Confident	147 Å²	147	104 Å²	104	69%	0.687	48%	0.476	S	S	*	.	H	α-helix	trans	-61.3	-33.9	174.9	-64.8	168.5	-171.7	0	0	113.9	K749	K749-E751 PolarHBondContact O-N 2.91Å; K749-E751 VanDerWaalsContact O-N 3.09Å
752	Y	81.2	Confident	78.6	Confident	114 Å²	114	106.4 Å²	106.4	45%	0.447	49%	0.489	S	S	.	.	H	α-helix	trans	-88.1	-10.5	-178.7	-62.4	-72.5	0	0	0	112.3	C748 K749 D750 E754 Q755 L756	C748-Y752 VanDerWaalsContact SG-CB 3.55Å; K749-Y752 HydrophobicContact CB-CD2 3.88Å; K749-Y752 HydrophobicContact CB-CE2 4.28Å; K749-Y752 HydrophobicContact CD-CE2 4.24Å; K749-Y752 HydrophobicContact CG-CD2 4.39Å; K749-Y752 HydrophobicContact CG-CE2 4.44Å; K749-Y752 PolarHBondContact O-N 2.96Å; D750-Y752 VanDerWaalsContact C-N 3.32Å; D750-Y752 PolarHBondContact O-N 3.49Å; Y752-E754 VanDerWaalsContact C-N 3.27Å; Y752-E754 PolarHBondContact O-N 3Å; Y752-Q755 WeakPolarHBondContact O-CB 3.43Å; Y752-Q755 PolarHBondContact O-N 3.05Å; Y752-L756 PolarHBondContact O-N 2.99Å
753	L	79	Confident	79.3	Confident	0 Å²	0	104.6 Å²	104.6	0%	0	48%	0.481	C	S	.	.	H	α-helix	trans	-62.7	-34.9	-178	-71.2	177.5	0	0	0	112.4	I744 C748 K749 D750 Q755 L756 L766 Q767	I744-L753 HydrophobicContact CG2-CD2 4.12Å; C748-L753 HydrophobicContact CB-CD2 4.27Å; K749-L753 PolarHBondContact O-N 3.29Å; D750-L753 HydrophobicContact CB-CD1 4.34Å; D750-L753 WeakPolarHBondContact O-CB 3.36Å; D750-L753 PolarHBondContact O-N 3.19Å; D750-L753 WeakPolarHBondContact OD1-CD1 3.36Å; L753-Q755 PolarHBondContact O-N 3.32Å; L753-L756 HydrophobicContact CD2-CD1 3.77Å; L753-L756 PolarHBondContact O-N 2.87Å; L753-L766 HydrophobicContact CD1-CB 4.29Å; L753-L766 HydrophobicContact CD2-CB 4.42Å; L753-L766 HydrophobicContact CD2-CD1 3.98Å; L753-Q767 HydrophobicContact CD1-CG 4.26Å
754	E	77.3	Confident	79.8	Confident	143 Å²	143	101.3 Å²	101.3	67%	0.668	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.4	176.9	-62.8	-162.7	168.7	0	0	112.8	Y752	Y752-E754 VanDerWaalsContact C-N 3.27Å; Y752-E754 PolarHBondContact O-N 3Å
755	Q	80.6	Confident	80.1	Confident	136 Å²	136	102.8 Å²	102.8	64%	0.636	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-5	179	-59.7	178.1	3.3	0	0	113.2	Y752 L753 D757	Y752-Q755 WeakPolarHBondContact O-CB 3.43Å; Y752-Q755 PolarHBondContact O-N 3.05Å; L753-Q755 PolarHBondContact O-N 3.32Å; Q755-D757 PolarHBondContact O-N 3.49Å; Q755-D757 VanDerWaalsContact O-N 3.11Å
756	L	76.2	Confident	80.6	Confident	72 Å²	72	99.3 Å²	99.3	38%	0.377	47%	0.47	S	S	.	.	S	Bend	trans	-75	6.7	-173.2	-70.2	176.8	0	0	0	114.9	Y752 L753 L758	Y752-L756 PolarHBondContact O-N 2.99Å; L753-L756 HydrophobicContact CD2-CD1 3.77Å; L753-L756 PolarHBondContact O-N 2.87Å; L756-L758 HydrophobicContact CB-CD1 3.77Å; L756-L758 HydrophobicContact CB-CG 3.77Å; L756-L758 HydrophobicContact CD1-CD1 3.9Å; L756-L758 WeakPolarHBondContact O-CG 3.43Å; L756-L758 PolarHBondContact O-N 2.97Å
757	D	83	Confident	81.2	Confident	163 Å²	163	98.3 Å²	98.3	87%	0.872	47%	0.465	S	S	*	.			trans	46.2	32.8	-173.9	-75.8	-18.8	0	0	0	113.5	Q755	Q755-D757 PolarHBondContact O-N 3.49Å; Q755-D757 VanDerWaalsContact O-N 3.11Å
758	L	84.7	Confident	81.2	Confident	61 Å²	61	98 Å²	98	32%	0.319	46%	0.459	S	S	.	.			trans	-91	147.3	179.8	-66.7	174.8	0	0	0	111	L756 R760 I762 I763 L766	L756-L758 HydrophobicContact CB-CD1 3.77Å; L756-L758 HydrophobicContact CB-CG 3.77Å; L756-L758 HydrophobicContact CD1-CD1 3.9Å; L756-L758 WeakPolarHBondContact O-CG 3.43Å; L756-L758 PolarHBondContact O-N 2.97Å; L758-R760 PolarHBondContact O-N 3.31Å; L758-I762 HydrophobicContact CB-CB 4.42Å; L758-I762 HydrophobicContact CB-CG2 4.31Å; L758-I762 HydrophobicContact CD1-CG2 3.98Å; L758-I763 HydrophobicContact CB-CG1 4.04Å; L758-I763 WeakPolarHBondContact O-CD1 3.31Å; L758-L766 HydrophobicContact CD1-CD1 3.91Å
759	P	89.2	Confident	80.3	Confident	82 Å²	82	103.2 Å²	103.2	53%	0.532	48%	0.481	S	S	.	.			trans	-48.4	134.6	170.5	-28.6	32.6	0	0	0	112.3	R761 I762 I763	P759-R761 PolarHBondContact O-N 3.32Å; P759-I762 HydrophobicContact CB-CD1 4.38Å; P759-I762 HydrophobicContact CB-CG1 4.37Å; P759-I762 HydrophobicContact CG-CD1 4.11Å; P759-I762 WeakPolarHBondContact O-CA 3.33Å; P759-I762 WeakPolarHBondContact O-CB 3.46Å; P759-I762 PolarHBondContact O-N 3Å; P759-I763 PolarHBondContact O-N 3.02Å; P759-I763 VanDerWaalsContact O-N 3.15Å
760	R	85.3	Confident	79.1	Confident	221 Å²	221	98.8 Å²	98.8	83%	0.834	47%	0.467	S	S	*	.	H	α-helix	trans	-49.4	-34	-177.3	-71.2	-176.6	179.2	173.1	0.1	114	L758 I762 I763 S764	L758-R760 PolarHBondContact O-N 3.31Å; R760-I762 VanDerWaalsContact C-N 3.34Å; R760-I763 PolarHBondContact O-N 3.44Å; R760-S764 WeakPolarHBondContact O-CB 3.42Å; R760-S764 PolarHBondContact O-N 3.38Å; R760-S764 PolarHBondContact O-OG 3.3Å
761	R	85.3	Confident	77.2	Confident	222 Å²	222	99.4 Å²	99.4	84%	0.838	48%	0.477	S	S	*	.	H	α-helix	trans	-65.8	-35.1	176.8	-167.2	177.1	-176.1	175.9	2.8	112.6	P759 Y765	P759-R761 PolarHBondContact O-N 3.32Å; R761-Y765 WeakPolarHBondContact O-CB 3.29Å; R761-Y765 PolarHBondContact O-N 3.25Å
762	I	85.1	Confident	75	Confident	74 Å²	74	100.1 Å²	100.1	38%	0.379	48%	0.475	S	S	.	.	H	α-helix	trans	-72.6	-43.8	174.2	-63.8	180	0	0	0	109.8	L758 P759 R760 S764 Y765 L766	L758-I762 HydrophobicContact CB-CB 4.42Å; L758-I762 HydrophobicContact CB-CG2 4.31Å; L758-I762 HydrophobicContact CD1-CG2 3.98Å; P759-I762 HydrophobicContact CB-CD1 4.38Å; P759-I762 HydrophobicContact CB-CG1 4.37Å; P759-I762 HydrophobicContact CG-CD1 4.11Å; P759-I762 WeakPolarHBondContact O-CA 3.33Å; P759-I762 WeakPolarHBondContact O-CB 3.46Å; P759-I762 PolarHBondContact O-N 3Å; R760-I762 VanDerWaalsContact C-N 3.34Å; I762-S764 VanDerWaalsContact C-N 3.34Å; I762-S764 PolarHBondContact O-N 2.8Å; I762-Y765 CarbonylContact O-C 3.53Å; I762-Y765 WeakPolarHBondContact O-CA 3.46Å; I762-Y765 WeakPolarHBondContact O-CB 3.25Å; I762-Y765 PolarHBondContact O-N 3.02Å; I762-Y765 VanDerWaalsContact O-N 3.11Å; I762-L766 HydrophobicContact CG2-CD1 4.06Å; I762-L766 HydrophobicContact CG2-CG 4.27Å; I762-L766 VanDerWaalsContact O-CG 3.3Å; I762-L766 WeakPolarHBondContact O-CG 3.12Å; I762-L766 PolarHBondContact O-N 3.39Å
763	I	85	Confident	72.6	Confident	23 Å²	23	100.5 Å²	100.5	12%	0.118	49%	0.485	C	S	.	.	H	α-helix	trans	-57.9	-48.6	174.6	-62.5	174.7	0	0	0	110.4	L758 P759 R760 Y765 L766 Q767	L758-I763 HydrophobicContact CB-CG1 4.04Å; L758-I763 WeakPolarHBondContact O-CD1 3.31Å; P759-I763 PolarHBondContact O-N 3.02Å; P759-I763 VanDerWaalsContact O-N 3.15Å; R760-I763 PolarHBondContact O-N 3.44Å; I763-Y765 VanDerWaalsContact C-N 3.28Å; I763-Y765 PolarHBondContact O-N 3.4Å; I763-L766 PolarHBondContact O-N 3.49Å; I763-L766 VanDerWaalsContact O-N 3.08Å; I763-Q767 HydrophobicContact CG2-CG 4.35Å; I763-Q767 WeakPolarHBondContact O-CB 3.36Å; I763-Q767 WeakPolarHBondContact O-CG 3.37Å; I763-Q767 PolarHBondContact O-N 2.97Å
764	S	84	Confident	70.2	Confident	71 Å²	71	103.7 Å²	103.7	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-58.4	-40.8	175.5	-57.1	0	0	0	0	111.8	R760 I762 Q767 F768	R760-S764 WeakPolarHBondContact O-CB 3.42Å; R760-S764 PolarHBondContact O-N 3.38Å; R760-S764 PolarHBondContact O-OG 3.3Å; I762-S764 VanDerWaalsContact C-N 3.34Å; I762-S764 PolarHBondContact O-N 2.8Å; S764-Q767 PolarHBondContact O-N 2.8Å; S764-F768 VanDerWaalsContact O-CB 3.31Å; S764-F768 WeakPolarHBondContact O-CB 3.29Å; S764-F768 PolarHBondContact O-N 2.88Å
765	Y	83.7	Confident	68.1	Low	81 Å²	81	101.6 Å²	101.6	32%	0.318	51%	0.513	S	S	.	.	H	α-helix	trans	-64.8	-41.7	175.4	177.3	-108.2	0	0	0	112.3	Q737 A738 R741 R761 I762 I763 F768	Q737-Y765 HydrophobicContact CB-CE1 4.17Å; Q737-Y765 VanDerWaalsContact CB-OH 3.25Å; Q737-Y765 WeakPolarHBondContact CB-OH 3.48Å; Q737-Y765 PolarHBondContact O-OH 3.15Å; A738-Y765 WeakPolarHBondContact CA-OH 3.26Å; A738-Y765 PolarHBondContact N-OH 3.48Å; R741-Y765 HydrophobicContact CB-CD1 4.44Å; R741-Y765 HydrophobicContact CB-CE1 3.75Å; R741-Y765 WeakPolarHBondContact CD-O 3.34Å; R741-Y765 HydrophobicContact CG-CE1 4.37Å; R741-Y765 VanDerWaalsContact CZ-O 3.3Å; R741-Y765 PolarHBondContact NE-O 3.27Å; R761-Y765 WeakPolarHBondContact O-CB 3.29Å; R761-Y765 PolarHBondContact O-N 3.25Å; I762-Y765 CarbonylContact O-C 3.53Å; I762-Y765 WeakPolarHBondContact O-CA 3.46Å; I762-Y765 WeakPolarHBondContact O-CB 3.25Å; I762-Y765 PolarHBondContact O-N 3.02Å; I762-Y765 VanDerWaalsContact O-N 3.11Å; I763-Y765 VanDerWaalsContact C-N 3.28Å; I763-Y765 PolarHBondContact O-N 3.4Å; Y765-F768 PolarHBondContact O-N 3.26Å
766	L	83.2	Confident	65.6	Low	3 Å²	3	98.1 Å²	98.1	2%	0.016	51%	0.514	C	S	.	.	H	α-helix	trans	-65.3	-39.5	176.9	-67.5	173.8	0	0	0	111.2	R741 I744 R745 L753 L758 I762 I763	R741-L766 HydrophobicContact CB-CD2 3.98Å; R741-L766 HydrophobicContact CG-CD2 3.87Å; R741-L766 VanDerWaalsContact CZ-O 3.29Å; R741-L766 PolarHBondContact NE-O 3.44Å; R741-L766 PolarHBondContact NH2-O 3.23Å; I744-L766 HydrophobicContact CB-CD2 4.09Å; I744-L766 HydrophobicContact CD1-CD2 3.93Å; I744-L766 HydrophobicContact CG2-CD1 4.03Å; I744-L766 HydrophobicContact CG2-CD2 3.99Å; R745-L766 WeakPolarHBondContact CD-O 3.36Å; L753-L766 HydrophobicContact CD1-CB 4.29Å; L753-L766 HydrophobicContact CD2-CB 4.42Å; L753-L766 HydrophobicContact CD2-CD1 3.98Å; L758-L766 HydrophobicContact CD1-CD1 3.91Å; I762-L766 HydrophobicContact CG2-CD1 4.06Å; I762-L766 HydrophobicContact CG2-CG 4.27Å; I762-L766 VanDerWaalsContact O-CG 3.3Å; I762-L766 WeakPolarHBondContact O-CG 3.12Å; I762-L766 PolarHBondContact O-N 3.39Å; I763-L766 PolarHBondContact O-N 3.49Å; I763-L766 VanDerWaalsContact O-N 3.08Å
767	Q	79.6	Confident	63.3	Low	78 Å²	78	100.6 Å²	100.6	36%	0.364	54%	0.538	S	S	.	.	H	α-helix	trans	-76.8	-21.7	177.3	-69.5	173.3	-18.1	0	0	113.9	L753 I763 S764 E769	L753-Q767 HydrophobicContact CD1-CG 4.26Å; I763-Q767 HydrophobicContact CG2-CG 4.35Å; I763-Q767 WeakPolarHBondContact O-CB 3.36Å; I763-Q767 WeakPolarHBondContact O-CG 3.37Å; I763-Q767 PolarHBondContact O-N 2.97Å; S764-Q767 PolarHBondContact O-N 2.8Å; Q767-E769 PolarHBondContact O-N 3.4Å
768	F	75.5	Confident	60.7	Low	124 Å²	124	96.7 Å²	96.7	54%	0.544	52%	0.522	S	S	.	.			trans	-60.7	95	-172.7	172.5	-105.1	0	0	0	114.2	R741 S764 Y765 P770	R741-F768 PolarHBondContact NH1-O 3.49Å; R741-F768 PolarHBondContact NH2-O 3.21Å; S764-F768 VanDerWaalsContact O-CB 3.31Å; S764-F768 WeakPolarHBondContact O-CB 3.29Å; S764-F768 PolarHBondContact O-N 2.88Å; Y765-F768 PolarHBondContact O-N 3.26Å; F768-P770 HydrophobicContact CE1-CB 3.97Å; F768-P770 HydrophobicContact CZ-CB 4.49Å; F768-P770 WeakPolarHBondContact O-CD 3.48Å
769	E	59.5	Low	58.2	Low	128 Å²	128	102.3 Å²	102.3	60%	0.598	55%	0.55	S	S	*	*			trans	-76.8	115.3	174.8	-59.3	-154.5	141.4	0	0	110.6	R745 Q767 S771	R745-E769 IonicContact CZ-OE1 2.82Å; R745-E769 IonicContact NH1-OE1 2.79Å; R745-E769 PolarHBondContact NH1-OE1 3.07Å; R745-E769 IonicContact NH2-OE1 3.87Å; R745-E769 PolarHBondContact NH2-OE1 3.2Å; Q767-E769 PolarHBondContact O-N 3.4Å; E769-S771 PolarHBondContact O-N 3.07Å
770	P	50.7	Low	55.3	Low	53 Å²	53	103.4 Å²	103.4	34%	0.344	56%	0.56	S	S	.	*			trans	-67	103.6	173.9	27.3	-30.8	0	0	0	108.1	F768 Y772	F768-P770 HydrophobicContact CE1-CB 3.97Å; F768-P770 HydrophobicContact CZ-CB 4.49Å; F768-P770 WeakPolarHBondContact O-CD 3.48Å; P770-Y772 HydrophobicContact CB-CE2 4.3Å; P770-Y772 HydrophobicContact CG-CE2 3.95Å; P770-Y772 WeakPolarHBondContact O-CD2 3.48Å; P770-Y772 PolarHBondContact O-N 3.04Å; P770-Y772 VanDerWaalsContact O-N 3.12Å
771	S	33.2	Very low	52.5	Low	91 Å²	91	104.3 Å²	104.3	64%	0.636	56%	0.563	S	S	*	*			trans	-66.3	108	163.2	56.2	0	0	0	0	107.5	E769 N773	E769-S771 PolarHBondContact O-N 3.07Å; S771-N773 PolarHBondContact O-N 3.18Å
772	Y	34.7	Very low	49.9	Very low	162 Å²	162	99.5 Å²	99.5	64%	0.635	56%	0.564	S	S	*	*			trans	-73	39.6	176	-68.9	-80.8	0	0	0	112.5	P770 C774	P770-Y772 HydrophobicContact CB-CE2 4.3Å; P770-Y772 HydrophobicContact CG-CE2 3.95Å; P770-Y772 WeakPolarHBondContact O-CD2 3.48Å; P770-Y772 PolarHBondContact O-N 3.04Å; P770-Y772 VanDerWaalsContact O-N 3.12Å; Y772-C774 VanDerWaalsContact C-N 3.31Å; Y772-C774 PolarHBondContact O-N 3.24Å
773	N	30.8	Very low	47.1	Very low	123 Å²	123	103.5 Å²	103.5	66%	0.658	59%	0.586	S	S	*	*			trans	-87.9	18.3	-171.1	-70.7	7.1	0	0	0	114.1	S771	S771-N773 PolarHBondContact O-N 3.18Å
774	C	27.4	Very low	44.7	Very low	66 Å²	66	107.4 Å²	107.4	45%	0.446	62%	0.616	S	S	.	*			trans	-144.4	75.8	-175.9	-140.3	0	0	0	0	111.3	Y772 G776 C778	Y772-C774 VanDerWaalsContact C-N 3.31Å; Y772-C774 PolarHBondContact O-N 3.24Å; C774-G776 PolarHBondContact O-N 3.31Å; C774-C778 WeakPolarHBondContact CB-SG 3.36Å; C774-C778 WeakPolarHBondContact SG-CB 3.46Å; C774-C778 CovalentContact SG-SG 2.05Å; C774-C778 PolarHBondContact SG-SG 3.2Å
775	A	32.4	Very low	42.1	Very low	99 Å²	99	109.7 Å²	109.7	82%	0.818	63%	0.632	S	S	*	*	S	Bend	trans	-76.4	79.2	163	0	0	0	0	0	109.2
776	G	30	Very low	39.7	Very low	63 Å²	63	112.2 Å²	112.2	65%	0.649	66%	0.655	S	S	*	*	S	Bend	trans	102.7	119.4	172.9	0	0	0	0	0	113.4	C774	C774-G776 PolarHBondContact O-N 3.31Å
777	S	28	Very low	37	Very low	125 Å²	125	123.7 Å²	123.7	87%	0.874	70%	0.699	S	S	*	*	S	Bend	trans	83.7	55.2	173.1	-160.3	0	0	0	0	117.6
778	C	27.6	Very low	34.8	Very low	81 Å²	81	125.9 Å²	125.9	55%	0.547	72%	0.717	S	S	.	*			trans	-157	73.6	151.2	58.7	0	0	0	0	112.9	C774	C774-C778 WeakPolarHBondContact CB-SG 3.36Å; C774-C778 WeakPolarHBondContact SG-CB 3.46Å; C774-C778 CovalentContact SG-SG 2.05Å; C774-C778 PolarHBondContact SG-SG 3.2Å
779	I	31.2	Very low	32.9	Very low	178 Å²	178	126.3 Å²	126.3	91%	0.913	73%	0.73	S	S	*	*			trans	-110.7	67.8	146.7	-56.6	176.9	0	0	0	105.5
780	S	28.4	Very low	31.4	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	74%	0.743	S	S	*	*	S	Bend	trans	-133.8	105	167.9	-67.3	0	0	0	0	106.1	S782	S780-S782 PolarHBondContact O-N 3.21Å
781	R	27.1	Very low	30.8	Very low	240 Å²	240	134.4 Å²	134.4	91%	0.906	77%	0.766	S	S	*	*			trans	14	100.9	160.9	-65.5	176.7	168.5	-175.8	-4.7	115.9
782	S	31.4	Very low	30.9	Very low	121 Å²	121	137.1 Å²	137.1	85%	0.846	77%	0.773	S	S	*	*			trans	-89.5	102.5	155	28.7	0	0	0	0	108.9	S780 S784	S780-S782 PolarHBondContact O-N 3.21Å; S782-S784 PolarHBondContact O-N 3.14Å
783	N	26.7	Very low	30.9	Very low	159 Å²	159	133.7 Å²	133.7	85%	0.85	77%	0.773	S	S	*	*			trans	-64.8	113.5	160.8	-81.2	-15.7	0	0	0	108.2
784	S	34.1	Very low	31.1	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	78%	0.783	S	S	*	*			trans	-99.4	104.2	160	58.7	0	0	0	0	108.3	S782 T786	S782-S784 PolarHBondContact O-N 3.14Å; S784-T786 PolarHBondContact O-N 3.48Å
785	S	28.9	Very low	31.6	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	80%	0.799	S	S	*	*			trans	-57.7	120.5	164.9	47.8	0	0	0	0	110.8
786	T	33.6	Very low	32	Very low	133 Å²	133	148 Å²	148	82%	0.816	82%	0.822	S	S	*	*			trans	-131.9	120.7	161	7.9	0	0	0	0	108.7	S784	S784-T786 PolarHBondContact O-N 3.48Å
787	R	27	Very low	32.1	Very low	245 Å²	245	152.3 Å²	152.3	93%	0.925	83%	0.83	S	S	*	*			trans	-80.1	130.3	-179.8	-167.1	-177.3	-173	-171.2	2.4	108.6
788	T	32.7	Very low	32.3	Very low	124 Å²	124	153.7 Å²	153.7	76%	0.761	83%	0.828	S	S	*	*			trans	-169.2	104	157.1	11.4	0	0	0	0	107.9
789	V	34.8	Very low	32.6	Very low	133 Å²	133	157.8 Å²	157.8	81%	0.806	84%	0.843	S	S	*	*				87.8	121.3	97.1	171.7	0	0	0	0	112
790	R	29	Very low	32.7	Very low	232 Å²	232	156.6 Å²	156.6	88%	0.875	84%	0.839	S	S	*	*			trans	-29.9	135.7	175.5	-67.4	173.7	161.4	104.1	-1.6	116.1
791	S	37	Very low	32.9	Very low	118 Å²	118	159.8 Å²	159.8	83%	0.825	85%	0.846	S	S	*	*			trans	-139.5	127.3	140.5	48.1	0	0	0	0	107.3
792	D	35.7	Very low	33.3	Very low	148 Å²	148	154.5 Å²	154.5	79%	0.791	84%	0.842	S	S	*	*			trans	-59.9	154.8	-177.7	-62.8	-56.5	0	0	0	113.5
793	S	34.8	Very low	33.5	Very low	90 Å²	90	156.9 Å²	156.9	63%	0.629	84%	0.842	S	S	*	*			trans	61.6	106.4	147.5	178.6	0	0	0	0	118.4
794	F	35.1	Very low	34	Very low	199 Å²	199	156.7 Å²	156.7	87%	0.873	84%	0.841	S	S	*	*				-164.4	106.8	115.3	-99.8	-72.5	0	0	0	109.6
795	D	39.1	Very low	34	Very low	146 Å²	146	161 Å²	161	78%	0.781	85%	0.85	S	S	*	*			trans	9.1	111.6	163.5	-59.5	-36.9	0	0	0	121.7
796	L	40	Very low	34.4	Very low	245 Å²	245	164.8 Å²	164.8	100%	1.283	85%	0.851	S	S	*	*				178	0	109.4	-117.1	152.7	0	0	0	110.6

Retrieved 796 of 796 residues in 1531.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).