A0A087YJ91_POEFO Loading...

Integrin beta

AlphaFold DB , UniProt , Accession A0A087YJ91, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 797 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	47.2	Very low	241 Å²	241	137.5 Å²	137.5	100%	1.187	72%	0.72	S	S	*	*				0	83.7	0	-84.3	157.7	66.1	0	0	109.3
2	W	34.8	Very low	47.3	Very low	261 Å²	261	137.4 Å²	137.4	99%	0.989	72%	0.716	S	S	*	*			trans	-114	118.9	167.8	-87.5	37.2	0	0	0	106.2
3	S	40.2	Very low	47.4	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	70%	0.698	S	S	*	*			trans	-75	139.3	-165.2	-162.5	0	0	0	0	111.5	G5	S3-G5 PolarHBondContact O-N 3.15Å; S3-G5 VanDerWaalsContact O-N 3.1Å
4	P	48.4	Very low	47.1	Very low	117 Å²	117	131.6 Å²	131.6	76%	0.76	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-11.6	-177.5	-9.3	23.1	0	0	0	113.8	R6	P4-R6 VanDerWaalsContact C-N 3.34Å; P4-R6 PolarHBondContact O-N 2.54Å
5	G	47.8	Very low	46.5	Very low	43 Å²	43	130.4 Å²	130.4	44%	0.443	68%	0.676	S	S	.	*	H	α-helix	trans	-72.3	-17.6	-175.8	0	0	0	0	0	115.6	S3	S3-G5 PolarHBondContact O-N 3.15Å; S3-G5 VanDerWaalsContact O-N 3.1Å
6	R	48	Very low	46.2	Very low	218 Å²	218	127.7 Å²	127.7	82%	0.823	67%	0.667	S	S	*	*	H	α-helix	trans	-85.5	-28.6	-178.2	-77.4	-173.5	170.3	-167.9	-3.2	114	P4 C10	P4-R6 VanDerWaalsContact C-N 3.34Å; P4-R6 PolarHBondContact O-N 2.54Å; R6-C10 PolarHBondContact O-N 3.46Å; R6-C10 VanDerWaalsContact O-N 3.16Å
7	A	49.1	Very low	45.5	Very low	71 Å²	71	130.2 Å²	130.2	59%	0.587	67%	0.672	S	S	*	*	H	α-helix	trans	-74	-38.5	176.7	0	0	0	0	0	112	C10 W11	A7-C10 PolarHBondContact O-N 3.21Å; A7-W11 PolarHBondContact O-N 3.39Å
8	A	53.3	Low	44.7	Very low	61 Å²	61	130.6 Å²	130.6	50%	0.504	67%	0.674	S	S	.	*	H	α-helix	trans	-68.3	-36.1	176.7	0	0	0	0	0	112.7	M12	A8-M12 WeakPolarHBondContact O-CB 3.07Å; A8-M12 WeakPolarHBondContact O-CG 3.41Å; A8-M12 PolarHBondContact O-N 3.39Å
9	L	53.3	Low	44.1	Very low	115 Å²	115	134.7 Å²	134.7	60%	0.602	68%	0.68	S	S	*	*	H	α-helix	trans	-68.9	-38.1	173.3	-116.4	98	0	0	0	112	L13	L9-L13 HydrophobicContact CD2-CD1 4.45Å; L9-L13 VanDerWaalsContact O-CB 3.23Å; L9-L13 WeakPolarHBondContact O-CB 3.47Å; L9-L13 WeakPolarHBondContact O-CD1 3.38Å; L9-L13 WeakPolarHBondContact O-CG 3.44Å; L9-L13 PolarHBondContact O-N 3.42Å
10	C	52.2	Low	43.5	Very low	87 Å²	87	133.3 Å²	133.3	59%	0.588	68%	0.683	S	S	*	*	H	α-helix	trans	-66.8	-37.8	176	-108.6	0	0	0	0	112.3	R6 A7 L14	R6-C10 PolarHBondContact O-N 3.46Å; R6-C10 VanDerWaalsContact O-N 3.16Å; A7-C10 PolarHBondContact O-N 3.21Å; C10-L14 WeakPolarHBondContact O-CB 3.5Å; C10-L14 PolarHBondContact O-N 3.11Å
11	W	52.4	Low	43.1	Very low	202 Å²	202	131.3 Å²	131.3	77%	0.765	69%	0.687	S	S	*	*	H	α-helix	trans	-73.6	-37.2	175.8	-107.7	2.1	0	0	0	113.5	A7 L13 L14 E15	A7-W11 PolarHBondContact O-N 3.39Å; W11-L13 VanDerWaalsContact C-N 3.35Å; W11-L14 PolarHBondContact O-N 3.04Å; W11-E15 WeakPolarHBondContact O-CB 3.48Å; W11-E15 PolarHBondContact O-N 3.45Å
12	M	48.6	Very low	43	Very low	137 Å²	137	123.7 Å²	123.7	68%	0.675	67%	0.67	S	S	*	*	H	α-helix	trans	-66.5	-37.8	171.5	-75.3	-77.2	-94.7	0	0	111.5	A8 T16	A8-M12 WeakPolarHBondContact O-CB 3.07Å; A8-M12 WeakPolarHBondContact O-CG 3.41Å; A8-M12 PolarHBondContact O-N 3.39Å; M12-T16 WeakPolarHBondContact O-CB 3.44Å; M12-T16 VanDerWaalsContact O-CG2 3.3Å; M12-T16 WeakPolarHBondContact O-CG2 3.44Å; M12-T16 PolarHBondContact O-N 3.2Å; M12-T16 PolarHBondContact O-OG1 2.81Å
13	L	48.3	Very low	43.4	Very low	92 Å²	92	114.4 Å²	114.4	48%	0.482	66%	0.655	S	S	.	*	H	α-helix	trans	-69	-37.2	174.3	-75	165.2	0	0	0	112	L9 W11 T16 F17	L9-L13 HydrophobicContact CD2-CD1 4.45Å; L9-L13 VanDerWaalsContact O-CB 3.23Å; L9-L13 WeakPolarHBondContact O-CB 3.47Å; L9-L13 WeakPolarHBondContact O-CD1 3.38Å; L9-L13 WeakPolarHBondContact O-CG 3.44Å; L9-L13 PolarHBondContact O-N 3.42Å; W11-L13 VanDerWaalsContact C-N 3.35Å; L13-T16 VanDerWaalsContact CA-OG1 3.29Å; L13-T16 WeakPolarHBondContact CA-OG1 3.41Å; L13-T16 PolarHBondContact O-N 3.06Å; L13-T16 PolarHBondContact O-OG1 2.93Å; L13-F17 WeakPolarHBondContact O-CB 3.38Å; L13-F17 WeakPolarHBondContact O-CD2 3.49Å; L13-F17 PolarHBondContact O-N 3.15Å
14	L	44.4	Very low	44.1	Very low	101 Å²	101	116.3 Å²	116.3	53%	0.529	66%	0.657	S	S	.	*	H	α-helix	trans	-67.7	-41.1	174.3	-135	80.9	0	0	0	112	C10 W11 F17 L18	C10-L14 WeakPolarHBondContact O-CB 3.5Å; C10-L14 PolarHBondContact O-N 3.11Å; W11-L14 PolarHBondContact O-N 3.04Å; L14-F17 PolarHBondContact O-N 2.97Å; L14-L18 HydrophobicContact CD2-CD1 4.37Å; L14-L18 HydrophobicContact CG-CD1 4.29Å; L14-L18 VanDerWaalsContact O-CB 3.26Å; L14-L18 WeakPolarHBondContact O-CB 3.49Å; L14-L18 WeakPolarHBondContact O-CD1 3.3Å; L14-L18 VanDerWaalsContact O-CG 3.29Å; L14-L18 WeakPolarHBondContact O-CG 3.19Å; L14-L18 PolarHBondContact O-N 2.85Å
15	E	38.1	Very low	45.2	Very low	114 Å²	114	112.2 Å²	112.2	53%	0.533	63%	0.629	S	S	.	*	H	α-helix	trans	-66.3	-34.8	173.7	-84.9	-114.1	164.1	0	0	112.2	W11 R19	W11-E15 WeakPolarHBondContact O-CB 3.48Å; W11-E15 PolarHBondContact O-N 3.45Å; E15-R19 PolarHBondContact O-N 3.4Å
16	T	40.5	Very low	46.4	Very low	87 Å²	87	114.1 Å²	114.1	53%	0.534	63%	0.628	S	S	.	*	H	α-helix	trans	-75	-30.7	174	54.9	0	0	0	0	113.3	M12 L13	M12-T16 WeakPolarHBondContact O-CB 3.44Å; M12-T16 VanDerWaalsContact O-CG2 3.3Å; M12-T16 WeakPolarHBondContact O-CG2 3.44Å; M12-T16 PolarHBondContact O-N 3.2Å; M12-T16 PolarHBondContact O-OG1 2.81Å; L13-T16 VanDerWaalsContact CA-OG1 3.29Å; L13-T16 WeakPolarHBondContact CA-OG1 3.41Å; L13-T16 PolarHBondContact O-N 3.06Å; L13-T16 PolarHBondContact O-OG1 2.93Å
17	F	34.8	Very low	47.7	Very low	171 Å²	171	103.8 Å²	103.8	75%	0.75	59%	0.589	S	S	*	*	H	α-helix	trans	-79.3	-25.8	173.6	-97.6	-88.3	0	0	0	113	L13 L14	L13-F17 WeakPolarHBondContact O-CB 3.38Å; L13-F17 WeakPolarHBondContact O-CD2 3.49Å; L13-F17 PolarHBondContact O-N 3.15Å; L14-F17 PolarHBondContact O-N 2.97Å
18	L	31.2	Very low	48.8	Very low	136 Å²	136	102.7 Å²	102.7	71%	0.712	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-7.2	175	-76.7	161.5	0	0	0	113.9	L14	L14-L18 HydrophobicContact CD2-CD1 4.37Å; L14-L18 HydrophobicContact CG-CD1 4.29Å; L14-L18 VanDerWaalsContact O-CB 3.26Å; L14-L18 WeakPolarHBondContact O-CB 3.49Å; L14-L18 WeakPolarHBondContact O-CD1 3.3Å; L14-L18 VanDerWaalsContact O-CG 3.29Å; L14-L18 WeakPolarHBondContact O-CG 3.19Å; L14-L18 PolarHBondContact O-N 2.85Å
19	R	33.5	Very low	48.9	Very low	209 Å²	209	103.5 Å²	103.5	79%	0.789	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	8.6	177.1	-81.2	-173.9	-179.7	-172.6	4.2	115.6	E15	E15-R19 PolarHBondContact O-N 3.4Å
20	S	32.6	Very low	48.9	Very low	107 Å²	107	99.6 Å²	99.6	75%	0.748	56%	0.562	S	S	*	*	S	Bend	trans	-123.4	27.8	-177.7	-168.7	0	0	0	0	115.5
21	A	34.1	Very low	49.3	Very low	92 Å²	92	99.2 Å²	99.2	76%	0.76	56%	0.56	S	S	*	*			trans	-124.5	72.9	165.1	0	0	0	0	0	109.2	G23	A21-G23 PolarHBondContact O-N 3.13Å
22	G	38.5	Very low	50.1	Low	81 Å²	81	90.3 Å²	90.3	84%	0.835	53%	0.53	S	S	*	.			trans	-66.4	103.5	164.6	0	0	0	0	0	107.8
23	G	41.3	Very low	51.3	Low	65 Å²	65	88.4 Å²	88.4	67%	0.67	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-53.4	145.5	177.9	0	0	0	0	0	111.6	A21 N25	A21-G23 PolarHBondContact O-N 3.13Å; G23-N25 PolarHBondContact O-N 2.98Å; G23-N25 VanDerWaalsContact O-N 3.16Å
24	L	55.6	Low	52.9	Low	136 Å²	136	84.2 Å²	84.2	71%	0.712	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-53.8	121.8	170.3	-83.5	88.1	0	0	0	108.4
25	N	71.1	Confident	54.9	Low	31 Å²	31	79.5 Å²	79.5	17%	0.166	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-86.1	167.7	170.4	65.9	62.5	0	0	0	110.1	G23 C27 M28 S29 D64 N68	G23-N25 PolarHBondContact O-N 2.98Å; G23-N25 VanDerWaalsContact O-N 3.16Å; N25-C27 PolarHBondContact O-N 2.85Å; N25-C27 VanDerWaalsContact OD1-CB 3.31Å; N25-C27 WeakPolarHBondContact OD1-CB 3.33Å; N25-C27 PolarHBondContact OD1-N 2.97Å; N25-M28 PolarHBondContact O-N 3.29Å; N25-M28 PolarHBondContact OD1-N 3.2Å; N25-S29 PolarHBondContact O-N 3.42Å; N25-S29 VanDerWaalsContact O-N 3.07Å; N25-S29 PolarHBondContact O-OG 3.44Å; N25-D64 PolarHBondContact ND2-OD1 3.05Å; N25-N68 PolarHBondContact ND2-ND2 3.49Å
26	I	74.1	Confident	57.1	Low	83 Å²	83	75.8 Å²	75.8	43%	0.426	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-31.1	-175.8	-166.7	165.1	0	0	0	114.2	S29 I41 H42	I26-S29 WeakPolarHBondContact CA-OG 3.29Å; I26-S29 PolarHBondContact O-OG 2.84Å; I26-I41 HydrophobicContact CG1-CG2 4.49Å; I26-I41 WeakPolarHBondContact O-CG2 3.3Å; I26-H42 HydrophobicContact CD1-CB 4.28Å; I26-H42 HydrophobicContact CG1-CB 4.49Å; I26-H42 HydrophobicContact CG2-CB 4.29Å
27	C	75.3	Confident	59.1	Low	1 Å²	1	75.2 Å²	75.2	1%	0.007	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-29.2	179.4	-53.5	0	0	0	0	112.9	N25 C45	N25-C27 PolarHBondContact O-N 2.85Å; N25-C27 VanDerWaalsContact OD1-CB 3.31Å; N25-C27 WeakPolarHBondContact OD1-CB 3.33Å; N25-C27 PolarHBondContact OD1-N 2.97Å; C27-C45 WeakPolarHBondContact CA-SG 3.28Å; C27-C45 HydrophobicContact CB-CB 3.8Å; C27-C45 WeakPolarHBondContact CB-SG 3.48Å; C27-C45 WeakPolarHBondContact SG-CA 3.3Å; C27-C45 WeakPolarHBondContact SG-CB 3.37Å; C27-C45 CovalentContact SG-SG 2.03Å; C27-C45 PolarHBondContact SG-SG 3.48Å
28	M	70.8	Confident	61.5	Low	49 Å²	49	67.1 Å²	67.1	24%	0.241	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-19.8	179.3	-64	-174	74.4	0	0	112.7	N25 G30 D64	N25-M28 PolarHBondContact O-N 3.29Å; N25-M28 PolarHBondContact OD1-N 3.2Å; M28-G30 VanDerWaalsContact C-N 3.35Å; M28-D64 HydrophobicContact CG-CB 4.46Å
29	S	57	Low	64	Low	78 Å²	78	60.9 Å²	60.9	55%	0.545	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.6	176.8	48.7	0	0	0	0	114.2	N25 I26	N25-S29 PolarHBondContact O-N 3.42Å; N25-S29 VanDerWaalsContact O-N 3.07Å; N25-S29 PolarHBondContact O-OG 3.44Å; I26-S29 WeakPolarHBondContact CA-OG 3.29Å; I26-S29 PolarHBondContact O-OG 2.84Å
30	G	52.7	Low	66.3	Low	33 Å²	33	55.3 Å²	55.3	34%	0.34	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	10.5	-171.6	0	0	0	0	0	117.1	M28 A32	M28-G30 VanDerWaalsContact C-N 3.35Å; G30-A32 PolarHBondContact O-N 2.91Å
31	S	61.3	Low	68.5	Low	78 Å²	78	52.7 Å²	52.7	55%	0.545	35%	0.348	S	S	.	.			trans	41.5	34.4	179.7	67.4	0	0	0	0	116	T33	S31-T33 PolarHBondContact O-N 3.37Å
32	A	67.8	Low	70.7	Confident	16 Å²	16	51.7 Å²	51.7	13%	0.132	33%	0.328	C	S	.	.			trans	-59.5	123.7	-176.4	0	0	0	0	0	111.2	G30 E37 C38 I41 C63	G30-A32 PolarHBondContact O-N 2.91Å; A32-E37 HydrophobicContact CB-CB 3.99Å; A32-C38 HydrophobicContact CB-CB 3.95Å; A32-I41 HydrophobicContact CB-CD1 3.69Å; A32-C63 HydrophobicContact CB-CB 4.2Å
33	T	73.4	Confident	72.8	Confident	97 Å²	97	49 Å²	49	60%	0.595	30%	0.296	S	S	*	.			trans	-95.2	-16.9	-179.7	65.6	0	0	0	0	112.3	S31 E37	S31-T33 PolarHBondContact O-N 3.37Å; T33-E37 PolarHBondContact N-OE2 3.41Å; T33-E37 PolarHBondContact OG1-OE1 3.18Å; T33-E37 PolarHBondContact OG1-OE2 2.96Å
34	S	81.9	Confident	75	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.028	28%	0.275	C	S	.	.	S	Bend	trans	-129.2	163.8	179.7	67.5	0	0	0	0	113	E36 E37 C38 R488	S34-E36 VanDerWaalsContact C-N 3.33Å; S34-E37 PolarHBondContact N-OE2 3.41Å; S34-E37 WeakPolarHBondContact OG-CB 3.29Å; S34-E37 VanDerWaalsContact OG-CG 3.28Å; S34-E37 WeakPolarHBondContact OG-CG 3.32Å; S34-E37 PolarHBondContact OG-N 3.48Å; S34-E37 PolarHBondContact OG-OE1 3.1Å; S34-C38 PolarHBondContact O-N 2.95Å; S34-C38 VanDerWaalsContact O-N 3.1Å; S34-R488 VanDerWaalsContact CB-NH2 3.33Å
35	C	87.1	Confident	76.5	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-41.5	177.5	-176.2	0	0	0	0	110.9	C38 L39 W47 C463 C484	C35-C38 WeakPolarHBondContact O-CB 3.39Å; C35-C38 PolarHBondContact O-N 2.81Å; C35-L39 WeakPolarHBondContact O-CG 3.4Å; C35-L39 PolarHBondContact O-N 3.43Å; C35-L39 VanDerWaalsContact O-N 3.08Å; C35-W47 HydrophobicContact CB-CB 4.28Å; C35-W47 HydrophobicContact CB-CD2 3.98Å; C35-W47 HydrophobicContact CB-CG 3.72Å; C35-W47 VanDerWaalsContact SG-CB 3.54Å; C35-W47 VanDerWaalsContact SG-CG 3.5Å; C35-C463 HydrophobicContact CB-CB 3.84Å; C35-C463 WeakPolarHBondContact CB-SG 3.45Å; C35-C463 WeakPolarHBondContact SG-CB 3.48Å; C35-C463 CovalentContact SG-SG 2.02Å; C35-C463 PolarHBondContact SG-SG 2.97Å; C35-C484 HydrophobicContact CB-CB 3.95Å
36	E	85.6	Confident	77.5	Confident	36 Å²	36	39.7 Å²	39.7	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-47.7	179.2	-63.1	80.5	-177.9	0	0	111.3	S34 C38 L39 L40 S466	S34-E36 VanDerWaalsContact C-N 3.33Å; E36-C38 VanDerWaalsContact C-N 3.3Å; E36-C38 PolarHBondContact O-N 3.3Å; E36-L39 PolarHBondContact O-N 2.95Å; E36-L40 WeakPolarHBondContact O-CG 3.27Å; E36-L40 PolarHBondContact O-N 3.29Å; E36-S466 WeakPolarHBondContact OE1-CB 3.3Å; E36-S466 PolarHBondContact OE1-OG 3.44Å
37	E	81.1	Confident	78.3	Confident	76 Å²	76	36 Å²	36	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-57	-43.8	173.4	-78.8	156.1	-131.7	0	0	111.7	A32 T33 S34 L39 L40 I41	A32-E37 HydrophobicContact CB-CB 3.99Å; T33-E37 PolarHBondContact N-OE2 3.41Å; T33-E37 PolarHBondContact OG1-OE1 3.18Å; T33-E37 PolarHBondContact OG1-OE2 2.96Å; S34-E37 PolarHBondContact N-OE2 3.41Å; S34-E37 WeakPolarHBondContact OG-CB 3.29Å; S34-E37 VanDerWaalsContact OG-CG 3.28Å; S34-E37 WeakPolarHBondContact OG-CG 3.32Å; S34-E37 PolarHBondContact OG-N 3.48Å; S34-E37 PolarHBondContact OG-OE1 3.1Å; E37-L39 VanDerWaalsContact C-N 3.31Å; E37-L39 PolarHBondContact O-N 2.78Å; E37-L40 PolarHBondContact O-N 2.92Å; E37-I41 WeakPolarHBondContact O-CG1 3.33Å; E37-I41 PolarHBondContact O-N 2.9Å
38	C	84.6	Confident	79.1	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-42	179.4	177	0	0	0	0	112.7	A32 S34 C35 E36 L40 I41 C45 A46 W47 C63	A32-C38 HydrophobicContact CB-CB 3.95Å; S34-C38 PolarHBondContact O-N 2.95Å; S34-C38 VanDerWaalsContact O-N 3.1Å; C35-C38 WeakPolarHBondContact O-CB 3.39Å; C35-C38 PolarHBondContact O-N 2.81Å; E36-C38 VanDerWaalsContact C-N 3.3Å; E36-C38 PolarHBondContact O-N 3.3Å; C38-L40 VanDerWaalsContact C-N 3.3Å; C38-L40 PolarHBondContact O-N 3.32Å; C38-I41 PolarHBondContact O-N 2.89Å; C38-C45 WeakPolarHBondContact O-CB 3.4Å; C38-A46 PolarHBondContact SG-O 2.84Å; C38-W47 HydrophobicContact CB-CB 4.39Å; C38-W47 HydrophobicContact CB-CE3 3.72Å; C38-W47 HydrophobicContact CB-CZ3 4.4Å; C38-C63 WeakPolarHBondContact CA-SG 3.48Å; C38-C63 HydrophobicContact CB-CB 3.64Å; C38-C63 WeakPolarHBondContact CB-SG 2.99Å; C38-C63 WeakPolarHBondContact SG-CA 3.47Å; C38-C63 WeakPolarHBondContact SG-CB 3.44Å; C38-C63 CovalentContact SG-SG 2.03Å; C38-C63 PolarHBondContact SG-SG 3.5Å
39	L	85.3	Confident	80	Confident	6 Å²	6	34.2 Å²	34.2	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-71.8	-26.6	-178.7	-64.9	-175	0	0	0	112.7	C35 E36 E37 P82 R119 C463	C35-L39 WeakPolarHBondContact O-CG 3.4Å; C35-L39 PolarHBondContact O-N 3.43Å; C35-L39 VanDerWaalsContact O-N 3.08Å; E36-L39 PolarHBondContact O-N 2.95Å; E37-L39 VanDerWaalsContact C-N 3.31Å; E37-L39 PolarHBondContact O-N 2.78Å; L39-P82 HydrophobicContact CD1-CG 3.66Å; L39-P82 HydrophobicContact CD2-CG 4.48Å; L39-R119 PolarHBondContact O-NH2 2.89Å; L39-C463 WeakPolarHBondContact CD1-SG 3.39Å
40	L	80.7	Confident	81.5	Confident	91 Å²	91	31.4 Å²	31.4	48%	0.476	19%	0.186	S	C	.	.	H	α-helix	trans	-77.2	-23.7	176.1	-71	172.9	0	0	0	113.9	E36 E37 C38 H42 P120	E36-L40 WeakPolarHBondContact O-CG 3.27Å; E36-L40 PolarHBondContact O-N 3.29Å; E37-L40 PolarHBondContact O-N 2.92Å; C38-L40 VanDerWaalsContact C-N 3.3Å; C38-L40 PolarHBondContact O-N 3.32Å; L40-H42 PolarHBondContact O-N 2.89Å; L40-P120 HydrophobicContact CD2-CB 4.01Å; L40-P120 HydrophobicContact CD2-CG 3.83Å
41	I	78.4	Confident	82.9	Confident	53 Å²	53	33.9 Å²	33.9	27%	0.272	19%	0.188	S	C	.	.	H	α-helix	trans	-58.8	-51.2	180	-72	168.9	0	0	0	111.6	I26 A32 E37 C38	I26-I41 HydrophobicContact CG1-CG2 4.49Å; I26-I41 WeakPolarHBondContact O-CG2 3.3Å; A32-I41 HydrophobicContact CB-CD1 3.69Å; E37-I41 WeakPolarHBondContact O-CG1 3.33Å; E37-I41 PolarHBondContact O-N 2.9Å; C38-I41 PolarHBondContact O-N 2.89Å
42	H	80.4	Confident	83.7	Confident	71 Å²	71	34.5 Å²	34.5	33%	0.329	19%	0.185	S	C	.	.			trans	-163.9	146.7	-179	-167.4	-97.7	0	0	0	110.5	I26 L40 S44 C45 R119	I26-H42 HydrophobicContact CD1-CB 4.28Å; I26-H42 HydrophobicContact CG1-CB 4.49Å; I26-H42 HydrophobicContact CG2-CB 4.29Å; L40-H42 PolarHBondContact O-N 2.89Å; H42-S44 WeakPolarHBondContact ND1-CB 3.29Å; H42-S44 PolarHBondContact ND1-N 2.91Å; H42-S44 PolarHBondContact ND1-OG 3.5Å; H42-S44 PolarHBondContact O-N 2.89Å; H42-C45 WeakPolarHBondContact O-CB 3.29Å; H42-C45 PolarHBondContact O-N 3.27Å; H42-R119 PolarHBondContact O-NH2 3.27Å
43	P	83.6	Confident	84.2	Confident	25 Å²	25	34.3 Å²	34.3	16%	0.162	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.9	178	25	-40.3	0	0	0	114.6	Y81 R119 G121 D122	P43-Y81 WeakPolarHBondContact O-CE2 3.39Å; P43-Y81 PolarHBondContact O-OH 2.03Å; P43-R119 PolarHBondContact O-NH1 2.64Å; P43-R119 VanDerWaalsContact O-NH1 3.12Å; P43-G121 WeakPolarHBondContact CG-O 3.32Å; P43-D122 HydrophobicContact CB-CB 3.83Å
44	S	86.7	Confident	83.8	Confident	35 Å²	35	31.4 Å²	31.4	25%	0.245	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-12.8	175.7	70.9	0	0	0	0	114.1	H42 L65	H42-S44 WeakPolarHBondContact ND1-CB 3.29Å; H42-S44 PolarHBondContact ND1-N 2.91Å; H42-S44 PolarHBondContact ND1-OG 3.5Å; H42-S44 PolarHBondContact O-N 2.89Å; S44-L65 WeakPolarHBondContact O-CD2 3.16Å; S44-L65 WeakPolarHBondContact OG-CD2 3.48Å
45	C	88.3	Confident	82.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	146.7	-178.6	-57.9	0	0	0	0	111.4	C27 C38 H42 Y81 R119	C27-C45 WeakPolarHBondContact CA-SG 3.28Å; C27-C45 HydrophobicContact CB-CB 3.8Å; C27-C45 WeakPolarHBondContact CB-SG 3.48Å; C27-C45 WeakPolarHBondContact SG-CA 3.3Å; C27-C45 WeakPolarHBondContact SG-CB 3.37Å; C27-C45 CovalentContact SG-SG 2.03Å; C27-C45 PolarHBondContact SG-SG 3.48Å; C38-C45 WeakPolarHBondContact O-CB 3.4Å; H42-C45 WeakPolarHBondContact O-CB 3.29Å; H42-C45 PolarHBondContact O-N 3.27Å; C45-Y81 VanDerWaalsContact O-CD2 3.24Å; C45-Y81 WeakPolarHBondContact O-CD2 3.33Å; C45-Y81 WeakPolarHBondContact O-CE2 3.47Å; C45-R119 PolarHBondContact O-NH1 2.93Å; C45-R119 PolarHBondContact O-NH2 2.88Å
46	A	91.5	Very high	80.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.9	177.4	0	0	0	0	0	108.7	C38 C63 D64 K66 L69 I79 E80 Y81	C38-A46 PolarHBondContact SG-O 2.84Å; A46-C63 WeakPolarHBondContact O-CA 3.45Å; A46-D64 WeakPolarHBondContact CA-O 3.38Å; A46-D64 PolarHBondContact N-O 3.49Å; A46-D64 PolarHBondContact O-N 3.01Å; A46-K66 HydrophobicContact CB-CB 4.03Å; A46-L69 HydrophobicContact CB-CD1 3.84Å; A46-L69 WeakPolarHBondContact O-CD1 3.49Å; A46-I79 HydrophobicContact CB-CG2 3.91Å; A46-E80 WeakPolarHBondContact CA-O 3.31Å; A46-Y81 HydrophobicContact CB-CD2 3.73Å; A46-Y81 HydrophobicContact CB-CG 4.24Å
47	W	91.6	Very high	78.8	Confident	7 Å²	7	59 Å²	59	3%	0.027	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.5	178	177.8	-94.1	0	0	0	111.2	C35 C38 R62 C63 I79 E80 C484	C35-W47 HydrophobicContact CB-CB 4.28Å; C35-W47 HydrophobicContact CB-CD2 3.98Å; C35-W47 HydrophobicContact CB-CG 3.72Å; C35-W47 VanDerWaalsContact SG-CB 3.54Å; C35-W47 VanDerWaalsContact SG-CG 3.5Å; C38-W47 HydrophobicContact CB-CB 4.39Å; C38-W47 HydrophobicContact CB-CE3 3.72Å; C38-W47 HydrophobicContact CB-CZ3 4.4Å; W47-R62 WeakPolarHBondContact CA-O 3.03Å; W47-R62 HydrophobicContact CD2-CB 4.03Å; W47-R62 HydrophobicContact CE3-CB 3.83Å; W47-R62 HydrophobicContact CH2-CB 3.51Å; W47-R62 HydrophobicContact CH2-CG 4.33Å; W47-R62 HydrophobicContact CZ2-CB 3.66Å; W47-R62 HydrophobicContact CZ2-CG 4.28Å; W47-R62 HydrophobicContact CZ3-CB 3.58Å; W47-C63 HydrophobicContact CE3-CB 3.93Å; W47-C63 HydrophobicContact CZ3-CB 4.17Å; W47-I79 CarbonylContact O-C 3.6Å; W47-I79 WeakPolarHBondContact O-CA 3.1Å; W47-E80 HydrophobicContact CB-CB 4.23Å; W47-E80 PolarHBondContact N-O 3.39Å; W47-E80 PolarHBondContact O-N 2.88Å; W47-C484 PolarHBondContact NE1-O 2.81Å
48	C	91.3	Very high	76.9	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	109	172.9	-174.9	0	0	0	0	111.7	Q50 F53 R62 L69 C74	C48-Q50 VanDerWaalsContact C-N 3.3Å; C48-Q50 PolarHBondContact O-N 3.02Å; C48-F53 HydrophobicContact CB-CD1 3.89Å; C48-F53 HydrophobicContact CB-CE1 3.98Å; C48-F53 HydrophobicContact CB-CG 4.16Å; C48-F53 HydrophobicContact CB-CZ 4.35Å; C48-F53 VanDerWaalsContact SG-CD2 3.59Å; C48-F53 WeakPolarHBondContact SG-CG 3.46Å; C48-R62 PolarHBondContact N-O 3.33Å; C48-R62 PolarHBondContact O-NH1 3.49Å; C48-L69 HydrophobicContact CB-CD1 4.12Å; C48-L69 HydrophobicContact CB-CD2 4.13Å; C48-C74 HydrophobicContact CB-CB 3.92Å; C48-C74 WeakPolarHBondContact CB-SG 3.41Å; C48-C74 WeakPolarHBondContact SG-CB 3.14Å; C48-C74 CovalentContact SG-SG 2.03Å; C48-C74 PolarHBondContact SG-SG 2.96Å
49	A	90.5	Very high	75.4	Confident	12 Å²	12	67.6 Å²	67.6	10%	0.099	33%	0.33	C	S	.	.			trans	-85.3	3.8	177.8	0	0	0	0	0	114.3	F78 C465 C484	A49-F78 PolarHBondContact N-O 3.06Å; A49-C465 HydrophobicContact CB-CB 4.01Å; A49-C484 WeakPolarHBondContact CA-O 3.4Å; A49-C484 HydrophobicContact CB-CB 4.43Å
50	Q	88.5	Confident	74.1	Confident	18 Å²	18	69 Å²	69	8%	0.084	34%	0.338	C	S	.	.			trans	-70.5	129.7	-177.7	-177.9	175.4	-30.3	0	0	111.2	C48 D52 F53 R62 F78	C48-Q50 VanDerWaalsContact C-N 3.3Å; C48-Q50 PolarHBondContact O-N 3.02Å; Q50-D52 WeakPolarHBondContact CG-OD1 3.32Å; Q50-D52 PolarHBondContact NE2-OD1 2.88Å; Q50-D52 PolarHBondContact O-N 3.32Å; Q50-F53 HydrophobicContact CB-CB 4.18Å; Q50-F53 WeakPolarHBondContact O-CB 3.31Å; Q50-F53 PolarHBondContact O-N 3.39Å; Q50-R62 PolarHBondContact O-NH1 2.96Å; Q50-F78 HydrophobicContact CB-CB 3.75Å; Q50-F78 HydrophobicContact CB-CD2 3.87Å; Q50-F78 HydrophobicContact CB-CG 3.85Å; Q50-F78 HydrophobicContact CG-CD2 3.92Å; Q50-F78 HydrophobicContact CG-CE2 4.34Å; Q50-F78 HydrophobicContact CG-CG 4.38Å
51	E	82.1	Confident	73.9	Confident	85 Å²	85	66.3 Å²	66.3	40%	0.397	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-46.6	-171.1	-168.4	-160.2	128.8	0	0	113.4	F53 K55 R62	E51-F53 VanDerWaalsContact C-N 3.31Å; E51-F53 PolarHBondContact O-N 2.85Å; E51-K55 IonicContact OE1-NZ 2.82Å; E51-K55 PolarHBondContact OE1-NZ 3.26Å; E51-R62 PolarHBondContact O-NH2 3.42Å
52	D	77.5	Confident	74.2	Confident	91 Å²	91	66 Å²	66	49%	0.487	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	2.9	-175.6	67.9	-35.4	0	0	0	114.8	Q50 G54 K55	Q50-D52 WeakPolarHBondContact CG-OD1 3.32Å; Q50-D52 PolarHBondContact NE2-OD1 2.88Å; Q50-D52 PolarHBondContact O-N 3.32Å; D52-G54 PolarHBondContact O-N 3.41Å; D52-K55 HydrophobicContact CB-CD 4.03Å; D52-K55 PolarHBondContact O-N 2.96Å
53	F	78.3	Confident	74.5	Confident	12 Å²	12	62.7 Å²	62.7	5%	0.053	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	123.6	178	-169.3	-102.8	0	0	0	111.2	C48 Q50 E51 R62 L69 R72 C74	C48-F53 HydrophobicContact CB-CD1 3.89Å; C48-F53 HydrophobicContact CB-CE1 3.98Å; C48-F53 HydrophobicContact CB-CG 4.16Å; C48-F53 HydrophobicContact CB-CZ 4.35Å; C48-F53 VanDerWaalsContact SG-CD2 3.59Å; C48-F53 WeakPolarHBondContact SG-CG 3.46Å; Q50-F53 HydrophobicContact CB-CB 4.18Å; Q50-F53 WeakPolarHBondContact O-CB 3.31Å; Q50-F53 PolarHBondContact O-N 3.39Å; E51-F53 VanDerWaalsContact C-N 3.31Å; E51-F53 PolarHBondContact O-N 2.85Å; F53-R62 HydrophobicContact CD1-CG 4.22Å; F53-R62 PolarHBondContact O-NH2 3.47Å; F53-L69 HydrophobicContact CE1-CD2 3.93Å; F53-L69 HydrophobicContact CZ-CD2 3.7Å; F53-R72 HydrophobicContact CE2-CB 3.86Å; F53-R72 HydrophobicContact CZ-CB 3.89Å; F53-C74 HydrophobicContact CD2-CB 3.75Å; F53-C74 HydrophobicContact CE2-CB 3.57Å; F53-C74 HydrophobicContact CZ-CB 4.29Å
54	G	64.9	Low	74.7	Confident	37 Å²	37	61.5 Å²	61.5	38%	0.381	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	3.3	178.7	0	0	0	0	0	116.8	D52 R56 T60	D52-G54 PolarHBondContact O-N 3.41Å; G54-R56 PolarHBondContact O-N 2.95Å; G54-R56 VanDerWaalsContact O-N 3.09Å; G54-T60 WeakPolarHBondContact CA-OG1 3.5Å
55	K	57.5	Low	74.9	Confident	124 Å²	124	62.4 Å²	62.4	54%	0.539	30%	0.301	S	S	.	.			trans	-67.1	-5.8	177.9	-69.5	-177.2	-179.4	170.5	0	114.7	E51 D52	E51-K55 IonicContact OE1-NZ 2.82Å; E51-K55 PolarHBondContact OE1-NZ 3.26Å; D52-K55 HydrophobicContact CB-CD 4.03Å; D52-K55 PolarHBondContact O-N 2.96Å
56	R	47.2	Very low	75	Confident	233 Å²	233	66.5 Å²	66.5	88%	0.879	32%	0.319	S	S	*	.	S	Bend	trans	-105.8	94.2	-179.2	-70.4	-175	-179.8	-178.5	1.6	112.2	G54 S58	G54-R56 PolarHBondContact O-N 2.95Å; G54-R56 VanDerWaalsContact O-N 3.09Å; R56-S58 PolarHBondContact O-N 3Å
57	R	44.2	Very low	75	Confident	264 Å²	264	73 Å²	73	100%	0.996	35%	0.349	S	S	*	.	S	Bend	trans	43.9	7.7	157.1	-77.1	-170.3	177	179.6	-0.4	121
58	S	42.3	Very low	74.8	Confident	70 Å²	70	74.5 Å²	74.5	49%	0.49	36%	0.358	S	S	.	.	S	Bend	trans	-132	136.6	163.6	71.8	0	0	0	0	109.8	R56 T60	R56-S58 PolarHBondContact O-N 3Å; S58-T60 PolarHBondContact O-N 3.45Å; S58-T60 WeakPolarHBondContact OG-CG2 3.08Å
59	L	51.6	Low	74.7	Confident	186 Å²	186	74.5 Å²	74.5	97%	0.974	36%	0.358	S	S	*	.			trans	-56.8	82.7	168.7	-73.4	144	0	0	0	109.7
60	T	59.7	Low	74.7	Confident	34 Å²	34	77.9 Å²	77.9	21%	0.209	37%	0.372	C	S	.	.			trans	-89.9	111	175	49.2	0	0	0	0	108.6	G54 S58 R62	G54-T60 WeakPolarHBondContact CA-OG1 3.5Å; S58-T60 PolarHBondContact O-N 3.45Å; S58-T60 WeakPolarHBondContact OG-CG2 3.08Å; T60-R62 PolarHBondContact O-N 3.24Å
61	S	75.3	Confident	74.6	Confident	35 Å²	35	85 Å²	85	25%	0.245	40%	0.402	C	S	.	.			trans	-49.9	132.4	167	177.4	0	0	0	0	110.4	C63	S61-C63 WeakPolarHBondContact CB-O 3.09Å; S61-C63 PolarHBondContact O-N 3.05Å; S61-C63 PolarHBondContact OG-N 3.37Å; S61-C63 VanDerWaalsContact OG-N 3.11Å; S61-C63 PolarHBondContact OG-O 3.35Å
62	R	85.1	Confident	74.7	Confident	48 Å²	48	85.9 Å²	85.9	18%	0.181	40%	0.402	C	S	.	.	S	Bend	trans	-72.6	-16	171.1	-70.3	179.7	176.3	-78.5	-0.4	112.1	W47 C48 Q50 E51 F53 T60 G485	W47-R62 WeakPolarHBondContact CA-O 3.03Å; W47-R62 HydrophobicContact CD2-CB 4.03Å; W47-R62 HydrophobicContact CE3-CB 3.83Å; W47-R62 HydrophobicContact CH2-CB 3.51Å; W47-R62 HydrophobicContact CH2-CG 4.33Å; W47-R62 HydrophobicContact CZ2-CB 3.66Å; W47-R62 HydrophobicContact CZ2-CG 4.28Å; W47-R62 HydrophobicContact CZ3-CB 3.58Å; C48-R62 PolarHBondContact N-O 3.33Å; C48-R62 PolarHBondContact O-NH1 3.49Å; Q50-R62 PolarHBondContact O-NH1 2.96Å; E51-R62 PolarHBondContact O-NH2 3.42Å; F53-R62 HydrophobicContact CD1-CG 4.22Å; F53-R62 PolarHBondContact O-NH2 3.47Å; T60-R62 PolarHBondContact O-N 3.24Å; R62-G485 PolarHBondContact NE-O 3.12Å; R62-G485 PolarHBondContact NH2-O 2.99Å; R62-G485 VanDerWaalsContact NH2-O 3.13Å
63	C	86.9	Confident	75.1	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.4	172.1	-169.7	0	0	0	0	111	A32 C38 A46 W47 S61	A32-C63 HydrophobicContact CB-CB 4.2Å; C38-C63 WeakPolarHBondContact CA-SG 3.48Å; C38-C63 HydrophobicContact CB-CB 3.64Å; C38-C63 WeakPolarHBondContact CB-SG 2.99Å; C38-C63 WeakPolarHBondContact SG-CA 3.47Å; C38-C63 WeakPolarHBondContact SG-CB 3.44Å; C38-C63 CovalentContact SG-SG 2.03Å; C38-C63 PolarHBondContact SG-SG 3.5Å; A46-C63 WeakPolarHBondContact O-CA 3.45Å; W47-C63 HydrophobicContact CE3-CB 3.93Å; W47-C63 HydrophobicContact CZ3-CB 4.17Å; S61-C63 WeakPolarHBondContact CB-O 3.09Å; S61-C63 PolarHBondContact O-N 3.05Å; S61-C63 PolarHBondContact OG-N 3.37Å; S61-C63 VanDerWaalsContact OG-N 3.11Å; S61-C63 PolarHBondContact OG-O 3.35Å
64	D	88.6	Confident	75.7	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	177.8	176.5	-152.6	-35.6	0	0	0	109.9	N25 M28 A46 N68 L69 R72	N25-D64 PolarHBondContact ND2-OD1 3.05Å; M28-D64 HydrophobicContact CG-CB 4.46Å; A46-D64 WeakPolarHBondContact CA-O 3.38Å; A46-D64 PolarHBondContact N-O 3.49Å; A46-D64 PolarHBondContact O-N 3.01Å; D64-N68 HydrophobicContact CB-CB 4.29Å; D64-N68 WeakPolarHBondContact OD1-CB 3.38Å; D64-N68 PolarHBondContact OD1-ND2 2.86Å; D64-L69 HydrophobicContact CB-CD2 3.66Å; D64-L69 HydrophobicContact CB-CG 3.95Å; D64-R72 IonicContact OD2-CZ 3.51Å; D64-R72 IonicContact OD2-NH1 2.87Å; D64-R72 PolarHBondContact OD2-NH1 3.32Å; D64-R72 IonicContact OD2-NH2 3.39Å; D64-R72 PolarHBondContact OD2-NH2 2.79Å
65	L	89.4	Confident	76.9	Confident	54 Å²	54	85.4 Å²	85.4	28%	0.283	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	139.7	167.4	-59	176.7	0	0	0	110.2	S44 Q67 N68 L69	S44-L65 WeakPolarHBondContact O-CD2 3.16Å; S44-L65 WeakPolarHBondContact OG-CD2 3.48Å; L65-Q67 PolarHBondContact O-N 3.01Å; L65-N68 HydrophobicContact CB-CB 4.45Å; L65-N68 WeakPolarHBondContact O-CA 3.29Å; L65-N68 WeakPolarHBondContact O-CB 3.45Å; L65-N68 PolarHBondContact O-N 3.37Å; L65-L69 PolarHBondContact O-N 2.92Å; L65-L69 VanDerWaalsContact O-N 3.11Å
66	K	91.3	Very high	78.4	Confident	87 Å²	87	84 Å²	84	38%	0.378	40%	0.403	S	S	.	.	H	α-helix	trans	-46.8	-43.6	179.7	177.1	171.9	-179.6	174	0	113.5	A46 N68 L69 Q70 I79 Y81	A46-K66 HydrophobicContact CB-CB 4.03Å; K66-N68 VanDerWaalsContact C-N 3.35Å; K66-N68 PolarHBondContact O-N 3Å; K66-L69 PolarHBondContact O-N 2.98Å; K66-Q70 WeakPolarHBondContact O-CG 3.36Å; K66-Q70 PolarHBondContact O-N 3.38Å; K66-I79 HydrophobicContact CG-CG2 4.32Å; K66-Y81 HydrophobicContact CD-CD1 3.75Å; K66-Y81 HydrophobicContact CD-CE1 4.24Å; K66-Y81 HydrophobicContact CD-CG 4.09Å
67	Q	90.4	Very high	80.5	Confident	135 Å²	135	81.8 Å²	81.8	63%	0.631	40%	0.395	S	S	*	.	H	α-helix	trans	-67.5	-34	-179.8	-62.8	-179.2	4.7	0	0	112.8	L65 K71	L65-Q67 PolarHBondContact O-N 3.01Å; Q67-K71 VanDerWaalsContact O-CG 3.29Å; Q67-K71 WeakPolarHBondContact O-CG 3.41Å; Q67-K71 PolarHBondContact O-N 2.68Å
68	N	88.8	Confident	82.6	Confident	40 Å²	40	72.7 Å²	72.7	21%	0.214	36%	0.363	C	S	.	.	H	α-helix	trans	-71.7	-41.8	178.3	-69.3	-14	0	0	0	110.9	N25 D64 L65 K66 Q70 K71 R72	N25-N68 PolarHBondContact ND2-ND2 3.49Å; D64-N68 HydrophobicContact CB-CB 4.29Å; D64-N68 WeakPolarHBondContact OD1-CB 3.38Å; D64-N68 PolarHBondContact OD1-ND2 2.86Å; L65-N68 HydrophobicContact CB-CB 4.45Å; L65-N68 WeakPolarHBondContact O-CA 3.29Å; L65-N68 WeakPolarHBondContact O-CB 3.45Å; L65-N68 PolarHBondContact O-N 3.37Å; K66-N68 VanDerWaalsContact C-N 3.35Å; K66-N68 PolarHBondContact O-N 3Å; N68-Q70 VanDerWaalsContact C-N 3.31Å; N68-Q70 PolarHBondContact O-N 3.49Å; N68-K71 PolarHBondContact O-N 3.48Å; N68-R72 WeakPolarHBondContact O-CB 3.46Å; N68-R72 VanDerWaalsContact O-CG 3.32Å; N68-R72 WeakPolarHBondContact O-CG 3.37Å; N68-R72 PolarHBondContact O-N 2.95Å
69	L	88.8	Confident	85	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.9	-43.9	175	-64.9	-179.5	0	0	0	111.6	A46 C48 F53 D64 L65 K66 R72 G73 C74 I79	A46-L69 HydrophobicContact CB-CD1 3.84Å; A46-L69 WeakPolarHBondContact O-CD1 3.49Å; C48-L69 HydrophobicContact CB-CD1 4.12Å; C48-L69 HydrophobicContact CB-CD2 4.13Å; F53-L69 HydrophobicContact CE1-CD2 3.93Å; F53-L69 HydrophobicContact CZ-CD2 3.7Å; D64-L69 HydrophobicContact CB-CD2 3.66Å; D64-L69 HydrophobicContact CB-CG 3.95Å; L65-L69 PolarHBondContact O-N 2.92Å; L65-L69 VanDerWaalsContact O-N 3.11Å; K66-L69 PolarHBondContact O-N 2.98Å; L69-R72 CarbonylContact O-C 3.54Å; L69-R72 PolarHBondContact O-N 3.39Å; L69-G73 PolarHBondContact O-N 3.06Å; L69-C74 HydrophobicContact CB-CB 4.05Å; L69-C74 WeakPolarHBondContact O-CB 3.29Å; L69-C74 PolarHBondContact O-N 3.33Å; L69-I79 HydrophobicContact CB-CD1 4.24Å; L69-I79 HydrophobicContact CD1-CG2 4.39Å
70	Q	89.5	Confident	87	Confident	82 Å²	82	62.4 Å²	62.4	38%	0.383	30%	0.303	S	S	.	.	H	α-helix	trans	-62.5	-45.5	175.8	-70.9	177.3	-27.6	0	0	112	K66 N68 R72 G73 I79	K66-Q70 WeakPolarHBondContact O-CG 3.36Å; K66-Q70 PolarHBondContact O-N 3.38Å; N68-Q70 VanDerWaalsContact C-N 3.31Å; N68-Q70 PolarHBondContact O-N 3.49Å; Q70-R72 PolarHBondContact O-N 3Å; Q70-G73 PolarHBondContact O-N 3.03Å; Q70-I79 HydrophobicContact CG-CD1 3.46Å; Q70-I79 VanDerWaalsContact CG-CD1 3.46Å
71	K	87	Confident	88.5	Confident	168 Å²	168	63.3 Å²	63.3	73%	0.73	30%	0.303	S	S	*	.	H	α-helix	trans	-61.7	-30.7	176.3	-75	173	-176.7	175	0	112.8	Q67 N68 G73	Q67-K71 VanDerWaalsContact O-CG 3.29Å; Q67-K71 WeakPolarHBondContact O-CG 3.41Å; Q67-K71 PolarHBondContact O-N 2.68Å; N68-K71 PolarHBondContact O-N 3.48Å; K71-G73 VanDerWaalsContact C-N 3.29Å
72	R	84.1	Confident	89.3	Confident	103 Å²	103	62.9 Å²	62.9	39%	0.389	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.8	177.4	-69	178.9	-173.6	161.8	10.7	113.6	F53 D64 N68 L69 Q70	F53-R72 HydrophobicContact CE2-CB 3.86Å; F53-R72 HydrophobicContact CZ-CB 3.89Å; D64-R72 IonicContact OD2-CZ 3.51Å; D64-R72 IonicContact OD2-NH1 2.87Å; D64-R72 PolarHBondContact OD2-NH1 3.32Å; D64-R72 IonicContact OD2-NH2 3.39Å; D64-R72 PolarHBondContact OD2-NH2 2.79Å; N68-R72 WeakPolarHBondContact O-CB 3.46Å; N68-R72 VanDerWaalsContact O-CG 3.32Å; N68-R72 WeakPolarHBondContact O-CG 3.37Å; N68-R72 PolarHBondContact O-N 2.95Å; L69-R72 CarbonylContact O-C 3.54Å; L69-R72 PolarHBondContact O-N 3.39Å; Q70-R72 PolarHBondContact O-N 3Å
73	G	86.3	Confident	89.5	Confident	47 Å²	47	68 Å²	68	49%	0.485	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	15.9	173.2	0	0	0	0	0	115.5	L69 Q70 K71 E75	L69-G73 PolarHBondContact O-N 3.06Å; Q70-G73 PolarHBondContact O-N 3.03Å; K71-G73 VanDerWaalsContact C-N 3.29Å; G73-E75 PolarHBondContact O-N 2.91Å
74	C	89.9	Confident	89.8	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.02	32%	0.324	C	S	.	.			trans	-74.4	122.4	168.3	-166.1	0	0	0	0	109.7	C48 F53 L69 I79	C48-C74 HydrophobicContact CB-CB 3.92Å; C48-C74 WeakPolarHBondContact CB-SG 3.41Å; C48-C74 WeakPolarHBondContact SG-CB 3.14Å; C48-C74 CovalentContact SG-SG 2.03Å; C48-C74 PolarHBondContact SG-SG 2.96Å; F53-C74 HydrophobicContact CD2-CB 3.75Å; F53-C74 HydrophobicContact CE2-CB 3.57Å; F53-C74 HydrophobicContact CZ-CB 4.29Å; L69-C74 HydrophobicContact CB-CB 4.05Å; L69-C74 WeakPolarHBondContact O-CB 3.29Å; L69-C74 PolarHBondContact O-N 3.33Å; C74-I79 HydrophobicContact CB-CD1 4.26Å; C74-I79 HydrophobicContact CB-CG1 4.13Å; C74-I79 VanDerWaalsContact SG-CG1 3.5Å
75	E	90.4	Very high	90	Very high	80 Å²	80	72.5 Å²	72.5	37%	0.374	35%	0.347	S	S	.	.			trans	-68.7	141.7	177.2	-63.3	-177.2	170.7	0	0	111.1	G73 R77 F78	G73-E75 PolarHBondContact O-N 2.91Å; E75-R77 HydrophobicContact CB-CG 4.31Å; E75-R77 PolarHBondContact O-N 2.97Å; E75-R77 IonicContact OE1-NH2 3.36Å; E75-R77 IonicContact OE2-CZ 2.68Å; E75-R77 IonicContact OE2-NE 3.66Å; E75-R77 PolarHBondContact OE2-NE 2.96Å; E75-R77 IonicContact OE2-NH2 2.68Å; E75-R77 PolarHBondContact OE2-NH2 3.37Å; E75-F78 HydrophobicContact CB-CD2 4.08Å; E75-F78 PolarHBondContact O-N 3.41Å
76	P	89.9	Confident	90.3	Very high	94 Å²	94	72.8 Å²	72.8	61%	0.61	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-54.6	-29.6	-174.9	-28.6	35.1	0	0	0	115.8	F78 I79	P76-F78 VanDerWaalsContact C-N 3.29Å; P76-F78 PolarHBondContact O-N 3.37Å; P76-I79 PolarHBondContact O-N 3.05Å
77	R	90.2	Very high	90.4	Very high	187 Å²	187	71.1 Å²	71.1	71%	0.706	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-70.1	-22.2	179	62.9	176	163.7	173	-3.8	114.2	E75	E75-R77 HydrophobicContact CB-CG 4.31Å; E75-R77 PolarHBondContact O-N 2.97Å; E75-R77 IonicContact OE1-NH2 3.36Å; E75-R77 IonicContact OE2-CZ 2.68Å; E75-R77 IonicContact OE2-NE 3.66Å; E75-R77 PolarHBondContact OE2-NE 2.96Å; E75-R77 IonicContact OE2-NH2 2.68Å; E75-R77 PolarHBondContact OE2-NH2 3.37Å
78	F	90.2	Very high	90.7	Very high	74 Å²	74	69.6 Å²	69.6	33%	0.325	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-99	3.5	178.1	-65.2	-67.2	0	0	0	112.4	A49 Q50 E75 P76	A49-F78 PolarHBondContact N-O 3.06Å; Q50-F78 HydrophobicContact CB-CB 3.75Å; Q50-F78 HydrophobicContact CB-CD2 3.87Å; Q50-F78 HydrophobicContact CB-CG 3.85Å; Q50-F78 HydrophobicContact CG-CD2 3.92Å; Q50-F78 HydrophobicContact CG-CE2 4.34Å; Q50-F78 HydrophobicContact CG-CG 4.38Å; E75-F78 HydrophobicContact CB-CD2 4.08Å; E75-F78 PolarHBondContact O-N 3.41Å; P76-F78 VanDerWaalsContact C-N 3.29Å; P76-F78 PolarHBondContact O-N 3.37Å
79	I	92.6	Very high	91	Very high	20 Å²	20	72.3 Å²	72.3	10%	0.103	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.4	177.9	-61.4	177.3	0	0	0	109.3	A46 W47 K66 L69 Q70 C74 P76	A46-I79 HydrophobicContact CB-CG2 3.91Å; W47-I79 CarbonylContact O-C 3.6Å; W47-I79 WeakPolarHBondContact O-CA 3.1Å; K66-I79 HydrophobicContact CG-CG2 4.32Å; L69-I79 HydrophobicContact CB-CD1 4.24Å; L69-I79 HydrophobicContact CD1-CG2 4.39Å; Q70-I79 HydrophobicContact CG-CD1 3.46Å; Q70-I79 VanDerWaalsContact CG-CD1 3.46Å; C74-I79 HydrophobicContact CB-CD1 4.26Å; C74-I79 HydrophobicContact CB-CG1 4.13Å; C74-I79 VanDerWaalsContact SG-CG1 3.5Å; P76-I79 PolarHBondContact O-N 3.05Å
80	E	92.7	Very high	91.3	Very high	20 Å²	20	76.9 Å²	76.9	9%	0.093	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	113.4	170.6	-63.7	-71.1	169.6	0	0	108.9	A46 W47 C463 S464 C465	A46-E80 WeakPolarHBondContact CA-O 3.31Å; W47-E80 HydrophobicContact CB-CB 4.23Å; W47-E80 PolarHBondContact N-O 3.39Å; W47-E80 PolarHBondContact O-N 2.88Å; E80-C463 HydrophobicContact CG-CB 4.17Å; E80-S464 WeakPolarHBondContact OE1-CB 3.05Å; E80-S464 PolarHBondContact OE1-N 2.69Å; E80-S464 PolarHBondContact OE1-OG 2.9Å; E80-S464 WeakPolarHBondContact OE2-CB 3.31Å; E80-S464 PolarHBondContact OE2-N 3.15Å; E80-S464 VanDerWaalsContact OE2-N 3.1Å; E80-S464 PolarHBondContact OE2-OG 3.14Å; E80-C465 WeakPolarHBondContact OE1-CB 3.38Å; E80-C465 PolarHBondContact OE1-N 2.61Å; E80-C465 PolarHBondContact OE1-SG 3.44Å
81	Y	92.1	Very high	91.5	Very high	52 Å²	52	77 Å²	77	20%	0.204	38%	0.381	C	S	.	.			trans	-150.6	70.4	178.5	-172.9	-111.3	0	0	0	110.2	P43 C45 A46 K66 R83	P43-Y81 WeakPolarHBondContact O-CE2 3.39Å; P43-Y81 PolarHBondContact O-OH 2.03Å; C45-Y81 VanDerWaalsContact O-CD2 3.24Å; C45-Y81 WeakPolarHBondContact O-CD2 3.33Å; C45-Y81 WeakPolarHBondContact O-CE2 3.47Å; A46-Y81 HydrophobicContact CB-CD2 3.73Å; A46-Y81 HydrophobicContact CB-CG 4.24Å; K66-Y81 HydrophobicContact CD-CD1 3.75Å; K66-Y81 HydrophobicContact CD-CE1 4.24Å; K66-Y81 HydrophobicContact CD-CG 4.09Å; Y81-R83 HydrophobicContact CE1-CG 4.19Å
82	P	90.6	Very high	91.8	Very high	26 Å²	26	71.1 Å²	71.1	17%	0.169	36%	0.361	C	S	.	.			trans	-62.3	153.3	175.1	22.5	-27.8	0	0	0	111	L39 R119 Q460	L39-P82 HydrophobicContact CD1-CG 3.66Å; L39-P82 HydrophobicContact CD2-CG 4.48Å; P82-R119 WeakPolarHBondContact O-CD 3.38Å; P82-R119 PolarHBondContact O-NH1 2.04Å; P82-Q460 HydrophobicContact CB-CB 4.48Å; P82-Q460 VanDerWaalsContact CB-OE1 3.22Å
83	R	90.4	Very high	92.2	Very high	157 Å²	157	71 Å²	71	59%	0.592	37%	0.373	S	S	*	.			trans	-132	147	176.4	-77.5	-170	168.3	-176.3	-3.5	109.7	Y81 T85 D122 Q460	Y81-R83 HydrophobicContact CE1-CG 4.19Å; R83-T85 PolarHBondContact O-N 3.4Å; R83-D122 WeakPolarHBondContact CA-OD2 3.49Å; R83-Q460 PolarHBondContact O-OE1 3.11Å
84	S	93.1	Very high	92.4	Very high	17 Å²	17	70.1 Å²	70.1	12%	0.119	36%	0.357	C	S	.	.			trans	-63.1	133.3	173	-68.9	0	0	0	0	110.6	S117 L118 R119 D122	S84-S117 CarbonylContact C-O 3.55Å; S84-S117 WeakPolarHBondContact CA-O 3.3Å; S84-L118 WeakPolarHBondContact OG-CA 3.29Å; S84-R119 PolarHBondContact OG-N 2.77Å; S84-D122 WeakPolarHBondContact CB-O 3.24Å; S84-D122 PolarHBondContact N-OD2 2.99Å; S84-D122 WeakPolarHBondContact OG-CB 2.81Å; S84-D122 PolarHBondContact OG-O 2.99Å
85	T	93	Very high	92.2	Very high	77 Å²	77	71.3 Å²	71.3	47%	0.472	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	154.7	-179	59.6	0	0	0	0	111.6	R83 S117	R83-T85 PolarHBondContact O-N 3.4Å; T85-S117 PolarHBondContact N-O 3.19Å; T85-S117 PolarHBondContact O-N 3.21Å
86	I	94.1	Very high	91.7	Very high	59 Å²	59	71.8 Å²	71.8	30%	0.303	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.4	-179.9	-57	162.6	0	0	0	108.1	L116 T124 A125 F126	I86-L116 HydrophobicContact CB-CD2 4.21Å; I86-L116 HydrophobicContact CG1-CD2 3.64Å; I86-L116 HydrophobicContact CG2-CD2 3.97Å; I86-T124 HydrophobicContact CD1-CG2 4.01Å; I86-T124 VanDerWaalsContact CD1-OG1 3.22Å; I86-T124 WeakPolarHBondContact CD1-OG1 3.38Å; I86-T124 HydrophobicContact CG1-CG2 3.96Å; I86-A125 VanDerWaalsContact CD1-C 3.47Å; I86-A125 WeakPolarHBondContact CD1-O 3.1Å; I86-F126 HydrophobicContact CD1-CB 4.18Å; I86-F126 HydrophobicContact CG2-CB 4.47Å
87	S	94.8	Very high	91	Very high	53 Å²	53	73.5 Å²	73.5	37%	0.371	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.3	171.6	61.2	0	0	0	0	109.9	I114 S115	S87-I114 CarbonylContact O-C 3.52Å; S87-I114 WeakPolarHBondContact O-CA 3.06Å; S87-S115 PolarHBondContact N-O 3.12Å; S87-S115 PolarHBondContact O-N 2.91Å; S87-S115 WeakPolarHBondContact OG-CB 3.24Å; S87-S115 PolarHBondContact OG-O 3.13Å
88	I	95.3	Very high	89.8	Confident	103 Å²	103	64.9 Å²	64.9	53%	0.528	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.1	177	-56.6	173.5	0	0	0	107.7	N91 P111 I114	I88-N91 HydrophobicContact CG2-CB 3.74Å; I88-P111 HydrophobicContact CG2-CB 3.84Å; I88-I114 HydrophobicContact CG1-CG2 4.27Å; I88-I114 HydrophobicContact CG2-CG2 4.41Å
89	L	95.5	Very high	88.3	Confident	96 Å²	96	63.2 Å²	63.2	50%	0.503	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-35.6	-176.6	-58.3	-178.3	0	0	0	111.9	R113	L89-R113 WeakPolarHBondContact CA-O 3.01Å; L89-R113 HydrophobicContact CB-CB 4.25Å; L89-R113 HydrophobicContact CB-CG 4.14Å; L89-R113 HydrophobicContact CD1-CG 4.15Å; L89-R113 PolarHBondContact N-O 2.79Å
90	Q	94.9	Very high	86.5	Confident	97 Å²	97	64 Å²	64	45%	0.453	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	127.1	177.7	-168.8	-179.4	-1.7	0	0	110.8	P111 Q112 R113	Q90-P111 VanDerWaalsContact O-CB 3.29Å; Q90-P111 WeakPolarHBondContact O-CB 3.47Å; Q90-Q112 HydrophobicContact CB-CB 4.38Å; Q90-Q112 HydrophobicContact CG-CB 4.22Å; Q90-Q112 PolarHBondContact O-N 2.98Å; Q90-Q112 PolarHBondContact O-OE1 2.91Å; Q90-R113 HydrophobicContact CB-CB 3.82Å; Q90-R113 PolarHBondContact N-O 2.95Å; Q90-R113 PolarHBondContact O-N 3.15Å
91	N	94.1	Very high	84.4	Confident	84 Å²	84	70.2 Å²	70.2	45%	0.449	39%	0.394	S	S	.	.			trans	-145.7	62.8	-175.2	-166.8	28.9	0	0	0	112.5	I88 M110 P111 Q112	I88-N91 HydrophobicContact CG2-CB 3.74Å; N91-M110 VanDerWaalsContact OD1-CE 3.22Å; N91-M110 WeakPolarHBondContact OD1-CE 3.26Å; N91-P111 HydrophobicContact CB-CB 4.26Å; N91-Q112 VanDerWaalsContact CA-OE1 3.29Å
92	S	93.3	Very high	82.4	Confident	45 Å²	45	71.6 Å²	71.6	32%	0.315	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-67.3	139.5	171.8	-59.8	0	0	0	0	110.4	Q112	S92-Q112 PolarHBondContact O-NE2 2.88Å
93	P	92.3	Very high	80.6	Confident	100 Å²	100	75.5 Å²	75.5	65%	0.649	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-70.7	152.9	-179	29.8	-35.3	0	0	0	112.2	V107	P93-V107 WeakPolarHBondContact O-CB 3.24Å
94	L	90.8	Very high	78.9	Confident	28 Å²	28	76.4 Å²	76.4	15%	0.147	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-65.4	132.1	177.8	-64.5	165	0	0	0	111.8	V107 Q108 M110 Q129 R131 T421	L94-V107 WeakPolarHBondContact CA-O 3.36Å; L94-Q108 VanDerWaalsContact CD2-O 3.28Å; L94-Q108 WeakPolarHBondContact CD2-O 3.25Å; L94-M110 HydrophobicContact CD1-CG 3.99Å; L94-M110 HydrophobicContact CD1-SD 3.88Å; L94-M110 HydrophobicContact CD2-CB 4.37Å; L94-M110 HydrophobicContact CD2-CG 4.1Å; L94-M110 HydrophobicContact CG-CB 4.37Å; L94-M110 HydrophobicContact CG-CG 3.76Å; L94-M110 HydrophobicContact CG-SD 3.7Å; L94-Q129 HydrophobicContact CD1-CB 4Å; L94-R131 HydrophobicContact CB-CB 4.35Å; L94-R131 HydrophobicContact CD1-CB 3.95Å; L94-R131 HydrophobicContact CD2-CB 4.13Å; L94-R131 HydrophobicContact CG-CB 4.37Å; L94-T421 HydrophobicContact CD1-CG2 3.81Å
95	S	86.7	Confident	77.8	Confident	28 Å²	28	82.1 Å²	82.1	20%	0.196	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-71	151.2	176.1	-62.5	0	0	0	0	111.7	V107	S95-V107 PolarHBondContact N-O 3.19Å; S95-V107 PolarHBondContact OG-N 2.93Å
96	T	79.8	Confident	77.3	Confident	91 Å²	91	79.2 Å²	79.2	56%	0.558	45%	0.448	S	S	*	.	S	Bend	trans	-95	-38.6	178.2	49.1	0	0	0	0	112.9
97	K	73.9	Confident	77	Confident	130 Å²	130	77.5 Å²	77.5	57%	0.565	44%	0.441	S	S	*	.	B	Isolated β-bridge	trans	-129.1	145.9	177.9	-69	-166.4	173.3	-168.1	0	111.7
98	G	64.8	Low	76.7	Confident	6 Å²	6	75 Å²	75	6%	0.062	42%	0.423	C	S	.	.	S	Bend	trans	-80.6	-19.7	178.1	0	0	0	0	0	113	E134	G98-E134 PolarHBondContact N-O 3.18Å
99	S	58.9	Low	76.6	Confident	38 Å²	38	70.1 Å²	70.1	27%	0.266	40%	0.398	S	S	.	.			trans	-116.4	108.5	-175.8	-52	0	0	0	0	111.1	D135 S173	S99-D135 WeakPolarHBondContact CB-OD2 3.49Å; S99-D135 PolarHBondContact OG-O 3.19Å; S99-D135 PolarHBondContact OG-OD2 3.4Å; S99-S173 PolarHBondContact OG-OG 3.4Å
100	G	56.1	Low	76.6	Confident	37 Å²	37	67.4 Å²	67.4	38%	0.381	38%	0.383	S	S	.	.	S	Bend	trans	-159.1	172.4	177	0	0	0	0	0	112	A102 Q103	G100-A102 CarbonylContact O-C 3.51Å; G100-A102 PolarHBondContact O-N 2.79Å; G100-Q103 PolarHBondContact O-N 2.9Å
101	P	47	Very low	76.6	Confident	151 Å²	151	63.1 Å²	63.1	98%	0.981	36%	0.364	S	S	*	.	S	Bend	trans	-63.1	-15.4	-175.5	23.2	-31.7	0	0	0	114.2
102	A	50.7	Low	76.7	Confident	81 Å²	81	60.1 Å²	60.1	67%	0.669	35%	0.347	S	S	*	.	S	Bend	trans	-100	73.1	165.6	0	0	0	0	0	109.1	G100 Y104	G100-A102 CarbonylContact O-C 3.51Å; G100-A102 PolarHBondContact O-N 2.79Å; A102-Y104 PolarHBondContact O-N 3.09Å
103	Q	52.5	Low	76.8	Confident	108 Å²	108	63.5 Å²	63.5	51%	0.505	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	9.5	-170.4	-152.8	170.3	2.8	0	0	114.7	G100	G100-Q103 PolarHBondContact O-N 2.9Å
104	Y	55.7	Low	77	Confident	175 Å²	175	58.8 Å²	58.8	69%	0.686	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	2.4	-162.6	-66.4	-72.8	0	0	0	116.1	A102	A102-Y104 PolarHBondContact O-N 3.09Å
105	D	69.8	Low	77.3	Confident	137 Å²	137	59.1 Å²	59.1	73%	0.733	33%	0.327	S	S	*	.			trans	-138.9	57.8	-179.3	-80.9	-40.5	0	0	0	111.5	V107	D105-V107 PolarHBondContact O-N 3.34Å
106	V	82.3	Confident	77.6	Confident	16 Å²	16	57.8 Å²	57.8	10%	0.097	32%	0.318	C	S	.	.			trans	-76.2	115.4	170.9	-176.3	0	0	0	0	108.8	Q108 V133 Y136	V106-Q108 HydrophobicContact CG1-CG 4Å; V106-V133 HydrophobicContact CG1-CB 4.15Å; V106-V133 HydrophobicContact CG1-CG1 3.96Å; V106-V133 HydrophobicContact CG1-CG2 3.86Å; V106-Y136 HydrophobicContact CB-CE2 4.29Å; V106-Y136 HydrophobicContact CG1-CD2 4.19Å; V106-Y136 HydrophobicContact CG1-CE2 3.94Å
107	V	88.4	Confident	78.2	Confident	23 Å²	23	54.2 Å²	54.2	14%	0.139	30%	0.296	C	S	.	.			trans	-102.3	116.4	178.7	-178.2	0	0	0	0	109.8	P93 L94 S95 D105 I109 D451	P93-V107 WeakPolarHBondContact O-CB 3.24Å; L94-V107 WeakPolarHBondContact CA-O 3.36Å; S95-V107 PolarHBondContact N-O 3.19Å; S95-V107 PolarHBondContact OG-N 2.93Å; D105-V107 PolarHBondContact O-N 3.34Å; V107-I109 VanDerWaalsContact CG1-O 3.28Å; V107-I109 WeakPolarHBondContact CG1-O 2.98Å; V107-D451 WeakPolarHBondContact CA-OD2 3.36Å
108	Q	89.1	Confident	79	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.269	C	S	.	.			trans	-112	-10.9	-176.8	-54	-167.2	-97.8	0	0	113.2	L94 V106 V130 R131 V133 Y136 F449 D451	L94-Q108 VanDerWaalsContact CD2-O 3.28Å; L94-Q108 WeakPolarHBondContact CD2-O 3.25Å; V106-Q108 HydrophobicContact CG1-CG 4Å; Q108-V130 WeakPolarHBondContact O-CA 3.29Å; Q108-R131 PolarHBondContact O-N 3.41Å; Q108-V133 HydrophobicContact CG-CG2 3.76Å; Q108-Y136 PolarHBondContact OE1-OH 3.27Å; Q108-F449 HydrophobicContact CB-CD1 3.7Å; Q108-F449 HydrophobicContact CB-CE1 3.9Å; Q108-F449 HydrophobicContact CG-CD1 4.24Å; Q108-F449 HydrophobicContact CG-CE1 4.37Å; Q108-D451 PolarHBondContact N-OD2 3.31Å
109	I	92.8	Very high	80.2	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.6	178	-156.3	175.4	0	0	0	110.6	V107 Q112 L128 Q129 V130 P446 D451 L453	V107-I109 VanDerWaalsContact CG1-O 3.28Å; V107-I109 WeakPolarHBondContact CG1-O 2.98Å; I109-Q112 HydrophobicContact CG2-CG 4.4Å; I109-Q112 PolarHBondContact O-NE2 2.87Å; I109-L128 HydrophobicContact CD1-CD1 3.69Å; I109-L128 HydrophobicContact CD1-CD2 4.23Å; I109-L128 HydrophobicContact CD1-CG 4.36Å; I109-L128 HydrophobicContact CG1-CD1 3.55Å; I109-L128 HydrophobicContact CG1-CD2 4.5Å; I109-L128 HydrophobicContact CG1-CG 4.17Å; I109-Q129 WeakPolarHBondContact CA-O 3.31Å; I109-V130 HydrophobicContact CG1-CG2 4.29Å; I109-P446 HydrophobicContact CD1-CG 4.19Å; I109-D451 HydrophobicContact CB-CB 4.16Å; I109-D451 HydrophobicContact CG2-CB 3.6Å; I109-L453 HydrophobicContact CD1-CB 4.14Å
110	M	94.1	Very high	81.5	Confident	39 Å²	39	46.4 Å²	46.4	19%	0.192	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	141.9	168.6	67.3	176.6	-65.2	0	0	111.4	N91 L94 Q129	N91-M110 VanDerWaalsContact OD1-CE 3.22Å; N91-M110 WeakPolarHBondContact OD1-CE 3.26Å; L94-M110 HydrophobicContact CD1-CG 3.99Å; L94-M110 HydrophobicContact CD1-SD 3.88Å; L94-M110 HydrophobicContact CD2-CB 4.37Å; L94-M110 HydrophobicContact CD2-CG 4.1Å; L94-M110 HydrophobicContact CG-CB 4.37Å; L94-M110 HydrophobicContact CG-CG 3.76Å; L94-M110 HydrophobicContact CG-SD 3.7Å; M110-Q129 HydrophobicContact CG-CB 3.91Å; M110-Q129 PolarHBondContact N-O 3.01Å; M110-Q129 PolarHBondContact O-N 3.31Å
111	P	96.4	Very high	82.6	Confident	8 Å²	8	45.9 Å²	45.9	5%	0.052	25%	0.251	C	S	.	.			cis	-68.7	170.7	-9	30.4	-34.7	0	0	0	112.6	I88 Q90 N91 I114 S127 L453	I88-P111 HydrophobicContact CG2-CB 3.84Å; Q90-P111 VanDerWaalsContact O-CB 3.29Å; Q90-P111 WeakPolarHBondContact O-CB 3.47Å; N91-P111 HydrophobicContact CB-CB 4.26Å; P111-I114 HydrophobicContact CB-CG2 4.21Å; P111-I114 HydrophobicContact CG-CG2 3.7Å; P111-S127 WeakPolarHBondContact CD-O 3.41Å; P111-L453 HydrophobicContact CG-CD1 4.22Å; P111-L453 WeakPolarHBondContact O-CD1 3.39Å
112	Q	94.9	Very high	84.5	Confident	21 Å²	21	40.4 Å²	40.4	10%	0.098	21%	0.214	C	C	.	.	S	Bend	trans	-100.3	-27.1	178.4	-58	77.1	28.1	0	0	112.6	Q90 N91 S92 I109 L453 E454	Q90-Q112 HydrophobicContact CB-CB 4.38Å; Q90-Q112 HydrophobicContact CG-CB 4.22Å; Q90-Q112 PolarHBondContact O-N 2.98Å; Q90-Q112 PolarHBondContact O-OE1 2.91Å; N91-Q112 VanDerWaalsContact CA-OE1 3.29Å; S92-Q112 PolarHBondContact O-NE2 2.88Å; I109-Q112 HydrophobicContact CG2-CG 4.4Å; I109-Q112 PolarHBondContact O-NE2 2.87Å; Q112-L453 WeakPolarHBondContact O-CA 3.47Å; Q112-E454 PolarHBondContact O-N 3.03Å
113	R	96.8	Very high	86.2	Confident	116 Å²	116	42.1 Å²	42.1	44%	0.438	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	130.3	178.6	-166.9	172.9	167.8	179.1	-0.7	112	L89 Q90 E454	L89-R113 WeakPolarHBondContact CA-O 3.01Å; L89-R113 HydrophobicContact CB-CB 4.25Å; L89-R113 HydrophobicContact CB-CG 4.14Å; L89-R113 HydrophobicContact CD1-CG 4.15Å; L89-R113 PolarHBondContact N-O 2.79Å; Q90-R113 HydrophobicContact CB-CB 3.82Å; Q90-R113 PolarHBondContact N-O 2.95Å; Q90-R113 PolarHBondContact O-N 3.15Å; R113-E454 WeakPolarHBondContact CA-O 3.47Å; R113-E454 HydrophobicContact CG-CB 4.15Å
114	I	96.4	Very high	88.1	Confident	1 Å²	1	38 Å²	38	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.2	175.4	66.4	177.8	0	0	0	110.8	S87 I88 P111 L116 F126 L453 E454 V455 A456	S87-I114 CarbonylContact O-C 3.52Å; S87-I114 WeakPolarHBondContact O-CA 3.06Å; I88-I114 HydrophobicContact CG1-CG2 4.27Å; I88-I114 HydrophobicContact CG2-CG2 4.41Å; P111-I114 HydrophobicContact CB-CG2 4.21Å; P111-I114 HydrophobicContact CG-CG2 3.7Å; I114-L116 HydrophobicContact CD1-CD2 4.12Å; I114-L116 HydrophobicContact CD1-CG 4.44Å; I114-F126 HydrophobicContact CD1-CD1 3.55Å; I114-F126 HydrophobicContact CD1-CD2 3.85Å; I114-F126 HydrophobicContact CD1-CE1 3.5Å; I114-F126 HydrophobicContact CD1-CE2 3.84Å; I114-F126 HydrophobicContact CD1-CG 3.71Å; I114-F126 HydrophobicContact CD1-CZ 3.66Å; I114-L453 HydrophobicContact CD1-CD1 4.45Å; I114-L453 HydrophobicContact CD1-CD2 4.2Å; I114-L453 HydrophobicContact CG1-CD1 4.08Å; I114-L453 HydrophobicContact CG2-CD1 4.06Å; I114-E454 PolarHBondContact N-O 2.8Å; I114-V455 HydrophobicContact CD1-CB 4.46Å; I114-V455 HydrophobicContact CD1-CG1 3.99Å; I114-V455 HydrophobicContact CD1-CG2 3.89Å; I114-V455 HydrophobicContact CG1-CB 4.15Å; I114-V455 HydrophobicContact CG1-CG1 3.9Å; I114-V455 HydrophobicContact CG1-CG2 3.88Å; I114-A456 PolarHBondContact O-N 2.85Å
115	S	95.4	Very high	89.9	Confident	34 Å²	34	32.5 Å²	32.5	24%	0.238	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.4	167.7	172.6	0	0	0	0	110.1	S87 A456	S87-S115 PolarHBondContact N-O 3.12Å; S87-S115 PolarHBondContact O-N 2.91Å; S87-S115 WeakPolarHBondContact OG-CB 3.24Å; S87-S115 PolarHBondContact OG-O 3.13Å; S115-A456 CarbonylContact C-O 3.56Å; S115-A456 VanDerWaalsContact CA-O 3.29Å; S115-A456 WeakPolarHBondContact CA-O 3.42Å
116	L	93.8	Very high	91.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	132.4	176.4	-57.2	-178.6	0	0	0	108.8	I86 I114 L118 F126 V428 V455 A456 V457 N458	I86-L116 HydrophobicContact CB-CD2 4.21Å; I86-L116 HydrophobicContact CG1-CD2 3.64Å; I86-L116 HydrophobicContact CG2-CD2 3.97Å; I114-L116 HydrophobicContact CD1-CD2 4.12Å; I114-L116 HydrophobicContact CD1-CG 4.44Å; L116-L118 HydrophobicContact CB-CD2 4.15Å; L116-L118 HydrophobicContact CB-CG 4.1Å; L116-F126 HydrophobicContact CD1-CE1 4.26Å; L116-F126 HydrophobicContact CD2-CD1 4.19Å; L116-V428 HydrophobicContact CD1-CB 4.15Å; L116-V428 HydrophobicContact CD1-CG1 3.89Å; L116-V428 HydrophobicContact CD1-CG2 3.96Å; L116-V455 HydrophobicContact CD1-CG1 3.41Å; L116-V455 VanDerWaalsContact CD1-CG1 3.41Å; L116-V455 HydrophobicContact CG-CG1 3.72Å; L116-A456 PolarHBondContact N-O 3.35Å; L116-V457 HydrophobicContact CD1-CG2 4.4Å; L116-N458 PolarHBondContact O-N 3.23Å
117	S	92.4	Very high	91.7	Very high	16 Å²	16	28.5 Å²	28.5	11%	0.112	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	108.7	165.4	-158.5	0	0	0	0	107.7	S84 T85 N458 Q460	S84-S117 CarbonylContact C-O 3.55Å; S84-S117 WeakPolarHBondContact CA-O 3.3Å; T85-S117 PolarHBondContact N-O 3.19Å; T85-S117 PolarHBondContact O-N 3.21Å; S117-N458 CarbonylContact C-O 3.57Å; S117-N458 VanDerWaalsContact CA-O 3.24Å; S117-N458 WeakPolarHBondContact CA-O 3.48Å; S117-Q460 WeakPolarHBondContact OG-CG 3.49Å; S117-Q460 PolarHBondContact OG-NE2 2.91Å
118	L	90.8	Very high	92	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.3	-167.9	-60.4	179.3	0	0	0	110.8	S84 L116 T124 V428 A430 V457 N458 Q460	S84-L118 WeakPolarHBondContact OG-CA 3.29Å; L116-L118 HydrophobicContact CB-CD2 4.15Å; L116-L118 HydrophobicContact CB-CG 4.1Å; L118-T124 HydrophobicContact CD2-CG2 3.55Å; L118-V428 HydrophobicContact CD1-CG1 3.73Å; L118-V428 HydrophobicContact CD2-CG1 4.49Å; L118-A430 HydrophobicContact CB-CB 3.87Å; L118-A430 HydrophobicContact CD1-CB 4.09Å; L118-V457 HydrophobicContact CD1-CG1 3.69Å; L118-V457 HydrophobicContact CG-CG1 4.18Å; L118-N458 PolarHBondContact N-O 2.79Å; L118-Q460 PolarHBondContact O-N 3.47Å
119	R	89.9	Confident	92.2	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	17%	0.174	C	C	.	.			trans	-89.7	133.9	162.6	172.9	-178.3	177.7	176.7	-3.4	108.4	L39 H42 P43 C45 P82 S84 G121 D122	L39-R119 PolarHBondContact O-NH2 2.89Å; H42-R119 PolarHBondContact O-NH2 3.27Å; P43-R119 PolarHBondContact O-NH1 2.64Å; P43-R119 VanDerWaalsContact O-NH1 3.12Å; C45-R119 PolarHBondContact O-NH1 2.93Å; C45-R119 PolarHBondContact O-NH2 2.88Å; P82-R119 WeakPolarHBondContact O-CD 3.38Å; P82-R119 PolarHBondContact O-NH1 2.04Å; S84-R119 PolarHBondContact OG-N 2.77Å; R119-G121 PolarHBondContact O-N 3.23Å; R119-D122 HydrophobicContact CB-CB 3.92Å; R119-D122 HydrophobicContact CG-CB 4.24Å; R119-D122 WeakPolarHBondContact O-CB 2.99Å; R119-D122 PolarHBondContact O-N 2.8Å
120	P	86.1	Confident	92.2	Very high	9 Å²	9	31.2 Å²	31.2	6%	0.058	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-53.1	132.5	176.1	-26.4	33.7	0	0	0	112.7	L40 D122 A430 C433	L40-P120 HydrophobicContact CD2-CB 4.01Å; L40-P120 HydrophobicContact CD2-CG 3.83Å; P120-D122 PolarHBondContact O-N 3.04Å; P120-A430 CarbonylContact C-O 3.07Å; P120-A430 VanDerWaalsContact CA-O 3.31Å; P120-A430 WeakPolarHBondContact CA-O 3.32Å; P120-C433 WeakPolarHBondContact CG-SG 3.01Å
121	G	80.2	Confident	92	Very high	26 Å²	26	32.1 Å²	32.1	27%	0.268	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-8.2	-175.5	0	0	0	0	0	115.9	P43 R119 A430	P43-G121 WeakPolarHBondContact CG-O 3.32Å; R119-G121 PolarHBondContact O-N 3.23Å; G121-A430 PolarHBondContact N-O 3.13Å
122	D	85.9	Confident	91.5	Very high	37 Å²	37	31.8 Å²	31.8	20%	0.198	17%	0.173	C	C	.	.			trans	-93.5	101	178.6	-168.4	27.8	0	0	0	110.8	P43 R83 S84 R119 P120	P43-D122 HydrophobicContact CB-CB 3.83Å; R83-D122 WeakPolarHBondContact CA-OD2 3.49Å; S84-D122 WeakPolarHBondContact CB-O 3.24Å; S84-D122 PolarHBondContact N-OD2 2.99Å; S84-D122 WeakPolarHBondContact OG-CB 2.81Å; S84-D122 PolarHBondContact OG-O 2.99Å; R119-D122 HydrophobicContact CB-CB 3.92Å; R119-D122 HydrophobicContact CG-CB 4.24Å; R119-D122 WeakPolarHBondContact O-CB 2.99Å; R119-D122 PolarHBondContact O-N 2.8Å; P120-D122 PolarHBondContact O-N 3.04Å
123	Q	87.3	Confident	90.9	Very high	116 Å²	116	30.8 Å²	30.8	54%	0.542	17%	0.168	S	C	.	.			trans	-70	133.9	-177.1	-172.7	179.1	11.6	0	0	112	S427 E429	Q123-S427 VanDerWaalsContact CD-OG 3.31Å; Q123-S427 WeakPolarHBondContact CG-OG 3.28Å; Q123-S427 PolarHBondContact NE2-OG 3.32Å; Q123-E429 HydrophobicContact CB-CB 4.47Å
124	T	92.1	Very high	90.1	Very high	23 Å²	23	29.2 Å²	29.2	14%	0.141	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	167.2	172.4	-158.6	0	0	0	0	110.9	I86 L118 S427 V428	I86-T124 HydrophobicContact CD1-CG2 4.01Å; I86-T124 VanDerWaalsContact CD1-OG1 3.22Å; I86-T124 WeakPolarHBondContact CD1-OG1 3.38Å; I86-T124 HydrophobicContact CG1-CG2 3.96Å; L118-T124 HydrophobicContact CD2-CG2 3.55Å; T124-S427 CarbonylContact O-C 3.49Å; T124-S427 VanDerWaalsContact O-CA 3.26Å; T124-S427 WeakPolarHBondContact O-CA 3.22Å; T124-S427 PolarHBondContact O-OG 2.94Å; T124-V428 HydrophobicContact CG2-CB 4.42Å; T124-V428 PolarHBondContact N-O 2.99Å; T124-V428 PolarHBondContact O-N 2.86Å
125	A	92.8	Very high	89.4	Confident	58 Å²	58	31.2 Å²	31.2	48%	0.479	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	142.5	-179.6	0	0	0	0	0	112.8	I86 V426	I86-A125 VanDerWaalsContact CD1-C 3.47Å; I86-A125 WeakPolarHBondContact CD1-O 3.1Å; A125-V426 CarbonylContact C-O 3.47Å; A125-V426 VanDerWaalsContact CA-O 3.23Å; A125-V426 WeakPolarHBondContact CA-O 3.06Å
126	F	94.9	Very high	88.8	Confident	16 Å²	16	30 Å²	30	7%	0.07	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.1	173	62.2	-94.5	0	0	0	110.7	I86 I114 L116 V426 V428 I444 L453 V455	I86-F126 HydrophobicContact CD1-CB 4.18Å; I86-F126 HydrophobicContact CG2-CB 4.47Å; I114-F126 HydrophobicContact CD1-CD1 3.55Å; I114-F126 HydrophobicContact CD1-CD2 3.85Å; I114-F126 HydrophobicContact CD1-CE1 3.5Å; I114-F126 HydrophobicContact CD1-CE2 3.84Å; I114-F126 HydrophobicContact CD1-CG 3.71Å; I114-F126 HydrophobicContact CD1-CZ 3.66Å; L116-F126 HydrophobicContact CD1-CE1 4.26Å; L116-F126 HydrophobicContact CD2-CD1 4.19Å; F126-V426 HydrophobicContact CD2-CB 4.22Å; F126-V426 HydrophobicContact CD2-CG2 4.48Å; F126-V426 HydrophobicContact CE1-CB 4.1Å; F126-V426 HydrophobicContact CE1-CG1 4.14Å; F126-V426 HydrophobicContact CE2-CB 3.72Å; F126-V426 HydrophobicContact CE2-CG1 4.32Å; F126-V426 HydrophobicContact CE2-CG2 3.83Å; F126-V426 HydrophobicContact CZ-CB 3.66Å; F126-V426 HydrophobicContact CZ-CG1 3.78Å; F126-V426 HydrophobicContact CZ-CG2 4.14Å; F126-V426 PolarHBondContact N-O 3.22Å; F126-V426 PolarHBondContact O-N 2.94Å; F126-V428 HydrophobicContact CD1-CG2 4.13Å; F126-V428 HydrophobicContact CE1-CG2 3.54Å; F126-V428 HydrophobicContact CZ-CG2 4.49Å; F126-I444 HydrophobicContact CE2-CD1 4.2Å; F126-I444 HydrophobicContact CZ-CD1 3.8Å; F126-L453 HydrophobicContact CD2-CD2 4.16Å; F126-L453 HydrophobicContact CE2-CD2 3.41Å; F126-L453 VanDerWaalsContact CE2-CD2 3.41Å; F126-L453 HydrophobicContact CZ-CD2 4.03Å; F126-V455 HydrophobicContact CZ-CG2 4.3Å
127	S	94.5	Very high	88.5	Confident	54 Å²	54	30.5 Å²	30.5	38%	0.378	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.9	178	-158.8	0	0	0	0	110.7	P111 D425	P111-S127 WeakPolarHBondContact CD-O 3.41Å; S127-D425 WeakPolarHBondContact CB-OD1 3.15Å; S127-D425 PolarHBondContact OG-OD1 3.33Å
128	L	94.4	Very high	88.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.5	176.9	-179.5	77.7	0	0	0	108.4	I109 V130 L384 S423 F424 I444 L453	I109-L128 HydrophobicContact CD1-CD1 3.69Å; I109-L128 HydrophobicContact CD1-CD2 4.23Å; I109-L128 HydrophobicContact CD1-CG 4.36Å; I109-L128 HydrophobicContact CG1-CD1 3.55Å; I109-L128 HydrophobicContact CG1-CD2 4.5Å; I109-L128 HydrophobicContact CG1-CG 4.17Å; L128-V130 HydrophobicContact CD2-CG2 4.19Å; L128-V130 HydrophobicContact CG-CG2 4.39Å; L128-L384 HydrophobicContact CD2-CD1 3.62Å; L128-L384 HydrophobicContact CD2-CD2 3.78Å; L128-L384 HydrophobicContact CD2-CG 4.37Å; L128-S423 CarbonylContact O-C 2.84Å; L128-S423 VanDerWaalsContact O-CA 3.27Å; L128-S423 WeakPolarHBondContact O-CA 3.39Å; L128-F424 HydrophobicContact CB-CB 4.41Å; L128-F424 PolarHBondContact N-O 3.1Å; L128-F424 PolarHBondContact O-N 2.83Å; L128-I444 HydrophobicContact CD2-CG2 4.11Å; L128-L453 HydrophobicContact CD1-CB 4.01Å; L128-L453 HydrophobicContact CD1-CD2 3.74Å; L128-L453 HydrophobicContact CD1-CG 4.45Å
129	Q	94.5	Very high	88.6	Confident	79 Å²	79	29.8 Å²	29.8	37%	0.369	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.1	171.6	-62.5	-177.5	23.6	0	0	110.5	L94 I109 M110 T421 V422	L94-Q129 HydrophobicContact CD1-CB 4Å; I109-Q129 WeakPolarHBondContact CA-O 3.31Å; M110-Q129 HydrophobicContact CG-CB 3.91Å; M110-Q129 PolarHBondContact N-O 3.01Å; M110-Q129 PolarHBondContact O-N 3.31Å; Q129-T421 HydrophobicContact CB-CG2 4.17Å; Q129-V422 WeakPolarHBondContact CA-O 3.45Å
130	V	93.3	Very high	88.8	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.8	177.5	-173.9	0	0	0	0	108.3	Q108 I109 L128 V382 L384 T421 V422 F424 P446 F449	Q108-V130 WeakPolarHBondContact O-CA 3.29Å; I109-V130 HydrophobicContact CG1-CG2 4.29Å; L128-V130 HydrophobicContact CD2-CG2 4.19Å; L128-V130 HydrophobicContact CG-CG2 4.39Å; V130-V382 HydrophobicContact CB-CG1 4Å; V130-V382 HydrophobicContact CG1-CG1 3.73Å; V130-V382 HydrophobicContact CG1-CG2 4.37Å; V130-V382 HydrophobicContact CG2-CG1 4.31Å; V130-L384 HydrophobicContact CG2-CD2 4.09Å; V130-T421 WeakPolarHBondContact O-CA 3.42Å; V130-V422 HydrophobicContact CB-CG2 4.16Å; V130-V422 PolarHBondContact N-O 3.15Å; V130-V422 PolarHBondContact O-N 3.2Å; V130-F424 HydrophobicContact CG2-CD2 4.24Å; V130-F424 HydrophobicContact CG2-CE2 4.12Å; V130-P446 HydrophobicContact CB-CG 4.49Å; V130-P446 HydrophobicContact CG1-CB 4.21Å; V130-P446 HydrophobicContact CG1-CG 3.72Å; V130-P446 HydrophobicContact CG2-CG 3.87Å; V130-F449 HydrophobicContact CG1-CE1 4.28Å
131	R	89.3	Confident	89.3	Confident	58 Å²	58	29.3 Å²	29.3	22%	0.219	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.4	176.9	-176.1	175.8	-166.5	168.1	4.5	111.8	L94 Q108 V133 G419 T421	L94-R131 HydrophobicContact CB-CB 4.35Å; L94-R131 HydrophobicContact CD1-CB 3.95Å; L94-R131 HydrophobicContact CD2-CB 4.13Å; L94-R131 HydrophobicContact CG-CB 4.37Å; Q108-R131 PolarHBondContact O-N 3.41Å; R131-V133 PolarHBondContact O-N 2.96Å; R131-G419 PolarHBondContact NE-O 2.94Å; R131-G419 PolarHBondContact NH2-O 3.11Å; R131-T421 HydrophobicContact CB-CG2 4.32Å; R131-T421 WeakPolarHBondContact CD-OG1 3.47Å; R131-T421 WeakPolarHBondContact CG-OG1 3.32Å
132	Q	84.8	Confident	90	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.009	15%	0.149	C	C	.	.			trans	-83.4	105.2	168	-63	-152.8	-3.4	0	0	110.7	R379 K381 V382 G419 E420 F449	Q132-R379 PolarHBondContact NE2-O 3.34Å; Q132-R379 PolarHBondContact OE1-O 2.77Å; Q132-K381 PolarHBondContact NE2-O 3.19Å; Q132-K381 VanDerWaalsContact NE2-O 3.11Å; Q132-V382 HydrophobicContact CG-CG2 4.01Å; Q132-G419 WeakPolarHBondContact O-CA 3.19Å; Q132-G419 PolarHBondContact O-N 3.2Å; Q132-E420 PolarHBondContact N-O 2.82Å; Q132-F449 HydrophobicContact CG-CZ 4.17Å
133	V	82.4	Confident	90.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.14	C	C	.	.			trans	-68.8	138.4	-177.6	176.5	0	0	0	0	110.6	V106 Q108 R131 R379	V106-V133 HydrophobicContact CG1-CB 4.15Å; V106-V133 HydrophobicContact CG1-CG1 3.96Å; V106-V133 HydrophobicContact CG1-CG2 3.86Å; Q108-V133 HydrophobicContact CG-CG2 3.76Å; R131-V133 PolarHBondContact O-N 2.96Å; V133-R379 PolarHBondContact O-NH2 3.39Å
134	E	80.6	Confident	90.9	Very high	83 Å²	83	20.8 Å²	20.8	39%	0.388	11%	0.114	S	C	.	.	B	Isolated β-bridge	trans	-67.2	146.3	173.9	-63.5	-176	178.7	0	0	110.4	G98 Y136 I418	G98-E134 PolarHBondContact N-O 3.18Å; E134-Y136 PolarHBondContact O-N 3.4Å; E134-I418 HydrophobicContact CB-CG2 4.43Å; E134-I418 HydrophobicContact CG-CG2 3.93Å
135	D	81.2	Confident	91.1	Very high	43 Å²	43	19.7 Å²	19.7	23%	0.23	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	44.1	174.6	-165.5	33.8	0	0	0	114	S99 T172 S173	S99-D135 WeakPolarHBondContact CB-OD2 3.49Å; S99-D135 PolarHBondContact OG-O 3.19Å; S99-D135 PolarHBondContact OG-OD2 3.4Å; D135-T172 VanDerWaalsContact OD1-CA 3.32Å; D135-T172 WeakPolarHBondContact OD1-CA 3.34Å; D135-S173 VanDerWaalsContact CG-OG 3.26Å; D135-S173 PolarHBondContact OD1-N 2.96Å; D135-S173 PolarHBondContact OD1-OG 3.04Å; D135-S173 VanDerWaalsContact OD1-OG 3.11Å; D135-S173 PolarHBondContact OD2-OG 2.97Å
136	Y	83	Confident	91.3	Very high	7 Å²	7	17 Å²	17	3%	0.027	9%	0.085	C	C	.	.			trans	-75.3	141.8	176.5	-160.5	-103.1	0	0	0	110.8	V106 Q108 E134 T172 Y270	V106-Y136 HydrophobicContact CB-CE2 4.29Å; V106-Y136 HydrophobicContact CG1-CD2 4.19Å; V106-Y136 HydrophobicContact CG1-CE2 3.94Å; Q108-Y136 PolarHBondContact OE1-OH 3.27Å; E134-Y136 PolarHBondContact O-N 3.4Å; Y136-T172 PolarHBondContact O-OG1 2.94Å; Y136-Y270 AromaticContact CD1-CD2 3.49Å; Y136-Y270 HydrophobicContact CD1-CD2 3.49Å; Y136-Y270 VanDerWaalsContact CD1-CD2 3.49Å; Y136-Y270 AromaticContact CD1-CE2 3.59Å; Y136-Y270 HydrophobicContact CD1-CE2 3.59Å; Y136-Y270 HydrophobicContact CD1-CG 4.22Å; Y136-Y270 HydrophobicContact CE1-CD2 4.27Å; Y136-Y270 HydrophobicContact CE1-CE2 4.39Å; Y136-Y270 HydrophobicContact CG-CD2 4.31Å; Y136-Y270 HydrophobicContact CG-CE2 4.09Å
137	P	88.6	Confident	91.3	Very high	12 Å²	12	16.2 Å²	16.2	8%	0.078	8%	0.082	C	C	.	.			trans	-62.1	147.5	-179.7	-21.5	33.2	0	0	0	112.9	N174 E268 A269 Y270	P137-N174 WeakPolarHBondContact CA-O 3.47Å; P137-N174 HydrophobicContact CB-CB 4.18Å; P137-N174 HydrophobicContact CG-CB 4.37Å; P137-E268 WeakPolarHBondContact CG-O 3.42Å; P137-A269 HydrophobicContact CB-CB 3.99Å; P137-A269 CarbonylContact O-C 3.55Å; P137-A269 WeakPolarHBondContact O-CA 3.32Å; P137-Y270 PolarHBondContact O-N 2.84Å
138	V	90.4	Very high	91.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.7	179.5	-177.6	0	0	0	0	110	M168 T172 N174 F175 R176 R266 L272 Y375	V138-M168 HydrophobicContact CG1-CE 4.03Å; V138-T172 HydrophobicContact CB-CG2 4Å; V138-T172 HydrophobicContact CG2-CG2 3.76Å; V138-N174 PolarHBondContact N-O 3.34Å; V138-N174 VanDerWaalsContact N-O 3.11Å; V138-F175 HydrophobicContact CB-CD2 4.23Å; V138-F175 HydrophobicContact CG1-CD2 4.32Å; V138-F175 HydrophobicContact CG1-CE2 4.44Å; V138-F175 WeakPolarHBondContact O-CA 3.03Å; V138-R176 PolarHBondContact O-N 3.48Å; V138-R266 PolarHBondContact O-NH2 3.36Å; V138-R266 VanDerWaalsContact O-NH2 3.09Å; V138-L272 HydrophobicContact CG1-CD1 3.75Å; V138-L272 HydrophobicContact CG1-CG 4.11Å; V138-Y375 HydrophobicContact CG2-CD2 4.32Å; V138-Y375 HydrophobicContact CG2-CE2 3.52Å
139	D	93.6	Very high	91	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.5	169.3	-70.3	-12	0	0	0	108.1	R176 L223 W265 R266 A269 Y270 L272	D139-R176 WeakPolarHBondContact OD1-CB 3.01Å; D139-L223 HydrophobicContact CB-CD1 3.94Å; D139-L223 HydrophobicContact CB-CD2 4.02Å; D139-W265 HydrophobicContact CB-CE3 3.66Å; D139-W265 HydrophobicContact CB-CZ3 3.63Å; D139-R266 IonicContact OD1-CZ 3.74Å; D139-R266 IonicContact OD1-NE 2.98Å; D139-R266 PolarHBondContact OD1-NE 3.3Å; D139-R266 IonicContact OD1-NH2 3.2Å; D139-R266 PolarHBondContact OD1-NH2 3.04Å; D139-R266 WeakPolarHBondContact OD2-CB 3.44Å; D139-R266 WeakPolarHBondContact OD2-CG 3.45Å; D139-R266 PolarHBondContact OD2-N 3.43Å; D139-R266 IonicContact OD2-NE 2.68Å; D139-R266 PolarHBondContact OD2-NE 3.2Å; D139-A269 HydrophobicContact CB-CB 4.47Å; D139-Y270 PolarHBondContact N-O 2.94Å; D139-L272 PolarHBondContact O-N 3.33Å
140	L	94.6	Very high	90.9	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.6	175.7	-169.6	151.3	0	0	0	109.6	Y142 L164 F175 R176 L177 G178 L223 L272 V274 I371	L140-Y142 HydrophobicContact CD2-CD2 4.45Å; L140-L164 HydrophobicContact CD2-CD2 4.37Å; L140-F175 HydrophobicContact CB-CE2 3.66Å; L140-F175 HydrophobicContact CB-CZ 3.93Å; L140-F175 HydrophobicContact CD1-CE2 4.49Å; L140-R176 PolarHBondContact N-O 3.31Å; L140-L177 HydrophobicContact CB-CD1 4.28Å; L140-L177 HydrophobicContact CD2-CD1 3.47Å; L140-L177 VanDerWaalsContact CD2-CD1 3.47Å; L140-L177 HydrophobicContact CG-CD1 4.43Å; L140-L177 CarbonylContact O-C 3.54Å; L140-L177 WeakPolarHBondContact O-CA 3.37Å; L140-G178 PolarHBondContact O-N 3.38Å; L140-L223 WeakPolarHBondContact O-CD2 2.97Å; L140-L272 WeakPolarHBondContact CA-O 3.41Å; L140-L272 HydrophobicContact CD1-CD1 4.47Å; L140-L272 HydrophobicContact CG-CB 4.33Å; L140-V274 HydrophobicContact CD1-CG2 4.12Å; L140-V274 HydrophobicContact CD2-CG2 4.07Å; L140-V274 HydrophobicContact CG-CG2 4.11Å; L140-I371 HydrophobicContact CD1-CB 4.49Å; L140-I371 HydrophobicContact CD1-CD1 3.95Å; L140-I371 HydrophobicContact CD1-CG1 4.25Å; L140-I371 HydrophobicContact CD1-CG2 3.45Å; L140-I371 VanDerWaalsContact CD1-CG2 3.45Å
141	Y	96.6	Very high	90.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.1	172	-166.1	-94.9	0	0	0	109.3	L143 F179 G180 H219 A256 I263 W265 L272 L273 V274	Y141-L143 HydrophobicContact CD1-CB 4.38Å; Y141-L143 HydrophobicContact CE1-CB 4.45Å; Y141-L143 HydrophobicContact CE1-CD1 4.35Å; Y141-F179 PolarHBondContact OH-O 2.84Å; Y141-G180 VanDerWaalsContact OH-CA 3.26Å; Y141-G180 WeakPolarHBondContact OH-CA 3.42Å; Y141-G180 PolarHBondContact OH-N 3.3Å; Y141-H219 AromaticContact CE2-CE1 3.86Å; Y141-H219 AromaticContact CE2-ND1 3.66Å; Y141-H219 AromaticContact CZ-ND1 3.66Å; Y141-H219 PolarHBondContact OH-ND1 3.04Å; Y141-A256 HydrophobicContact CD1-CB 4.21Å; Y141-A256 HydrophobicContact CE1-CB 4.05Å; Y141-I263 HydrophobicContact CD2-CG2 3.53Å; Y141-I263 HydrophobicContact CE1-CD1 4.47Å; Y141-I263 HydrophobicContact CE2-CD1 3.84Å; Y141-I263 HydrophobicContact CE2-CG2 3.76Å; Y141-I263 HydrophobicContact CG-CG2 4.12Å; Y141-W265 VanDerWaalsContact CB-CH2 3.44Å; Y141-W265 HydrophobicContact CG-CZ2 4.36Å; Y141-L272 PolarHBondContact N-O 3.18Å; Y141-L273 HydrophobicContact CD1-CD1 3.65Å; Y141-L273 HydrophobicContact CG-CD1 4.35Å; Y141-V274 PolarHBondContact O-N 3.21Å
142	Y	95.2	Very high	90.6	Very high	1 Å²	1	16.7 Å²	16.7	0%	0.004	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	110.1	-179.7	-163	-78.3	0	0	0	109.5	L140 M144 I157 G178 F179 G180 V274 A276 V367	L140-Y142 HydrophobicContact CD2-CD2 4.45Å; Y142-M144 HydrophobicContact CD1-CB 4.02Å; Y142-M144 HydrophobicContact CE1-CB 3.84Å; Y142-M144 HydrophobicContact CE1-CG 4.05Å; Y142-M144 HydrophobicContact CE1-SD 4.37Å; Y142-I157 HydrophobicContact CE1-CD1 3.7Å; Y142-I157 VanDerWaalsContact OH-CD1 3.23Å; Y142-I157 WeakPolarHBondContact OH-CD1 3.29Å; Y142-G178 PolarHBondContact N-O 3.15Å; Y142-F179 HydrophobicContact CD1-CD2 4.02Å; Y142-F179 AromaticContact CD1-CE2 3.8Å; Y142-F179 HydrophobicContact CD1-CE2 3.8Å; Y142-F179 HydrophobicContact CE1-CE2 4.47Å; Y142-F179 HydrophobicContact CG-CD2 4.48Å; Y142-F179 WeakPolarHBondContact O-CA 3.1Å; Y142-G180 PolarHBondContact O-N 3.5Å; Y142-V274 HydrophobicContact CD2-CB 4.16Å; Y142-V274 HydrophobicContact CD2-CG1 4.08Å; Y142-V274 HydrophobicContact CE2-CG1 3.93Å; Y142-A276 HydrophobicContact CE1-CB 4.14Å; Y142-V367 HydrophobicContact CE2-CG2 3.91Å
143	L	97.3	Very high	90.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	109.9	-179	-176.1	59.1	0	0	0	109.5	Y141 F182 F217 A252 I253 L273 V274 F275 A276	Y141-L143 HydrophobicContact CD1-CB 4.38Å; Y141-L143 HydrophobicContact CE1-CB 4.45Å; Y141-L143 HydrophobicContact CE1-CD1 4.35Å; L143-F182 HydrophobicContact CD1-CD1 3.85Å; L143-F182 HydrophobicContact CD2-CD1 4.42Å; L143-F182 HydrophobicContact CG-CD1 3.79Å; L143-F182 HydrophobicContact CG-CE1 3.97Å; L143-F217 HydrophobicContact CD1-CD2 4.02Å; L143-F217 HydrophobicContact CD1-CE2 3.62Å; L143-A252 HydrophobicContact CD1-CB 3.99Å; L143-A252 HydrophobicContact CD2-CB 3.81Å; L143-A252 HydrophobicContact CG-CB 4.34Å; L143-I253 HydrophobicContact CD2-CG1 3.86Å; L143-L273 HydrophobicContact CB-CD1 3.98Å; L143-L273 HydrophobicContact CD2-CD1 4.36Å; L143-V274 WeakPolarHBondContact CA-O 3.37Å; L143-V274 WeakPolarHBondContact CB-O 3.48Å; L143-V274 PolarHBondContact N-O 3.4Å; L143-F275 HydrophobicContact CD2-CD2 3.96Å; L143-F275 HydrophobicContact CG-CD2 4.29Å; L143-A276 PolarHBondContact O-N 3.12Å
144	M	95.6	Very high	91	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.8	-169.8	-166.7	-177.5	171.3	0	0	112.3	Y142 L146 M150 D153 L154 I157 F179 G180 S181 F182	Y142-M144 HydrophobicContact CD1-CB 4.02Å; Y142-M144 HydrophobicContact CE1-CB 3.84Å; Y142-M144 HydrophobicContact CE1-CG 4.05Å; Y142-M144 HydrophobicContact CE1-SD 4.37Å; M144-L146 HydrophobicContact CE-CD2 4.15Å; M144-L146 HydrophobicContact CG-CD2 4.35Å; M144-L146 PolarHBondContact O-N 3.22Å; M144-L146 HydrophobicContact SD-CD2 3.95Å; M144-M150 HydrophobicContact CE-CB 4.25Å; M144-M150 HydrophobicContact CE-CE 4.01Å; M144-D153 HydrophobicContact CE-CB 3.77Å; M144-L154 HydrophobicContact CE-CB 3.98Å; M144-L154 HydrophobicContact SD-CD1 4.2Å; M144-I157 HydrophobicContact CE-CD1 3.61Å; M144-I157 HydrophobicContact CG-CD1 4.32Å; M144-I157 HydrophobicContact SD-CD1 3.39Å; M144-I157 WeakPolarHBondContact SD-CD1 3.45Å; M144-F179 HydrophobicContact CB-CE2 3.91Å; M144-F179 HydrophobicContact CB-CZ 3.94Å; M144-F179 HydrophobicContact SD-CE2 4.35Å; M144-F179 HydrophobicContact SD-CZ 4.23Å; M144-G180 PolarHBondContact N-O 2.94Å; M144-S181 VanDerWaalsContact O-CA 3.23Å; M144-S181 WeakPolarHBondContact O-CA 3.13Å; M144-F182 WeakPolarHBondContact O-CD1 3.06Å; M144-F182 PolarHBondContact O-N 3.38Å; M144-F182 VanDerWaalsContact O-N 3.08Å
145	D	96.6	Very high	91.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	125.4	163.6	-172.4	-8.6	0	0	0	110.4	S147 M150 F182 A276 T277	D145-S147 WeakPolarHBondContact OD1-CB 3.49Å; D145-S147 PolarHBondContact OD1-N 3.25Å; D145-S147 PolarHBondContact OD1-OG 2.8Å; D145-S147 VanDerWaalsContact OD1-OG 3.09Å; D145-M150 HydrophobicContact CB-CE 4.47Å; D145-M150 HydrophobicContact CB-CG 3.89Å; D145-M150 WeakPolarHBondContact O-CB 3.42Å; D145-M150 WeakPolarHBondContact O-CG 3.47Å; D145-F182 HydrophobicContact CB-CE1 4.15Å; D145-F182 HydrophobicContact CB-CE2 3.83Å; D145-F182 HydrophobicContact CB-CZ 3.56Å; D145-A276 VanDerWaalsContact CB-O 3.27Å; D145-A276 WeakPolarHBondContact CB-O 3.4Å; D145-A276 PolarHBondContact N-O 3.08Å; D145-T277 PolarHBondContact OD2-OG1 3.02Å
146	L	96.4	Very high	91.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.088	C	C	.	.			trans	-112.9	27.3	175.9	-69.6	-171.9	0	0	0	112	M144 L154 F182 V183 F215 Q237 V239 S240	M144-L146 HydrophobicContact CE-CD2 4.15Å; M144-L146 HydrophobicContact CG-CD2 4.35Å; M144-L146 PolarHBondContact O-N 3.22Å; M144-L146 HydrophobicContact SD-CD2 3.95Å; L146-L154 HydrophobicContact CD2-CD1 4.15Å; L146-L154 HydrophobicContact CD2-CD2 4.2Å; L146-F182 PolarHBondContact N-O 3.11Å; L146-V183 HydrophobicContact CB-CG2 4.29Å; L146-F215 HydrophobicContact CB-CZ 4.29Å; L146-F215 HydrophobicContact CD1-CZ 4.27Å; L146-Q237 HydrophobicContact CD1-CB 4.19Å; L146-V239 CarbonylContact O-C 3.41Å; L146-V239 VanDerWaalsContact O-CA 3.31Å; L146-V239 WeakPolarHBondContact O-CA 3.47Å; L146-V239 WeakPolarHBondContact O-CB 3.37Å; L146-S240 PolarHBondContact O-N 3.07Å
147	S	94.4	Very high	91.5	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.007	9%	0.087	C	C	.	.	S	Bend	trans	-56.9	167.3	162.5	70.8	0	0	0	0	111.2	D145 S149 M150 V239 S240 E247	D145-S147 WeakPolarHBondContact OD1-CB 3.49Å; D145-S147 PolarHBondContact OD1-N 3.25Å; D145-S147 PolarHBondContact OD1-OG 2.8Å; D145-S147 VanDerWaalsContact OD1-OG 3.09Å; S147-S149 PolarHBondContact O-N 2.99Å; S147-S149 PolarHBondContact OG-OG 3.39Å; S147-M150 PolarHBondContact O-N 3.28Å; S147-V239 WeakPolarHBondContact O-CG1 3.3Å; S147-S240 CarbonylContact C-O 3.59Å; S147-E247 WeakPolarHBondContact CB-OE1 3.23Å
148	L	92.1	Very high	91.2	Very high	20 Å²	20	17.9 Å²	17.9	11%	0.105	9%	0.094	C	C	.	.	S	Bend	trans	-67.6	-27.3	-172.1	-171.2	61	0	0	0	112.6	M150 Y205 F208 V239 S240 R241	L148-M150 VanDerWaalsContact C-N 3.33Å; L148-Y205 HydrophobicContact CD2-CD1 3.96Å; L148-Y205 HydrophobicContact CD2-CE1 3.95Å; L148-Y205 HydrophobicContact CD2-CG 4.37Å; L148-F208 HydrophobicContact CD1-CB 3.85Å; L148-F208 HydrophobicContact CD1-CD2 3.92Å; L148-F208 HydrophobicContact CD1-CG 4Å; L148-F208 HydrophobicContact CD2-CD2 4.23Å; L148-F208 HydrophobicContact CG-CD2 4.08Å; L148-V239 HydrophobicContact CD1-CG2 3.84Å; L148-S240 WeakPolarHBondContact CA-O 3.37Å; L148-S240 WeakPolarHBondContact CB-O 3.29Å; L148-S240 PolarHBondContact N-O 3.43Å; L148-S240 VanDerWaalsContact N-O 3.13Å; L148-R241 HydrophobicContact CB-CB 4.3Å; L148-R241 HydrophobicContact CB-CG 4.39Å; L148-R241 HydrophobicContact CD2-CG 4.32Å
149	S	90.8	Very high	90.4	Very high	55 Å²	55	23.8 Å²	23.8	39%	0.385	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-35.2	178.3	46	0	0	0	0	112.1	S147 K151 D152 D278	S147-S149 PolarHBondContact O-N 2.99Å; S147-S149 PolarHBondContact OG-OG 3.39Å; S149-K151 PolarHBondContact O-N 2.01Å; S149-D152 VanDerWaalsContact O-OD1 3.11Å; S149-D278 WeakPolarHBondContact CB-OD2 3.18Å; S149-D278 VanDerWaalsContact OG-CG 3.31Å; S149-D278 PolarHBondContact OG-OD1 2.95Å; S149-D278 PolarHBondContact OG-OD2 3.47Å; S149-D278 VanDerWaalsContact OG-OD2 3.05Å
150	M	91.8	Very high	89.5	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	16.7	-176.7	-61.8	-67.6	-63.7	0	0	114.6	M144 D145 S147 L148 D153 L154 D278	M144-M150 HydrophobicContact CE-CB 4.25Å; M144-M150 HydrophobicContact CE-CE 4.01Å; D145-M150 HydrophobicContact CB-CE 4.47Å; D145-M150 HydrophobicContact CB-CG 3.89Å; D145-M150 WeakPolarHBondContact O-CB 3.42Å; D145-M150 WeakPolarHBondContact O-CG 3.47Å; S147-M150 PolarHBondContact O-N 3.28Å; L148-M150 VanDerWaalsContact C-N 3.33Å; M150-D153 HydrophobicContact CE-CB 3.86Å; M150-L154 PolarHBondContact O-N 3.46Å; M150-L154 VanDerWaalsContact O-N 3.08Å; M150-D278 HydrophobicContact SD-CB 3.77Å; M150-D278 VanDerWaalsContact SD-OD1 3.42Å
151	K	89.8	Confident	88.7	Confident	46 Å²	46	24.5 Å²	24.5	20%	0.2	13%	0.129	C	C	.	.	H	α-helix	trans	-68.1	-39.7	-173.1	174.2	64.5	-155	70.4	0	112.6	S149 D155 F208 V239	S149-K151 PolarHBondContact O-N 2.01Å; K151-D155 IonicContact NZ-OD1 3.41Å; K151-D155 PolarHBondContact NZ-OD1 2Å; K151-D155 IonicContact NZ-OD2 2.7Å; K151-D155 PolarHBondContact NZ-OD2 2.04Å; K151-D155 PolarHBondContact O-N 3.22Å; K151-F208 HydrophobicContact CG-CD1 4.37Å; K151-F208 HydrophobicContact CG-CE1 3.93Å; K151-F208 HydrophobicContact CG-CZ 4.43Å; K151-V239 HydrophobicContact CB-CG1 4.04Å; K151-V239 HydrophobicContact CB-CG2 4.3Å; K151-V239 HydrophobicContact CD-CG1 4.07Å; K151-V239 HydrophobicContact CD-CG2 3.78Å; K151-V239 HydrophobicContact CG-CG2 4.48Å
152	D	87.5	Confident	88	Confident	80 Å²	80	27.1 Å²	27.1	43%	0.428	15%	0.146	S	C	.	.	H	α-helix	trans	-73.6	-39.3	176.7	52.7	-32.9	0	0	0	111.7	S149 L154 D155 T156	S149-D152 VanDerWaalsContact O-OD1 3.11Å; D152-L154 VanDerWaalsContact C-N 3.26Å; D152-L154 PolarHBondContact O-N 3.3Å; D152-D155 WeakPolarHBondContact O-CB 3.48Å; D152-D155 PolarHBondContact O-N 2.97Å; D152-T156 PolarHBondContact O-N 3.17Å; D152-T156 VanDerWaalsContact O-N 3.09Å
153	D	87.6	Confident	87.5	Confident	7 Å²	7	32.7 Å²	32.7	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-56.3	-41.8	171.1	-61.2	-90.4	0	0	0	112	M144 M150 D155 T156 I157 S364	M144-D153 HydrophobicContact CE-CB 3.77Å; M150-D153 HydrophobicContact CE-CB 3.86Å; D153-D155 VanDerWaalsContact C-N 3.25Å; D153-D155 PolarHBondContact O-N 3.46Å; D153-T156 PolarHBondContact O-N 2.88Å; D153-T156 VanDerWaalsContact O-N 3.12Å; D153-I157 WeakPolarHBondContact O-CG1 3.3Å; D153-I157 PolarHBondContact O-N 3.01Å; D153-S364 VanDerWaalsContact OD1-CB 3.3Å; D153-S364 WeakPolarHBondContact OD1-CB 3.48Å; D153-S364 PolarHBondContact OD1-N 3.5Å; D153-S364 PolarHBondContact OD1-OG 2.79Å
154	L	88.5	Confident	86.9	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-36.5	177.3	-178.8	61.5	0	0	0	111.4	M144 L146 M150 D152 I157 R158 V234 Q237 V239	M144-L154 HydrophobicContact CE-CB 3.98Å; M144-L154 HydrophobicContact SD-CD1 4.2Å; L146-L154 HydrophobicContact CD2-CD1 4.15Å; L146-L154 HydrophobicContact CD2-CD2 4.2Å; M150-L154 PolarHBondContact O-N 3.46Å; M150-L154 VanDerWaalsContact O-N 3.08Å; D152-L154 VanDerWaalsContact C-N 3.26Å; D152-L154 PolarHBondContact O-N 3.3Å; L154-I157 PolarHBondContact O-N 3.28Å; L154-R158 VanDerWaalsContact O-CG 3.24Å; L154-R158 WeakPolarHBondContact O-CG 3.36Å; L154-R158 PolarHBondContact O-N 2.83Å; L154-V234 HydrophobicContact CD1-CG1 3.94Å; L154-Q237 HydrophobicContact CD1-CB 4.27Å; L154-Q237 HydrophobicContact CD2-CB 4.39Å; L154-V239 HydrophobicContact CD2-CG1 4.28Å
155	D	85.7	Confident	86.3	Confident	68 Å²	68	33.5 Å²	33.5	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-69.8	-34.2	176.5	-68.5	-29.5	0	0	0	112.2	K151 D152 D153 R158 N159	K151-D155 IonicContact NZ-OD1 3.41Å; K151-D155 PolarHBondContact NZ-OD1 2Å; K151-D155 IonicContact NZ-OD2 2.7Å; K151-D155 PolarHBondContact NZ-OD2 2.04Å; K151-D155 PolarHBondContact O-N 3.22Å; D152-D155 WeakPolarHBondContact O-CB 3.48Å; D152-D155 PolarHBondContact O-N 2.97Å; D153-D155 VanDerWaalsContact C-N 3.25Å; D153-D155 PolarHBondContact O-N 3.46Å; D155-R158 IonicContact OD1-CZ 2.76Å; D155-R158 IonicContact OD1-NH1 2.77Å; D155-R158 PolarHBondContact OD1-NH1 3.45Å; D155-N159 PolarHBondContact O-ND2 2.61Å
156	T	84.3	Confident	85.8	Confident	32 Å²	32	39.7 Å²	39.7	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-67.6	-46.5	172.2	-59.9	0	0	0	0	111.6	D152 D153 R158 N159 D363 K365	D152-T156 PolarHBondContact O-N 3.17Å; D152-T156 VanDerWaalsContact O-N 3.09Å; D153-T156 PolarHBondContact O-N 2.88Å; D153-T156 VanDerWaalsContact O-N 3.12Å; T156-R158 VanDerWaalsContact C-N 3.29Å; T156-R158 PolarHBondContact O-N 2.84Å; T156-N159 PolarHBondContact O-N 2.67Å; T156-N159 VanDerWaalsContact O-N 3.12Å; T156-D363 WeakPolarHBondContact CB-O 3.49Å; T156-D363 VanDerWaalsContact CG2-O 3.26Å; T156-D363 WeakPolarHBondContact CG2-O 3.44Å; T156-D363 PolarHBondContact OG1-O 2.85Å; T156-K365 HydrophobicContact CG2-CG 4.13Å
157	I	83.6	Confident	85.4	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-30	-174.5	-67.6	163.6	0	0	0	112.1	Y142 M144 D153 L154 N159 L160 F230 V234	Y142-I157 HydrophobicContact CE1-CD1 3.7Å; Y142-I157 VanDerWaalsContact OH-CD1 3.23Å; Y142-I157 WeakPolarHBondContact OH-CD1 3.29Å; M144-I157 HydrophobicContact CE-CD1 3.61Å; M144-I157 HydrophobicContact CG-CD1 4.32Å; M144-I157 HydrophobicContact SD-CD1 3.39Å; M144-I157 WeakPolarHBondContact SD-CD1 3.45Å; D153-I157 WeakPolarHBondContact O-CG1 3.3Å; D153-I157 PolarHBondContact O-N 3.01Å; L154-I157 PolarHBondContact O-N 3.28Å; I157-N159 PolarHBondContact O-N 3.31Å; I157-L160 WeakPolarHBondContact O-CB 3.46Å; I157-L160 PolarHBondContact O-N 3.12Å; I157-F230 HydrophobicContact CG2-CE1 4.19Å; I157-F230 HydrophobicContact CG2-CZ 4.2Å; I157-V234 HydrophobicContact CG2-CG1 4.04Å
158	R	82.9	Confident	85	Confident	62 Å²	62	42.2 Å²	42.2	23%	0.234	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-26.3	172.7	-78.9	169	177.3	179.2	-10.7	113.9	L154 D155 T156 V234 Q235 Q237	L154-R158 VanDerWaalsContact O-CG 3.24Å; L154-R158 WeakPolarHBondContact O-CG 3.36Å; L154-R158 PolarHBondContact O-N 2.83Å; D155-R158 IonicContact OD1-CZ 2.76Å; D155-R158 IonicContact OD1-NH1 2.77Å; D155-R158 PolarHBondContact OD1-NH1 3.45Å; T156-R158 VanDerWaalsContact C-N 3.29Å; T156-R158 PolarHBondContact O-N 2.84Å; R158-V234 HydrophobicContact CG-CG1 3.8Å; R158-Q235 HydrophobicContact CB-CG 4.4Å; R158-Q235 HydrophobicContact CG-CG 4.1Å; R158-Q235 PolarHBondContact NH2-O 3.02Å; R158-Q237 PolarHBondContact NH2-O 3.02Å
159	N	73	Confident	84.5	Confident	125 Å²	125	43.5 Å²	43.5	67%	0.668	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	5.1	-179.5	-61.4	-50.9	0	0	0	113.1	D155 T156 I157	D155-N159 PolarHBondContact O-ND2 2.61Å; T156-N159 PolarHBondContact O-N 2.67Å; T156-N159 VanDerWaalsContact O-N 3.12Å; I157-N159 PolarHBondContact O-N 3.31Å
160	L	75.8	Confident	84.3	Confident	14 Å²	14	47.7 Å²	47.7	7%	0.073	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-28.6	-167.1	-163.5	81.8	0	0	0	113.8	I157 T162 K163 L164 V367 I368	I157-L160 WeakPolarHBondContact O-CB 3.46Å; I157-L160 PolarHBondContact O-N 3.12Å; L160-T162 PolarHBondContact O-N 3.12Å; L160-K163 PolarHBondContact O-N 3.25Å; L160-K163 VanDerWaalsContact O-N 3.15Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 PolarHBondContact O-N 2.8Å; L160-V367 HydrophobicContact CD1-CG1 4.39Å; L160-V367 HydrophobicContact CD2-CG1 3.15Å; L160-V367 HydrophobicContact CG-CG1 4.36Å; L160-I368 HydrophobicContact CD1-CD1 3.41Å; L160-I368 VanDerWaalsContact CD1-CD1 3.41Å; L160-I368 HydrophobicContact CD1-CG1 3.75Å; L160-I368 HydrophobicContact CD2-CG1 4.17Å; L160-I368 HydrophobicContact CG-CD1 3.85Å; L160-I368 HydrophobicContact CG-CG1 3.96Å
161	G	77.9	Confident	83.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-43.2	-170.3	0	0	0	0	0	114.1	L164 A165 V227 N231	G161-L164 PolarHBondContact O-N 2.97Å; G161-A165 PolarHBondContact O-N 2.97Å; G161-V227 VanDerWaalsContact O-CG1 3.25Å; G161-V227 WeakPolarHBondContact O-CG1 3.44Å; G161-N231 VanDerWaalsContact CA-OD1 3.26Å; G161-N231 WeakPolarHBondContact CA-OD1 3.2Å; G161-N231 PolarHBondContact N-OD1 3.47Å
162	T	82.1	Confident	83.6	Confident	56 Å²	56	47.8 Å²	47.8	34%	0.344	25%	0.249	S	C	.	.	H	α-helix	trans	-63.1	-48.7	175.3	37.8	0	0	0	0	111.8	L160 L164 A165 E166 V227 N231	L160-T162 PolarHBondContact O-N 3.12Å; T162-L164 VanDerWaalsContact C-N 3.33Å; T162-L164 PolarHBondContact O-N 3.47Å; T162-A165 PolarHBondContact O-N 2.85Å; T162-E166 WeakPolarHBondContact O-CG 3.42Å; T162-E166 PolarHBondContact O-N 3.32Å; T162-V227 HydrophobicContact CG2-CG1 4.48Å; T162-N231 VanDerWaalsContact CG2-ND2 3.33Å; T162-N231 WeakPolarHBondContact CG2-ND2 3.27Å
163	K	84.3	Confident	83.5	Confident	117 Å²	117	48 Å²	48	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-38.9	179.6	-167.8	179.7	179.3	-178.8	0	112.1	L160 E166 E167 I368	L160-K163 PolarHBondContact O-N 3.25Å; L160-K163 VanDerWaalsContact O-N 3.15Å; K163-E166 PolarHBondContact O-N 3.37Å; K163-E167 WeakPolarHBondContact O-CG 3.48Å; K163-E167 PolarHBondContact O-N 2.65Å; K163-I368 HydrophobicContact CB-CD1 3.89Å; K163-I368 HydrophobicContact CD-CD1 3.76Å; K163-I368 HydrophobicContact CG-CD1 3.67Å
164	L	84.2	Confident	83.5	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-46.9	175.6	177.2	62.6	0	0	0	110.7	L140 L160 G161 T162 E166 E167 M168 L177 I368 I371	L140-L164 HydrophobicContact CD2-CD2 4.37Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 PolarHBondContact O-N 2.8Å; G161-L164 PolarHBondContact O-N 2.97Å; T162-L164 VanDerWaalsContact C-N 3.33Å; T162-L164 PolarHBondContact O-N 3.47Å; L164-E166 VanDerWaalsContact C-N 3.35Å; L164-E166 PolarHBondContact O-N 2.96Å; L164-E167 PolarHBondContact O-N 3.07Å; L164-M168 HydrophobicContact CD1-CG 3.97Å; L164-M168 HydrophobicContact CG-CG 4.35Å; L164-M168 WeakPolarHBondContact O-CB 3.3Å; L164-M168 VanDerWaalsContact O-CG 3.26Å; L164-M168 WeakPolarHBondContact O-CG 3.14Å; L164-M168 PolarHBondContact O-N 2.94Å; L164-L177 HydrophobicContact CD2-CD1 4.06Å; L164-L177 HydrophobicContact CD2-CD2 4.43Å; L164-I368 HydrophobicContact CB-CD1 4.39Å; L164-I368 HydrophobicContact CB-CG1 4.21Å; L164-I368 HydrophobicContact CD1-CG1 4.08Å; L164-I368 HydrophobicContact CD1-CG2 4.36Å; L164-I371 HydrophobicContact CD1-CD1 3.78Å; L164-I371 HydrophobicContact CD1-CG2 4.43Å; L164-I371 HydrophobicContact CD2-CD1 4.21Å
165	A	83.4	Confident	83.6	Confident	16 Å²	16	50.4 Å²	50.4	13%	0.132	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-36.2	178.4	0	0	0	0	0	113	G161 T162 G169 F175 V227	G161-A165 PolarHBondContact O-N 2.97Å; T162-A165 PolarHBondContact O-N 2.85Å; A165-G169 WeakPolarHBondContact O-CA 3.11Å; A165-G169 PolarHBondContact O-N 3.02Å; A165-F175 HydrophobicContact CB-CD1 4.27Å; A165-F175 HydrophobicContact CB-CE1 4.18Å; A165-V227 HydrophobicContact CB-CB 4.04Å; A165-V227 HydrophobicContact CB-CG1 3.54Å; A165-V227 HydrophobicContact CB-CG2 3.29Å
166	E	85.9	Confident	83.9	Confident	129 Å²	129	51 Å²	51	60%	0.603	27%	0.265	S	S	*	.	H	α-helix	trans	-61.5	-45	173.5	-76	175.2	-176.8	0	0	112	T162 K163 L164 G169	T162-E166 WeakPolarHBondContact O-CG 3.42Å; T162-E166 PolarHBondContact O-N 3.32Å; K163-E166 PolarHBondContact O-N 3.37Å; L164-E166 VanDerWaalsContact C-N 3.35Å; L164-E166 PolarHBondContact O-N 2.96Å; E166-G169 PolarHBondContact O-N 3.26Å
167	E	87.4	Confident	84.3	Confident	55 Å²	55	49.5 Å²	49.5	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-70.3	-41.2	177.9	-68.8	-58.5	146.5	0	0	112.1	K163 L164 G169 K170 I368 I372	K163-E167 WeakPolarHBondContact O-CG 3.48Å; K163-E167 PolarHBondContact O-N 2.65Å; L164-E167 PolarHBondContact O-N 3.07Å; E167-G169 VanDerWaalsContact C-N 3.29Å; E167-G169 PolarHBondContact O-N 3.32Å; E167-K170 WeakPolarHBondContact O-CB 3.45Å; E167-K170 PolarHBondContact O-N 3.39Å; E167-K170 IonicContact OE1-NZ 2.81Å; E167-K170 PolarHBondContact OE1-NZ 3.05Å; E167-K170 IonicContact OE2-NZ 2.66Å; E167-K170 PolarHBondContact OE2-NZ 3.01Å; E167-I368 HydrophobicContact CB-CG2 4Å; E167-I368 HydrophobicContact CG-CG2 3.9Å; E167-I372 HydrophobicContact CB-CD1 3.92Å; E167-I372 HydrophobicContact CG-CD1 4.43Å
168	M	85.6	Confident	84.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-31.9	175.7	-69.2	-57.8	-64	0	0	112.1	V138 L164 K170 L171 T172 F175 I371	V138-M168 HydrophobicContact CG1-CE 4.03Å; L164-M168 HydrophobicContact CD1-CG 3.97Å; L164-M168 HydrophobicContact CG-CG 4.35Å; L164-M168 WeakPolarHBondContact O-CB 3.3Å; L164-M168 VanDerWaalsContact O-CG 3.26Å; L164-M168 WeakPolarHBondContact O-CG 3.14Å; L164-M168 PolarHBondContact O-N 2.94Å; M168-K170 PolarHBondContact O-N 3.01Å; M168-L171 PolarHBondContact O-N 3.02Å; M168-L171 HydrophobicContact SD-CD1 4.2Å; M168-T172 PolarHBondContact O-N 3.3Å; M168-F175 HydrophobicContact CB-CD1 4.17Å; M168-F175 HydrophobicContact CB-CD2 3.98Å; M168-F175 HydrophobicContact CB-CE1 4.2Å; M168-F175 HydrophobicContact CB-CE2 4.02Å; M168-F175 HydrophobicContact CB-CG 4.05Å; M168-F175 HydrophobicContact CB-CZ 4.14Å; M168-F175 HydrophobicContact CE-CD2 4.27Å; M168-F175 HydrophobicContact CE-CE2 4.09Å; M168-F175 HydrophobicContact CG-CD2 4.33Å; M168-F175 HydrophobicContact CG-CE1 4.39Å; M168-F175 HydrophobicContact CG-CE2 3.88Å; M168-F175 HydrophobicContact CG-CZ 3.92Å; M168-I371 HydrophobicContact SD-CG2 4.01Å
169	G	83	Confident	85.5	Confident	46 Å²	46	46.5 Å²	46.5	47%	0.474	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20	174.1	0	0	0	0	0	114.1	A165 E166 E167 L171 T172	A165-G169 WeakPolarHBondContact O-CA 3.11Å; A165-G169 PolarHBondContact O-N 3.02Å; E166-G169 PolarHBondContact O-N 3.26Å; E167-G169 VanDerWaalsContact C-N 3.29Å; E167-G169 PolarHBondContact O-N 3.32Å; G169-L171 VanDerWaalsContact C-N 3.33Å; G169-T172 WeakPolarHBondContact CA-O 3.24Å
170	K	85.9	Confident	86.7	Confident	144 Å²	144	40.6 Å²	40.6	63%	0.626	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-20.9	171.8	-59.6	174	-167.7	166.6	0	112.6	E167 M168	E167-K170 WeakPolarHBondContact O-CB 3.45Å; E167-K170 PolarHBondContact O-N 3.39Å; E167-K170 IonicContact OE1-NZ 2.81Å; E167-K170 PolarHBondContact OE1-NZ 3.05Å; E167-K170 IonicContact OE2-NZ 2.66Å; E167-K170 PolarHBondContact OE2-NZ 3.01Å; M168-K170 PolarHBondContact O-N 3.01Å
171	L	82	Confident	87.7	Confident	47 Å²	47	39.9 Å²	39.9	25%	0.246	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-35.6	-175.1	-57.5	177.4	0	0	0	112.5	M168 G169 I372 Y375	M168-L171 PolarHBondContact O-N 3.02Å; M168-L171 HydrophobicContact SD-CD1 4.2Å; G169-L171 VanDerWaalsContact C-N 3.33Å; L171-I372 HydrophobicContact CD1-CG1 4.3Å; L171-I372 HydrophobicContact CD1-CG2 4.22Å; L171-Y375 HydrophobicContact CB-CE1 4.03Å; L171-Y375 HydrophobicContact CD1-CD1 3.78Å; L171-Y375 HydrophobicContact CD1-CE1 4.05Å
172	T	85.2	Confident	88.7	Confident	2 Å²	2	40 Å²	40	1%	0.012	21%	0.21	C	C	.	.			trans	-143.4	139.1	178.6	-177.3	0	0	0	0	110.5	D135 Y136 V138 M168 G169 N174 F175	D135-T172 VanDerWaalsContact OD1-CA 3.32Å; D135-T172 WeakPolarHBondContact OD1-CA 3.34Å; Y136-T172 PolarHBondContact O-OG1 2.94Å; V138-T172 HydrophobicContact CB-CG2 4Å; V138-T172 HydrophobicContact CG2-CG2 3.76Å; M168-T172 PolarHBondContact O-N 3.3Å; G169-T172 WeakPolarHBondContact CA-O 3.24Å; T172-N174 VanDerWaalsContact C-N 3.27Å; T172-N174 PolarHBondContact OG1-N 3.31Å; T172-F175 HydrophobicContact CG2-CB 4.09Å
173	S	85.1	Confident	89.4	Confident	84 Å²	84	37.3 Å²	37.3	59%	0.587	19%	0.193	S	C	*	.	S	Bend	trans	-77.8	-14.3	174.6	66.3	0	0	0	0	112.6	S99 D135	S99-S173 PolarHBondContact OG-OG 3.4Å; D135-S173 VanDerWaalsContact CG-OG 3.26Å; D135-S173 PolarHBondContact OD1-N 2.96Å; D135-S173 PolarHBondContact OD1-OG 3.04Å; D135-S173 VanDerWaalsContact OD1-OG 3.11Å; D135-S173 PolarHBondContact OD2-OG 2.97Å
174	N	87.1	Confident	90.1	Very high	35 Å²	35	31.7 Å²	31.7	19%	0.187	17%	0.169	C	C	.	.	S	Bend	trans	-126.9	74.4	-171.5	-165.2	-7.2	0	0	0	112	P137 V138 T172 R266	P137-N174 WeakPolarHBondContact CA-O 3.47Å; P137-N174 HydrophobicContact CB-CB 4.18Å; P137-N174 HydrophobicContact CG-CB 4.37Å; V138-N174 PolarHBondContact N-O 3.34Å; V138-N174 VanDerWaalsContact N-O 3.11Å; T172-N174 VanDerWaalsContact C-N 3.27Å; T172-N174 PolarHBondContact OG1-N 3.31Å; N174-R266 PolarHBondContact ND2-NH1 3.42Å; N174-R266 PolarHBondContact O-NH2 3.32Å; N174-R266 PolarHBondContact OD1-NH1 3.5Å
175	F	90.5	Very high	90.7	Very high	24 Å²	24	31.7 Å²	31.7	11%	0.105	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	136.9	-177	-179.3	-117.7	0	0	0	112.1	V138 L140 A165 M168 T172 L177	V138-F175 HydrophobicContact CB-CD2 4.23Å; V138-F175 HydrophobicContact CG1-CD2 4.32Å; V138-F175 HydrophobicContact CG1-CE2 4.44Å; V138-F175 WeakPolarHBondContact O-CA 3.03Å; L140-F175 HydrophobicContact CB-CE2 3.66Å; L140-F175 HydrophobicContact CB-CZ 3.93Å; L140-F175 HydrophobicContact CD1-CE2 4.49Å; A165-F175 HydrophobicContact CB-CD1 4.27Å; A165-F175 HydrophobicContact CB-CE1 4.18Å; M168-F175 HydrophobicContact CB-CD1 4.17Å; M168-F175 HydrophobicContact CB-CD2 3.98Å; M168-F175 HydrophobicContact CB-CE1 4.2Å; M168-F175 HydrophobicContact CB-CE2 4.02Å; M168-F175 HydrophobicContact CB-CG 4.05Å; M168-F175 HydrophobicContact CB-CZ 4.14Å; M168-F175 HydrophobicContact CE-CD2 4.27Å; M168-F175 HydrophobicContact CE-CE2 4.09Å; M168-F175 HydrophobicContact CG-CD2 4.33Å; M168-F175 HydrophobicContact CG-CE1 4.39Å; M168-F175 HydrophobicContact CG-CE2 3.88Å; M168-F175 HydrophobicContact CG-CZ 3.92Å; T172-F175 HydrophobicContact CG2-CB 4.09Å; F175-L177 HydrophobicContact CE1-CB 3.93Å; F175-L177 HydrophobicContact CZ-CB 4.16Å; F175-L177 HydrophobicContact CZ-CD1 4.22Å
176	R	93.1	Very high	91.2	Very high	80 Å²	80	34.4 Å²	34.4	30%	0.302	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	142.6	167.1	-65.1	-175.6	174.3	-174.7	-2.6	110.9	V138 D139 L140 L223 T224	V138-R176 PolarHBondContact O-N 3.48Å; D139-R176 WeakPolarHBondContact OD1-CB 3.01Å; L140-R176 PolarHBondContact N-O 3.31Å; R176-L223 HydrophobicContact CB-CB 4.16Å; R176-L223 HydrophobicContact CB-CD2 4.34Å; R176-T224 CarbonylContact C-O 3.58Å; R176-T224 VanDerWaalsContact CA-O 3.3Å; R176-T224 WeakPolarHBondContact CA-O 3.27Å
177	L	92.9	Very high	91.6	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.8	-179.6	-176.5	61.9	0	0	0	110	L140 L164 F175 T224 F230	L140-L177 HydrophobicContact CB-CD1 4.28Å; L140-L177 HydrophobicContact CD2-CD1 3.47Å; L140-L177 VanDerWaalsContact CD2-CD1 3.47Å; L140-L177 HydrophobicContact CG-CD1 4.43Å; L140-L177 CarbonylContact O-C 3.54Å; L140-L177 WeakPolarHBondContact O-CA 3.37Å; L164-L177 HydrophobicContact CD2-CD1 4.06Å; L164-L177 HydrophobicContact CD2-CD2 4.43Å; F175-L177 HydrophobicContact CE1-CB 3.93Å; F175-L177 HydrophobicContact CZ-CB 4.16Å; F175-L177 HydrophobicContact CZ-CD1 4.22Å; L177-T224 PolarHBondContact N-O 3.38Å; L177-T224 PolarHBondContact O-N 3.43Å; L177-T224 VanDerWaalsContact O-N 3.08Å; L177-F230 HydrophobicContact CD1-CD2 4.24Å; L177-F230 HydrophobicContact CD1-CE2 4.11Å; L177-F230 HydrophobicContact CD2-CB 3.81Å; L177-F230 HydrophobicContact CD2-CD1 3.89Å; L177-F230 HydrophobicContact CD2-CD2 3.48Å; L177-F230 VanDerWaalsContact CD2-CD2 3.48Å; L177-F230 HydrophobicContact CD2-CE1 4.3Å; L177-F230 HydrophobicContact CD2-CE2 3.91Å; L177-F230 HydrophobicContact CD2-CG 3.45Å; L177-F230 VanDerWaalsContact CD2-CG 3.45Å; L177-F230 HydrophobicContact CD2-CZ 4.3Å; L177-F230 HydrophobicContact CG-CB 4.37Å; L177-F230 HydrophobicContact CG-CD2 3.52Å; L177-F230 HydrophobicContact CG-CE2 3.9Å; L177-F230 HydrophobicContact CG-CG 4.01Å
178	G	95.6	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	164	175.8	0	0	0	0	0	111.2	L140 Y142 L221	L140-G178 PolarHBondContact O-N 3.38Å; Y142-G178 PolarHBondContact N-O 3.15Å; G178-L221 CarbonylContact C-O 3.59Å; G178-L221 VanDerWaalsContact CA-O 3.26Å; G178-L221 WeakPolarHBondContact CA-O 3.35Å
179	F	96.3	Very high	92.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	138	-176.7	-170.8	-103.2	0	0	0	111.7	Y141 Y142 M144 I220 L221 F230 V234 Q237	Y141-F179 PolarHBondContact OH-O 2.84Å; Y142-F179 HydrophobicContact CD1-CD2 4.02Å; Y142-F179 AromaticContact CD1-CE2 3.8Å; Y142-F179 HydrophobicContact CD1-CE2 3.8Å; Y142-F179 HydrophobicContact CE1-CE2 4.47Å; Y142-F179 HydrophobicContact CG-CD2 4.48Å; Y142-F179 WeakPolarHBondContact O-CA 3.1Å; M144-F179 HydrophobicContact CB-CE2 3.91Å; M144-F179 HydrophobicContact CB-CZ 3.94Å; M144-F179 HydrophobicContact SD-CE2 4.35Å; M144-F179 HydrophobicContact SD-CZ 4.23Å; F179-I220 HydrophobicContact CD1-CB 3.98Å; F179-I220 HydrophobicContact CD1-CD1 3.53Å; F179-I220 HydrophobicContact CD1-CG1 4.35Å; F179-I220 HydrophobicContact CD1-CG2 4.13Å; F179-I220 HydrophobicContact CE1-CD1 3.46Å; F179-I220 VanDerWaalsContact CE1-CD1 3.46Å; F179-I220 PolarHBondContact O-N 3.19Å; F179-I220 VanDerWaalsContact O-N 3.11Å; F179-L221 HydrophobicContact CB-CB 4.07Å; F179-L221 PolarHBondContact N-O 3.08Å; F179-L221 PolarHBondContact O-N 2.69Å; F179-F230 HydrophobicContact CB-CD2 3.94Å; F179-F230 HydrophobicContact CB-CE2 3.73Å; F179-F230 AromaticContact CD2-CE2 3.62Å; F179-F230 HydrophobicContact CD2-CE2 3.62Å; F179-F230 AromaticContact CD2-CZ 3.89Å; F179-F230 HydrophobicContact CD2-CZ 3.89Å; F179-F230 HydrophobicContact CG-CE2 4.03Å; F179-V234 HydrophobicContact CD1-CG2 4.14Å; F179-V234 HydrophobicContact CD2-CG2 3.87Å; F179-V234 HydrophobicContact CE1-CG2 4.26Å; F179-V234 HydrophobicContact CE2-CG2 3.97Å; F179-V234 HydrophobicContact CG-CG2 3.97Å; F179-V234 HydrophobicContact CZ-CG2 4.17Å; F179-Q237 HydrophobicContact CE1-CG 3.91Å
180	G	97.5	Very high	93	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	161.4	170.1	0	0	0	0	0	111.1	Y141 Y142 M144 R218	Y141-G180 VanDerWaalsContact OH-CA 3.26Å; Y141-G180 WeakPolarHBondContact OH-CA 3.42Å; Y141-G180 PolarHBondContact OH-N 3.3Å; Y142-G180 PolarHBondContact O-N 3.5Å; M144-G180 PolarHBondContact N-O 2.94Å; G180-R218 WeakPolarHBondContact CA-O 3.48Å
181	S	97.5	Very high	93.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.7	179.5	61.6	0	0	0	0	112.9	M144 F215 F217 R218 I220	M144-S181 VanDerWaalsContact O-CA 3.23Å; M144-S181 WeakPolarHBondContact O-CA 3.13Å; S181-F215 WeakPolarHBondContact OG-CE2 3.49Å; S181-F217 WeakPolarHBondContact O-CA 3.33Å; S181-F217 VanDerWaalsContact O-CD2 3.25Å; S181-F217 WeakPolarHBondContact O-CD2 3.15Å; S181-R218 PolarHBondContact N-O 3.31Å; S181-R218 PolarHBondContact O-N 3.37Å; S181-I220 WeakPolarHBondContact OG-CD1 3.45Å
182	F	98.3	Very high	93.8	Very high	1 Å²	1	23.6 Å²	23.6	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	161.6	174.9	68.5	-89	0	0	0	111.1	L143 M144 D145 L146 G216 E247 A252 F275	L143-F182 HydrophobicContact CD1-CD1 3.85Å; L143-F182 HydrophobicContact CD2-CD1 4.42Å; L143-F182 HydrophobicContact CG-CD1 3.79Å; L143-F182 HydrophobicContact CG-CE1 3.97Å; M144-F182 WeakPolarHBondContact O-CD1 3.06Å; M144-F182 PolarHBondContact O-N 3.38Å; M144-F182 VanDerWaalsContact O-N 3.08Å; D145-F182 HydrophobicContact CB-CE1 4.15Å; D145-F182 HydrophobicContact CB-CE2 3.83Å; D145-F182 HydrophobicContact CB-CZ 3.56Å; L146-F182 PolarHBondContact N-O 3.11Å; F182-G216 WeakPolarHBondContact CA-O 3.37Å; F182-G216 VanDerWaalsContact CB-O 3.23Å; F182-G216 WeakPolarHBondContact CB-O 3.28Å; F182-E247 HydrophobicContact CE2-CB 4.23Å; F182-A252 HydrophobicContact CB-CB 3.57Å; F182-A252 HydrophobicContact CD1-CB 3.98Å; F182-A252 HydrophobicContact CG-CB 3.9Å; F182-F275 HydrophobicContact CD1-CE2 4.26Å; F182-F275 AromaticContact CE1-CD2 3.8Å; F182-F275 HydrophobicContact CE1-CD2 3.8Å; F182-F275 AromaticContact CE1-CE2 3.32Å; F182-F275 HydrophobicContact CE1-CE2 3.32Å; F182-F275 HydrophobicContact CE1-CZ 4.07Å; F182-F275 HydrophobicContact CE2-CE2 4.02Å; F182-F275 HydrophobicContact CE2-CZ 4.11Å; F182-F275 HydrophobicContact CZ-CD2 4.02Å; F182-F275 HydrophobicContact CZ-CE1 4.43Å; F182-F275 AromaticContact CZ-CE2 3.17Å; F182-F275 HydrophobicContact CZ-CE2 3.17Å; F182-F275 AromaticContact CZ-CZ 3.43Å; F182-F275 HydrophobicContact CZ-CZ 3.43Å; F182-F275 VanDerWaalsContact CZ-CZ 3.43Å
183	V	97.6	Very high	94.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.			trans	-136.9	-93.1	168.1	-173.2	0	0	0	0	105.9	L146 T214 F215 G216 N242 G248	L146-V183 HydrophobicContact CB-CG2 4.29Å; V183-T214 HydrophobicContact CB-CG2 4.39Å; V183-T214 HydrophobicContact CG1-CG2 4.08Å; V183-F215 WeakPolarHBondContact CB-O 3.49Å; V183-F215 HydrophobicContact CG2-CD1 4.18Å; V183-F215 HydrophobicContact CG2-CE1 3.72Å; V183-F215 HydrophobicContact CG2-CE2 4.11Å; V183-F215 HydrophobicContact CG2-CZ 3.68Å; V183-F215 PolarHBondContact N-O 3.12Å; V183-G216 PolarHBondContact N-O 3.48Å; V183-N242 HydrophobicContact CG1-CB 4.09Å; V183-G248 PolarHBondContact O-N 2.89Å
184	D	97.5	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.			trans	-158.6	173.6	174	-157.9	2.7	0	0	0	111.5	N186 F190 F215 G216 G248 H282 Y316	D184-N186 PolarHBondContact O-N 2.84Å; D184-N186 VanDerWaalsContact O-N 3.16Å; D184-F190 WeakPolarHBondContact OD2-CB 3.42Å; D184-F215 PolarHBondContact N-O 3.27Å; D184-F215 CarbonylContact O-C 3.5Å; D184-G216 WeakPolarHBondContact O-CA 3.26Å; D184-G216 PolarHBondContact O-N 2.94Å; D184-G248 VanDerWaalsContact OD1-CA 3.31Å; D184-G248 WeakPolarHBondContact OD1-CA 3.39Å; D184-G248 PolarHBondContact OD1-N 2.95Å; D184-H282 IonicContact OD1-CD2 2.88Å; D184-H282 IonicContact OD2-CD2 2.65Å; D184-H282 PolarHBondContact OD2-CD2 3.49Å; D184-H282 IonicContact OD2-NE2 3.73Å; D184-Y316 WeakPolarHBondContact OD1-CE1 3.17Å; D184-Y316 PolarHBondContact OD1-OH 3.28Å; D184-Y316 PolarHBondContact OD2-OH 2.86Å
185	K	96.9	Very high	94.6	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	16%	0.163	C	C	.	.			trans	-55.5	120.3	179.5	-60.9	-176.5	-179.4	-61.8	0	109.9	M187 F190 D251 L292 S311 M314 Y316	K185-M187 HydrophobicContact CB-CG 4.17Å; K185-M187 PolarHBondContact O-N 3.36Å; K185-F190 HydrophobicContact CB-CD2 4.1Å; K185-D251 IonicContact NZ-OD1 3.98Å; K185-D251 IonicContact NZ-OD2 3.39Å; K185-D251 PolarHBondContact NZ-OD2 3.24Å; K185-L292 HydrophobicContact CD-CD1 3.4Å; K185-L292 VanDerWaalsContact CD-CD1 3.4Å; K185-S311 VanDerWaalsContact CD-O 3.29Å; K185-S311 WeakPolarHBondContact CD-O 3.26Å; K185-S311 WeakPolarHBondContact CG-O 3.47Å; K185-S311 PolarHBondContact NZ-O 3.47Å; K185-M314 PolarHBondContact NZ-O 3.49Å; K185-Y316 HydrophobicContact CD-CE1 3.85Å; K185-Y316 HydrophobicContact CD-CE2 3.91Å; K185-Y316 VanDerWaalsContact CD-CZ 3.49Å; K185-Y316 WeakPolarHBondContact CD-OH 3.22Å; K185-Y316 VanDerWaalsContact CE-CE2 3.45Å; K185-Y316 HydrophobicContact CG-CE1 3.86Å
186	N	94.9	Very high	94.6	Very high	73 Å²	73	33.2 Å²	33.2	39%	0.39	18%	0.184	S	C	.	.	S	Bend	trans	-77.1	69.4	-178.4	-172.1	14.5	0	0	0	112.2	D184 S191 T214	D184-N186 PolarHBondContact O-N 2.84Å; D184-N186 VanDerWaalsContact O-N 3.16Å; N186-S191 PolarHBondContact OD1-OG 3.32Å; N186-T214 VanDerWaalsContact CB-O 3.28Å; N186-T214 WeakPolarHBondContact CB-O 2.93Å; N186-T214 PolarHBondContact ND2-O 3.29Å
187	M	94.7	Very high	94.5	Very high	34 Å²	34	32.3 Å²	32.3	17%	0.167	18%	0.181	C	C	.	.	S	Bend	trans	-158	163.5	177.3	60.7	-174.1	-67.8	0	0	111.1	K185 F190 S191 G290 L292 T312	K185-M187 HydrophobicContact CB-CG 4.17Å; K185-M187 PolarHBondContact O-N 3.36Å; M187-F190 HydrophobicContact CG-CD2 3.94Å; M187-F190 HydrophobicContact CG-CE2 4.36Å; M187-F190 PolarHBondContact O-N 2.94Å; M187-S191 PolarHBondContact N-OG 3.26Å; M187-S191 PolarHBondContact O-N 2.89Å; M187-G290 WeakPolarHBondContact CE-O 3Å; M187-L292 HydrophobicContact CE-CD1 4.46Å; M187-L292 HydrophobicContact CE-CD2 3.99Å; M187-L292 HydrophobicContact CE-CG 4.09Å; M187-L292 HydrophobicContact SD-CD1 3.72Å; M187-L292 HydrophobicContact SD-CD2 3.91Å; M187-L292 HydrophobicContact SD-CG 3.96Å; M187-T312 HydrophobicContact CB-CG2 4.31Å; M187-T312 HydrophobicContact CG-CG2 4.38Å; M187-T312 HydrophobicContact SD-CG2 4.05Å
188	S	94.4	Very high	94.2	Very high	62 Å²	62	37.8 Å²	37.8	43%	0.434	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	140.8	173.8	178.8	0	0	0	0	110.2	T193 G290	S188-T193 VanDerWaalsContact N-CG2 3.34Å; S188-G290 WeakPolarHBondContact O-CA 3.25Å
189	P	95.1	Very high	94	Very high	43 Å²	43	46.1 Å²	46.1	28%	0.279	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.9	-4.1	4.8	34.9	-35.5	0	0	0	116	R243 L289	P189-R243 WeakPolarHBondContact O-CD 3.45Å; P189-L289 HydrophobicContact CG-CB 4.22Å
190	F	95.4	Very high	93.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-36.1	-170	-43.5	-66.4	0	0	0	113.8	D184 K185 M187 R243 D244 H282 L289	D184-F190 WeakPolarHBondContact OD2-CB 3.42Å; K185-F190 HydrophobicContact CB-CD2 4.1Å; M187-F190 HydrophobicContact CG-CD2 3.94Å; M187-F190 HydrophobicContact CG-CE2 4.36Å; M187-F190 PolarHBondContact O-N 2.94Å; F190-R243 WeakPolarHBondContact O-CB 3.35Å; F190-R243 PolarHBondContact O-N 2.95Å; F190-D244 WeakPolarHBondContact CA-OD1 3.25Å; F190-H282 AromaticContact CD1-NE2 3.48Å; F190-H282 WeakPolarHBondContact CD1-NE2 3.27Å; F190-H282 AromaticContact CE1-CE1 3.88Å; F190-H282 AromaticContact CE1-NE2 3.74Å; F190-L289 HydrophobicContact CZ-CB 4.38Å
191	S	93.4	Very high	93.7	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.007	25%	0.254	C	S	.	.	S	Bend	trans	-116.1	164.4	178.7	85.4	0	0	0	0	113.9	N186 M187 T193	N186-S191 PolarHBondContact OD1-OG 3.32Å; M187-S191 PolarHBondContact N-OG 3.26Å; M187-S191 PolarHBondContact O-N 2.89Å; S191-T193 PolarHBondContact O-N 3.45Å
192	Y	91.8	Very high	93.5	Very high	54 Å²	54	47.7 Å²	47.7	21%	0.212	25%	0.254	C	S	.	.			trans	-79.7	97.6	173.3	-65.8	-80.4	0	0	0	111.1	Y197 P201 R241 N242 R243	Y192-Y197 HydrophobicContact CG-CG 4.39Å; Y192-P201 HydrophobicContact CD2-CB 4.33Å; Y192-R241 HydrophobicContact CE2-CG 4.2Å; Y192-R241 PolarHBondContact OH-NH2 2.95Å; Y192-N242 WeakPolarHBondContact CE2-O 3.45Å; Y192-R243 HydrophobicContact CD2-CB 4.44Å; Y192-R243 HydrophobicContact CE1-CB 4.41Å; Y192-R243 HydrophobicContact CE1-CG 4.11Å; Y192-R243 HydrophobicContact CE2-CB 4.13Å
193	T	89.6	Confident	93.1	Very high	67 Å²	67	50.5 Å²	50.5	41%	0.411	27%	0.269	S	S	.	.			trans	-89.7	-10.3	-175.9	56.8	0	0	0	0	115.4	S188 S191 Q198	S188-T193 VanDerWaalsContact N-CG2 3.34Å; S191-T193 PolarHBondContact O-N 3.45Å; T193-Q198 PolarHBondContact O-NE2 3.36Å; T193-Q198 VanDerWaalsContact O-NE2 3.12Å
194	A	91.6	Very high	92.4	Very high	49 Å²	49	53.8 Å²	53.8	41%	0.405	30%	0.303	S	S	.	.	S	Bend	trans	-66.2	143.9	-179.5	0	0	0	0	0	111.1	K196 Y197 Q198	A194-K196 PolarHBondContact O-N 2.9Å; A194-Y197 HydrophobicContact CB-CD2 4.2Å; A194-Y197 PolarHBondContact O-N 2.83Å; A194-Q198 PolarHBondContact O-N 3.3Å
195	P	92.5	Very high	91.7	Very high	108 Å²	108	58 Å²	58	70%	0.701	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-52.2	-33.2	-170.8	-30.2	35.2	0	0	0	115.3	Y197 Q198	P195-Y197 PolarHBondContact O-N 3.21Å; P195-Q198 PolarHBondContact O-N 3.45Å
196	K	90.9	Very high	90.8	Very high	124 Å²	124	67.7 Å²	67.7	54%	0.539	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-60.3	-24.9	177.4	-177.8	178.2	176.7	-171.4	0	114.1	A194 N203	A194-K196 PolarHBondContact O-N 2.9Å; K196-N203 WeakPolarHBondContact CE-ND2 3.38Å; K196-N203 WeakPolarHBondContact CG-ND2 3.37Å; K196-N203 PolarHBondContact O-ND2 2.79Å
197	Y	90.3	Very high	90	Very high	60 Å²	60	70.6 Å²	70.6	24%	0.235	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-112.6	-6	-171.7	-62	-75.7	0	0	0	113.7	Y192 A194 P195 E199 N200 P201 N203	Y192-Y197 HydrophobicContact CG-CG 4.39Å; A194-Y197 HydrophobicContact CB-CD2 4.2Å; A194-Y197 PolarHBondContact O-N 2.83Å; P195-Y197 PolarHBondContact O-N 3.21Å; Y197-E199 PolarHBondContact O-N 3.15Å; Y197-N200 CarbonylContact O-C 3.6Å; Y197-N200 VanDerWaalsContact O-C 3.27Å; Y197-N200 PolarHBondContact O-N 3.43Å; Y197-P201 WeakPolarHBondContact O-CD 3.36Å; Y197-P201 VanDerWaalsContact O-N 3.16Å; Y197-N203 HydrophobicContact CD1-CB 4.07Å; Y197-N203 HydrophobicContact CE1-CB 4.11Å; Y197-N203 VanDerWaalsContact CE1-O 3.3Å; Y197-N203 WeakPolarHBondContact CE1-O 3.48Å
198	Q	86.7	Confident	89.3	Confident	117 Å²	117	72.7 Å²	72.7	55%	0.547	39%	0.385	S	S	.	.	S	Bend	trans	-62.4	-42	-175.3	-74.5	-178.8	-6.2	0	0	112.9	T193 A194 P195 P213	T193-Q198 PolarHBondContact O-NE2 3.36Å; T193-Q198 VanDerWaalsContact O-NE2 3.12Å; A194-Q198 PolarHBondContact O-N 3.3Å; P195-Q198 PolarHBondContact O-N 3.45Å; Q198-P213 WeakPolarHBondContact O-CB 3.48Å; Q198-P213 WeakPolarHBondContact O-CG 2.99Å
199	E	91.2	Very high	88.8	Confident	174 Å²	174	73.5 Å²	73.5	81%	0.813	39%	0.388	S	S	*	.	S	Bend	trans	-86.7	-28.1	177.6	-64.9	-176.4	171	0	0	112.8	Y197	Y197-E199 PolarHBondContact O-N 3.15Å
200	N	93.7	Very high	88.6	Confident	31 Å²	31	76.9 Å²	76.9	17%	0.166	40%	0.404	C	S	.	.			trans	-147.2	94.6	-178.3	-179.8	5.5	0	0	0	110.8	Y197 C202 N203 P209 N210 C211	Y197-N200 CarbonylContact O-C 3.6Å; Y197-N200 VanDerWaalsContact O-C 3.27Å; Y197-N200 PolarHBondContact O-N 3.43Å; N200-C202 PolarHBondContact O-N 2.04Å; N200-C202 VanDerWaalsContact O-N 3.13Å; N200-C202 WeakPolarHBondContact OD1-CA 3.3Å; N200-C202 WeakPolarHBondContact OD1-CB 3.32Å; N200-C202 PolarHBondContact OD1-N 2.88Å; N200-N203 VanDerWaalsContact O-CB 3.32Å; N200-N203 WeakPolarHBondContact O-CB 3.43Å; N200-N203 PolarHBondContact O-N 3.27Å; N200-N203 VanDerWaalsContact O-N 3.15Å; N200-P209 PolarHBondContact ND2-O 3.13Å; N200-N210 PolarHBondContact ND2-OD1 3.2Å; N200-C211 PolarHBondContact OD1-N 3.16Å
201	P	93.6	Very high	88.4	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.013	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.1	176.7	-26.7	36.6	0	0	0	114.2	Y192 Y197 N203 V212 R241	Y192-P201 HydrophobicContact CD2-CB 4.33Å; Y197-P201 WeakPolarHBondContact O-CD 3.36Å; Y197-P201 VanDerWaalsContact O-N 3.16Å; P201-N203 VanDerWaalsContact C-N 3.3Å; P201-N203 PolarHBondContact O-N 3.28Å; P201-V212 WeakPolarHBondContact CD-O 3.49Å; P201-R241 HydrophobicContact CB-CB 4.02Å; P201-R241 WeakPolarHBondContact CB-O 3.43Å; P201-R241 PolarHBondContact O-NH1 3.22Å
202	C	92.9	Very high	88.5	Confident	0 Å²	0	79 Å²	79	0%	0	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	5.6	-179.4	-58	0	0	0	0	113.4	N200 G204 Y205 F208 C211	N200-C202 PolarHBondContact O-N 2.04Å; N200-C202 VanDerWaalsContact O-N 3.13Å; N200-C202 WeakPolarHBondContact OD1-CA 3.3Å; N200-C202 WeakPolarHBondContact OD1-CB 3.32Å; N200-C202 PolarHBondContact OD1-N 2.88Å; C202-G204 PolarHBondContact O-N 2.76Å; C202-G204 VanDerWaalsContact O-N 3.08Å; C202-Y205 VanDerWaalsContact O-CB 3.29Å; C202-Y205 WeakPolarHBondContact O-CB 3.21Å; C202-Y205 PolarHBondContact O-N 2.9Å; C202-F208 VanDerWaalsContact CB-O 3.3Å; C202-F208 WeakPolarHBondContact CB-O 3.18Å; C202-C211 HydrophobicContact CB-CB 3.9Å; C202-C211 WeakPolarHBondContact CB-SG 3.17Å; C202-C211 PolarHBondContact N-SG 3.39Å; C202-C211 WeakPolarHBondContact SG-CB 3.4Å; C202-C211 CovalentContact SG-SG 2.02Å; C202-C211 PolarHBondContact SG-SG 2.82Å
203	N	90.1	Very high	88.6	Confident	60 Å²	60	78.6 Å²	78.6	32%	0.321	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	116.1	177.4	-170.2	-13.3	0	0	0	111.9	K196 Y197 N200 P201	K196-N203 WeakPolarHBondContact CE-ND2 3.38Å; K196-N203 WeakPolarHBondContact CG-ND2 3.37Å; K196-N203 PolarHBondContact O-ND2 2.79Å; Y197-N203 HydrophobicContact CD1-CB 4.07Å; Y197-N203 HydrophobicContact CE1-CB 4.11Å; Y197-N203 VanDerWaalsContact CE1-O 3.3Å; Y197-N203 WeakPolarHBondContact CE1-O 3.48Å; N200-N203 VanDerWaalsContact O-CB 3.32Å; N200-N203 WeakPolarHBondContact O-CB 3.43Å; N200-N203 PolarHBondContact O-N 3.27Å; N200-N203 VanDerWaalsContact O-N 3.15Å; P201-N203 VanDerWaalsContact C-N 3.3Å; P201-N203 PolarHBondContact O-N 3.28Å
204	G	82.8	Confident	88.9	Confident	69 Å²	69	75.7 Å²	75.7	71%	0.711	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	0.3	-177.2	0	0	0	0	0	115.1	C202	C202-G204 PolarHBondContact O-N 2.76Å; C202-G204 VanDerWaalsContact O-N 3.08Å
205	Y	82.7	Confident	89.1	Confident	88 Å²	88	73.9 Å²	73.9	35%	0.345	39%	0.386	S	S	.	.			trans	-88.2	112.4	170.9	-158.9	-97.2	0	0	0	110.1	L148 C202 L207 F208 P209	L148-Y205 HydrophobicContact CD2-CD1 3.96Å; L148-Y205 HydrophobicContact CD2-CE1 3.95Å; L148-Y205 HydrophobicContact CD2-CG 4.37Å; C202-Y205 VanDerWaalsContact O-CB 3.29Å; C202-Y205 WeakPolarHBondContact O-CB 3.21Å; C202-Y205 PolarHBondContact O-N 2.9Å; Y205-L207 HydrophobicContact CD1-CB 4.31Å; Y205-L207 HydrophobicContact CE1-CB 3.92Å; Y205-L207 HydrophobicContact CE1-CD1 4.48Å; Y205-L207 PolarHBondContact O-N 3.09Å; Y205-F208 HydrophobicContact CD1-CB 4.07Å; Y205-F208 AromaticContact CD1-CD2 4Å; Y205-F208 HydrophobicContact CD1-CD2 4Å; Y205-F208 AromaticContact CE1-CD2 3.63Å; Y205-F208 HydrophobicContact CE1-CD2 3.63Å; Y205-F208 HydrophobicContact CE1-CE2 4.34Å; Y205-F208 CarbonylContact O-C 3.5Å; Y205-P209 WeakPolarHBondContact O-CA 3.46Å
206	K	79.6	Confident	89.3	Confident	205 Å²	205	69.1 Å²	69.1	89%	0.891	36%	0.357	S	S	*	.	S	Bend	trans	-67.6	-36.5	-168	-70.9	-174.7	179.3	179.9	0	114.5
207	L	77.4	Confident	89.7	Confident	135 Å²	135	63.3 Å²	63.3	71%	0.707	33%	0.332	S	S	*	.	S	Bend	trans	-75.9	-31	-176.1	-76.4	151.5	0	0	0	112.2	Y205	Y205-L207 HydrophobicContact CD1-CB 4.31Å; Y205-L207 HydrophobicContact CE1-CB 3.92Å; Y205-L207 HydrophobicContact CE1-CD1 4.48Å; Y205-L207 PolarHBondContact O-N 3.09Å
208	F	80.4	Confident	90.1	Very high	78 Å²	78	63.5 Å²	63.5	34%	0.342	33%	0.332	S	S	.	.			trans	-136.9	86.5	-178.6	-55.4	-66.7	0	0	0	109	L148 K151 C202 Y205 N210	L148-F208 HydrophobicContact CD1-CB 3.85Å; L148-F208 HydrophobicContact CD1-CD2 3.92Å; L148-F208 HydrophobicContact CD1-CG 4Å; L148-F208 HydrophobicContact CD2-CD2 4.23Å; L148-F208 HydrophobicContact CG-CD2 4.08Å; K151-F208 HydrophobicContact CG-CD1 4.37Å; K151-F208 HydrophobicContact CG-CE1 3.93Å; K151-F208 HydrophobicContact CG-CZ 4.43Å; C202-F208 VanDerWaalsContact CB-O 3.3Å; C202-F208 WeakPolarHBondContact CB-O 3.18Å; Y205-F208 HydrophobicContact CD1-CB 4.07Å; Y205-F208 AromaticContact CD1-CD2 4Å; Y205-F208 HydrophobicContact CD1-CD2 4Å; Y205-F208 AromaticContact CE1-CD2 3.63Å; Y205-F208 HydrophobicContact CE1-CD2 3.63Å; Y205-F208 HydrophobicContact CE1-CE2 4.34Å; Y205-F208 CarbonylContact O-C 3.5Å; F208-N210 VanDerWaalsContact C-N 3.31Å; F208-N210 PolarHBondContact O-N 3.26Å
209	P	83.4	Confident	90.6	Very high	78 Å²	78	58.3 Å²	58.3	51%	0.506	31%	0.308	S	S	.	.			trans	-75	-18.9	-170.8	27.9	-34.6	0	0	0	113.9	N200 Y205	N200-P209 PolarHBondContact ND2-O 3.13Å; Y205-P209 WeakPolarHBondContact O-CA 3.46Å
210	N	89.6	Confident	90.9	Very high	114 Å²	114	51.7 Å²	51.7	61%	0.61	28%	0.277	S	S	*	.			trans	-131.3	129.1	-174.5	-62.2	-38.1	0	0	0	110.7	N200 F208	N200-N210 PolarHBondContact ND2-OD1 3.2Å; F208-N210 VanDerWaalsContact C-N 3.31Å; F208-N210 PolarHBondContact O-N 3.26Å
211	C	92.9	Very high	91	Very high	9 Å²	9	50.4 Å²	50.4	6%	0.061	27%	0.27	C	S	.	.			trans	-148.7	165	171	65.5	0	0	0	0	110.2	N200 C202 V239	N200-C211 PolarHBondContact OD1-N 3.16Å; C202-C211 HydrophobicContact CB-CB 3.9Å; C202-C211 WeakPolarHBondContact CB-SG 3.17Å; C202-C211 PolarHBondContact N-SG 3.39Å; C202-C211 WeakPolarHBondContact SG-CB 3.4Å; C202-C211 CovalentContact SG-SG 2.02Å; C202-C211 PolarHBondContact SG-SG 2.82Å; C211-V239 WeakPolarHBondContact CA-O 3.33Å; C211-V239 WeakPolarHBondContact CB-O 3.48Å
212	V	94.8	Very high	91.2	Very high	36 Å²	36	53 Å²	53	22%	0.218	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-78.6	155.5	-179	-63	0	0	0	0	111.4	P201 F215 M238 V239 S240	P201-V212 WeakPolarHBondContact CD-O 3.49Å; V212-F215 HydrophobicContact CG2-CD1 4.48Å; V212-F215 HydrophobicContact CG2-CE1 4.03Å; V212-M238 HydrophobicContact CG1-CB 3.85Å; V212-V239 PolarHBondContact N-O 3.15Å; V212-V239 VanDerWaalsContact N-O 3.08Å; V212-S240 WeakPolarHBondContact O-CB 3.4Å; V212-S240 PolarHBondContact O-OG 2.71Å
213	P	94.8	Very high	91.4	Very high	47 Å²	47	53.5 Å²	53.5	31%	0.305	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-52.6	144.5	171.8	-26.7	35.3	0	0	0	112.1	Q198 F215 S240	Q198-P213 WeakPolarHBondContact O-CB 3.48Å; Q198-P213 WeakPolarHBondContact O-CG 2.99Å; P213-F215 WeakPolarHBondContact O-CD1 3.2Å; P213-S240 PolarHBondContact O-OG 3.13Å
214	T	95.1	Very high	91.5	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.031	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-58.6	143.4	177.6	-43.4	0	0	0	0	110.8	V183 N186 S240 R241	V183-T214 HydrophobicContact CB-CG2 4.39Å; V183-T214 HydrophobicContact CG1-CG2 4.08Å; N186-T214 VanDerWaalsContact CB-O 3.28Å; N186-T214 WeakPolarHBondContact CB-O 2.93Å; N186-T214 PolarHBondContact ND2-O 3.29Å; T214-S240 VanDerWaalsContact CA-OG 3.24Å; T214-S240 WeakPolarHBondContact CA-OG 3.44Å; T214-S240 PolarHBondContact N-OG 3.09Å; T214-R241 PolarHBondContact OG1-O 2.81Å
215	F	96.2	Very high	91.9	Very high	11 Å²	11	53.4 Å²	53.4	5%	0.048	28%	0.275	C	S	.	.			trans	-146.8	151.4	178.9	60	-89	0	0	0	109.8	L146 S181 V183 D184 V212 P213 R218	L146-F215 HydrophobicContact CB-CZ 4.29Å; L146-F215 HydrophobicContact CD1-CZ 4.27Å; S181-F215 WeakPolarHBondContact OG-CE2 3.49Å; V183-F215 WeakPolarHBondContact CB-O 3.49Å; V183-F215 HydrophobicContact CG2-CD1 4.18Å; V183-F215 HydrophobicContact CG2-CE1 3.72Å; V183-F215 HydrophobicContact CG2-CE2 4.11Å; V183-F215 HydrophobicContact CG2-CZ 3.68Å; V183-F215 PolarHBondContact N-O 3.12Å; D184-F215 PolarHBondContact N-O 3.27Å; D184-F215 CarbonylContact O-C 3.5Å; V212-F215 HydrophobicContact CG2-CD1 4.48Å; V212-F215 HydrophobicContact CG2-CE1 4.03Å; P213-F215 WeakPolarHBondContact O-CD1 3.2Å; F215-R218 HydrophobicContact CD2-CB 4.22Å; F215-R218 HydrophobicContact CD2-CG 3.55Å; F215-R218 HydrophobicContact CE2-CB 4.14Å; F215-R218 HydrophobicContact CE2-CG 3.91Å; F215-R218 HydrophobicContact CG-CG 4.13Å
216	G	96.8	Very high	92.3	Very high	8 Å²	8	55.5 Å²	55.5	8%	0.082	29%	0.286	C	S	.	.	S	Bend	trans	-71	-76.8	178.7	0	0	0	0	0	111.9	F182 V183 D184	F182-G216 WeakPolarHBondContact CA-O 3.37Å; F182-G216 VanDerWaalsContact CB-O 3.23Å; F182-G216 WeakPolarHBondContact CB-O 3.28Å; V183-G216 PolarHBondContact N-O 3.48Å; D184-G216 WeakPolarHBondContact O-CA 3.26Å; D184-G216 PolarHBondContact O-N 2.94Å
217	F	98.4	Very high	92.5	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.009	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.2	177.4	168.2	-118.9	0	0	0	110.7	L143 S181 H219 A252 Q255 A256 L302 Y308	L143-F217 HydrophobicContact CD1-CD2 4.02Å; L143-F217 HydrophobicContact CD1-CE2 3.62Å; S181-F217 WeakPolarHBondContact O-CA 3.33Å; S181-F217 VanDerWaalsContact O-CD2 3.25Å; S181-F217 WeakPolarHBondContact O-CD2 3.15Å; F217-H219 HydrophobicContact CE1-CB 4.3Å; F217-H219 HydrophobicContact CZ-CB 4.07Å; F217-A252 HydrophobicContact CB-CB 3.88Å; F217-A252 HydrophobicContact CD2-CB 3.48Å; F217-A252 VanDerWaalsContact CD2-CB 3.48Å; F217-A252 HydrophobicContact CE2-CB 4.23Å; F217-A252 HydrophobicContact CG-CB 3.82Å; F217-Q255 HydrophobicContact CD1-CB 3.55Å; F217-Q255 HydrophobicContact CD1-CG 4.14Å; F217-Q255 HydrophobicContact CE1-CB 3.62Å; F217-A256 HydrophobicContact CZ-CB 4.48Å; F217-L302 HydrophobicContact CD1-CD2 3.84Å; F217-L302 HydrophobicContact CE1-CD1 4.42Å; F217-L302 HydrophobicContact CE1-CD2 3.79Å; F217-Y308 PolarHBondContact O-N 3.38Å
218	R	98.3	Very high	93	Very high	65 Å²	65	46 Å²	46	25%	0.245	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.7	174.2	-72.6	178.9	168.9	157.2	-0.5	110.2	G180 S181 F215 I220 E307	G180-R218 WeakPolarHBondContact CA-O 3.48Å; S181-R218 PolarHBondContact N-O 3.31Å; S181-R218 PolarHBondContact O-N 3.37Å; F215-R218 HydrophobicContact CD2-CB 4.22Å; F215-R218 HydrophobicContact CD2-CG 3.55Å; F215-R218 HydrophobicContact CE2-CB 4.14Å; F215-R218 HydrophobicContact CE2-CG 3.91Å; F215-R218 HydrophobicContact CG-CG 4.13Å; R218-I220 HydrophobicContact CB-CG1 4.46Å; R218-E307 HydrophobicContact CG-CG 4.1Å; R218-E307 IonicContact CZ-OE1 3.75Å; R218-E307 IonicContact NE-OE1 3.22Å; R218-E307 PolarHBondContact NE-OE1 3.1Å; R218-E307 IonicContact NH2-OE1 3.54Å; R218-E307 PolarHBondContact NH2-OE1 3.31Å
219	H	98.3	Very high	93.5	Very high	7 Å²	7	47.6 Å²	47.6	3%	0.032	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	125.2	164.8	171.3	60.3	0	0	0	109.4	Y141 F217 L221 S222 E262 I263 L302 N306	Y141-H219 AromaticContact CE2-CE1 3.86Å; Y141-H219 AromaticContact CE2-ND1 3.66Å; Y141-H219 AromaticContact CZ-ND1 3.66Å; Y141-H219 PolarHBondContact OH-ND1 3.04Å; F217-H219 HydrophobicContact CE1-CB 4.3Å; F217-H219 HydrophobicContact CZ-CB 4.07Å; H219-L221 PolarHBondContact CE1-O 2.93Å; H219-L221 VanDerWaalsContact CE1-O 3.31Å; H219-S222 VanDerWaalsContact CE1-CA 3.46Å; H219-S222 WeakPolarHBondContact CE1-CA 3.47Å; H219-S222 PolarHBondContact CE1-N 2.8Å; H219-S222 PolarHBondContact NE2-N 3.43Å; H219-S222 PolarHBondContact NE2-OG 3.5Å; H219-E262 PolarHBondContact NE2-O 3.1Å; H219-E262 VanDerWaalsContact NE2-O 3.12Å; H219-I263 HydrophobicContact CB-CD1 4.2Å; H219-I263 VanDerWaalsContact ND1-CD1 3.27Å; H219-I263 WeakPolarHBondContact ND1-CD1 3.47Å; H219-L302 HydrophobicContact CB-CD1 4.02Å; H219-N306 HydrophobicContact CB-CB 4.01Å; H219-N306 PolarHBondContact N-O 2.95Å; H219-N306 WeakPolarHBondContact O-CB 3.36Å
220	I	96.9	Very high	93.8	Very high	35 Å²	35	44 Å²	44	18%	0.179	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-49.1	-171.3	-65.6	161.1	0	0	0	110.9	F179 S181 R218 E233 Q237	F179-I220 HydrophobicContact CD1-CB 3.98Å; F179-I220 HydrophobicContact CD1-CD1 3.53Å; F179-I220 HydrophobicContact CD1-CG1 4.35Å; F179-I220 HydrophobicContact CD1-CG2 4.13Å; F179-I220 HydrophobicContact CE1-CD1 3.46Å; F179-I220 VanDerWaalsContact CE1-CD1 3.46Å; F179-I220 PolarHBondContact O-N 3.19Å; F179-I220 VanDerWaalsContact O-N 3.11Å; S181-I220 WeakPolarHBondContact OG-CD1 3.45Å; R218-I220 HydrophobicContact CB-CG1 4.46Å; I220-E233 HydrophobicContact CG2-CB 3.84Å; I220-E233 HydrophobicContact CG2-CG 4.36Å; I220-Q237 HydrophobicContact CD1-CG 4.1Å; I220-Q237 VanDerWaalsContact CD1-OE1 3.3Å
221	L	96.4	Very high	93.7	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	115	-177.2	179.8	64.2	0	0	0	110.6	G178 F179 H219 T224 R229 F230 E233	G178-L221 CarbonylContact C-O 3.59Å; G178-L221 VanDerWaalsContact CA-O 3.26Å; G178-L221 WeakPolarHBondContact CA-O 3.35Å; F179-L221 HydrophobicContact CB-CB 4.07Å; F179-L221 PolarHBondContact N-O 3.08Å; F179-L221 PolarHBondContact O-N 2.69Å; H219-L221 PolarHBondContact CE1-O 2.93Å; H219-L221 VanDerWaalsContact CE1-O 3.31Å; L221-T224 HydrophobicContact CD1-CG2 4.09Å; L221-T224 HydrophobicContact CD2-CG2 4.28Å; L221-T224 HydrophobicContact CG-CG2 4.33Å; L221-R229 HydrophobicContact CD1-CB 4.26Å; L221-R229 HydrophobicContact CD2-CB 4.42Å; L221-F230 VanDerWaalsContact CD2-CA 3.45Å; L221-F230 HydrophobicContact CD2-CB 3.87Å; L221-F230 HydrophobicContact CD2-CD2 4.24Å; L221-E233 HydrophobicContact CB-CG 4.43Å; L221-E233 HydrophobicContact CD1-CG 4.39Å
222	S	97.3	Very high	93.7	Very high	56 Å²	56	44 Å²	44	39%	0.392	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	149.4	168.8	-45	0	0	0	0	110.9	H219 T224 E262	H219-S222 VanDerWaalsContact CE1-CA 3.46Å; H219-S222 WeakPolarHBondContact CE1-CA 3.47Å; H219-S222 PolarHBondContact CE1-N 2.8Å; H219-S222 PolarHBondContact NE2-N 3.43Å; H219-S222 PolarHBondContact NE2-OG 3.5Å; S222-T224 PolarHBondContact O-N 3.17Å; S222-E262 PolarHBondContact OG-O 3.07Å
223	L	96.3	Very high	93.6	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.058	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	114.1	-179.2	-74.5	161.2	0	0	0	111.2	D139 L140 R176 I263 W265	D139-L223 HydrophobicContact CB-CD1 3.94Å; D139-L223 HydrophobicContact CB-CD2 4.02Å; L140-L223 WeakPolarHBondContact O-CD2 2.97Å; R176-L223 HydrophobicContact CB-CB 4.16Å; R176-L223 HydrophobicContact CB-CD2 4.34Å; L223-I263 HydrophobicContact CD1-CG2 4Å; L223-I263 HydrophobicContact CG-CG2 4.38Å; L223-I263 PolarHBondContact N-O 2.84Å; L223-W265 HydrophobicContact CD1-CD2 3.73Å; L223-W265 HydrophobicContact CD1-CE3 3.45Å; L223-W265 VanDerWaalsContact CD1-CE3 3.45Å; L223-W265 HydrophobicContact CD1-CG 4.23Å; L223-W265 HydrophobicContact CD1-CZ3 3.88Å
224	T	94.1	Very high	93.5	Very high	22 Å²	22	41.5 Å²	41.5	14%	0.135	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.1	-178.4	-174.6	0	0	0	0	111.1	R176 L177 L221 S222 K226	R176-T224 CarbonylContact C-O 3.58Å; R176-T224 VanDerWaalsContact CA-O 3.3Å; R176-T224 WeakPolarHBondContact CA-O 3.27Å; L177-T224 PolarHBondContact N-O 3.38Å; L177-T224 PolarHBondContact O-N 3.43Å; L177-T224 VanDerWaalsContact O-N 3.08Å; L221-T224 HydrophobicContact CD1-CG2 4.09Å; L221-T224 HydrophobicContact CD2-CG2 4.28Å; L221-T224 HydrophobicContact CG-CG2 4.33Å; S222-T224 PolarHBondContact O-N 3.17Å; T224-K226 VanDerWaalsContact C-N 3.26Å; T224-K226 HydrophobicContact CG2-CB 4.35Å; T224-K226 PolarHBondContact OG1-N 2.83Å
225	D	90.6	Very high	93.3	Very high	106 Å²	106	46.6 Å²	46.6	57%	0.567	23%	0.229	S	C	*	.	S	Bend	trans	-77	-12.3	170.1	55.1	-9	0	0	0	112.8	V227	D225-V227 PolarHBondContact O-N 3.43Å; D225-V227 VanDerWaalsContact O-N 3.15Å
226	K	90.9	Very high	93.2	Very high	132 Å²	132	52.1 Å²	52.1	57%	0.574	25%	0.253	S	S	*	.			trans	-84.3	85.9	178.9	-62.4	-176.9	-177.1	-179.1	0	111.5	T224 D228 R229	T224-K226 VanDerWaalsContact C-N 3.26Å; T224-K226 HydrophobicContact CG2-CB 4.35Å; T224-K226 PolarHBondContact OG1-N 2.83Å; K226-D228 PolarHBondContact O-N 3.34Å; K226-R229 HydrophobicContact CB-CG 4.02Å; K226-R229 WeakPolarHBondContact O-CB 3.43Å; K226-R229 PolarHBondContact O-N 3.21Å; K226-R229 VanDerWaalsContact O-N 3.09Å
227	V	84.1	Confident	93	Very high	31 Å²	31	53.2 Å²	53.2	19%	0.188	26%	0.255	C	S	.	.	H	α-helix	trans	-55.9	-36.4	-178.5	-175.4	0	0	0	0	112.8	G161 T162 A165 D225 R229 F230	G161-V227 VanDerWaalsContact O-CG1 3.25Å; G161-V227 WeakPolarHBondContact O-CG1 3.44Å; T162-V227 HydrophobicContact CG2-CG1 4.48Å; A165-V227 HydrophobicContact CB-CB 4.04Å; A165-V227 HydrophobicContact CB-CG1 3.54Å; A165-V227 HydrophobicContact CB-CG2 3.29Å; D225-V227 PolarHBondContact O-N 3.43Å; D225-V227 VanDerWaalsContact O-N 3.15Å; V227-R229 PolarHBondContact O-N 3.47Å; V227-F230 VanDerWaalsContact O-CB 3.27Å; V227-F230 WeakPolarHBondContact O-CB 3.32Å; V227-F230 PolarHBondContact O-N 3Å
228	D	87.3	Confident	92.7	Very high	110 Å²	110	57.6 Å²	57.6	59%	0.588	28%	0.277	S	S	*	.	H	α-helix	trans	-58.8	-33.6	179.9	-62.8	-36.9	0	0	0	112.5	K226 F230 N231 E232	K226-D228 PolarHBondContact O-N 3.34Å; D228-F230 VanDerWaalsContact C-N 3.26Å; D228-F230 PolarHBondContact O-N 2.89Å; D228-N231 PolarHBondContact O-N 3.09Å; D228-E232 WeakPolarHBondContact O-CG 3.32Å; D228-E232 PolarHBondContact O-N 3.05Å
229	R	90.8	Very high	92.6	Very high	110 Å²	110	54.9 Å²	54.9	42%	0.415	27%	0.268	S	S	.	.	H	α-helix	trans	-63.4	-33.1	176.4	-67.8	-163.3	68.3	-165.6	-3.5	112.5	L221 K226 V227 E232 E233	L221-R229 HydrophobicContact CD1-CB 4.26Å; L221-R229 HydrophobicContact CD2-CB 4.42Å; K226-R229 HydrophobicContact CB-CG 4.02Å; K226-R229 WeakPolarHBondContact O-CB 3.43Å; K226-R229 PolarHBondContact O-N 3.21Å; K226-R229 VanDerWaalsContact O-N 3.09Å; V227-R229 PolarHBondContact O-N 3.47Å; R229-E232 PolarHBondContact O-N 3.27Å; R229-E233 WeakPolarHBondContact O-CG 3.46Å; R229-E233 PolarHBondContact O-N 2.54Å
230	F	90	Very high	92.4	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-49.6	175.5	179.2	-88.6	0	0	0	110.6	I157 L177 F179 L221 V227 D228 E232 E233 V234	I157-F230 HydrophobicContact CG2-CE1 4.19Å; I157-F230 HydrophobicContact CG2-CZ 4.2Å; L177-F230 HydrophobicContact CD1-CD2 4.24Å; L177-F230 HydrophobicContact CD1-CE2 4.11Å; L177-F230 HydrophobicContact CD2-CB 3.81Å; L177-F230 HydrophobicContact CD2-CD1 3.89Å; L177-F230 HydrophobicContact CD2-CD2 3.48Å; L177-F230 VanDerWaalsContact CD2-CD2 3.48Å; L177-F230 HydrophobicContact CD2-CE1 4.3Å; L177-F230 HydrophobicContact CD2-CE2 3.91Å; L177-F230 HydrophobicContact CD2-CG 3.45Å; L177-F230 VanDerWaalsContact CD2-CG 3.45Å; L177-F230 HydrophobicContact CD2-CZ 4.3Å; L177-F230 HydrophobicContact CG-CB 4.37Å; L177-F230 HydrophobicContact CG-CD2 3.52Å; L177-F230 HydrophobicContact CG-CE2 3.9Å; L177-F230 HydrophobicContact CG-CG 4.01Å; F179-F230 HydrophobicContact CB-CD2 3.94Å; F179-F230 HydrophobicContact CB-CE2 3.73Å; F179-F230 AromaticContact CD2-CE2 3.62Å; F179-F230 HydrophobicContact CD2-CE2 3.62Å; F179-F230 AromaticContact CD2-CZ 3.89Å; F179-F230 HydrophobicContact CD2-CZ 3.89Å; F179-F230 HydrophobicContact CG-CE2 4.03Å; L221-F230 VanDerWaalsContact CD2-CA 3.45Å; L221-F230 HydrophobicContact CD2-CB 3.87Å; L221-F230 HydrophobicContact CD2-CD2 4.24Å; V227-F230 VanDerWaalsContact O-CB 3.27Å; V227-F230 WeakPolarHBondContact O-CB 3.32Å; V227-F230 PolarHBondContact O-N 3Å; D228-F230 VanDerWaalsContact C-N 3.26Å; D228-F230 PolarHBondContact O-N 2.89Å; F230-E232 VanDerWaalsContact C-N 3.33Å; F230-E232 PolarHBondContact O-N 3.12Å; F230-E233 PolarHBondContact O-N 3.33Å; F230-V234 HydrophobicContact CD1-CG2 3.98Å; F230-V234 HydrophobicContact CD2-CG2 4.39Å; F230-V234 HydrophobicContact CE1-CG2 3.7Å; F230-V234 HydrophobicContact CE2-CG2 4.15Å; F230-V234 HydrophobicContact CG-CG2 4.32Å; F230-V234 HydrophobicContact CZ-CG2 3.79Å; F230-V234 WeakPolarHBondContact O-CB 3.33Å; F230-V234 WeakPolarHBondContact O-CG2 3.3Å; F230-V234 PolarHBondContact O-N 3.33Å
231	N	88.1	Confident	92.3	Very high	19 Å²	19	55.2 Å²	55.2	10%	0.102	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-42.7	179.2	-64.3	-28	0	0	0	111.4	G161 T162 D228 Q235	G161-N231 VanDerWaalsContact CA-OD1 3.26Å; G161-N231 WeakPolarHBondContact CA-OD1 3.2Å; G161-N231 PolarHBondContact N-OD1 3.47Å; T162-N231 VanDerWaalsContact CG2-ND2 3.33Å; T162-N231 WeakPolarHBondContact CG2-ND2 3.27Å; D228-N231 PolarHBondContact O-N 3.09Å; N231-Q235 WeakPolarHBondContact O-CB 2.97Å; N231-Q235 WeakPolarHBondContact O-CG 3.45Å; N231-Q235 PolarHBondContact O-N 3.03Å
232	E	92	Very high	92	Very high	103 Å²	103	55.9 Å²	55.9	48%	0.481	27%	0.27	S	S	.	.	H	α-helix	trans	-59.5	-46.2	176.4	-71.6	175.7	-177.4	0	0	112.4	D228 R229 F230 K236	D228-E232 WeakPolarHBondContact O-CG 3.32Å; D228-E232 PolarHBondContact O-N 3.05Å; R229-E232 PolarHBondContact O-N 3.27Å; F230-E232 VanDerWaalsContact C-N 3.33Å; F230-E232 PolarHBondContact O-N 3.12Å; E232-K236 WeakPolarHBondContact O-CE 2.99Å; E232-K236 WeakPolarHBondContact O-CG 3.48Å
233	E	93.4	Very high	91.7	Very high	31 Å²	31	60.5 Å²	60.5	15%	0.145	28%	0.279	C	S	.	.	H	α-helix	trans	-72.8	-38.1	-178.8	-65.7	-50.1	151.2	0	0	112.5	I220 L221 R229 F230 Q235 K236 Q237	I220-E233 HydrophobicContact CG2-CB 3.84Å; I220-E233 HydrophobicContact CG2-CG 4.36Å; L221-E233 HydrophobicContact CB-CG 4.43Å; L221-E233 HydrophobicContact CD1-CG 4.39Å; R229-E233 WeakPolarHBondContact O-CG 3.46Å; R229-E233 PolarHBondContact O-N 2.54Å; F230-E233 PolarHBondContact O-N 3.33Å; E233-Q235 VanDerWaalsContact C-N 3.33Å; E233-Q235 PolarHBondContact O-N 2.88Å; E233-K236 PolarHBondContact O-N 2.81Å; E233-K236 IonicContact OE1-NZ 3.66Å; E233-K236 PolarHBondContact OE1-NZ 2.7Å; E233-K236 WeakPolarHBondContact OE2-CD 3.28Å; E233-K236 IonicContact OE2-NZ 2.89Å; E233-K236 PolarHBondContact OE2-NZ 3.3Å; E233-Q237 WeakPolarHBondContact O-CG 3.3Å; E233-Q237 PolarHBondContact O-NE2 2.84Å
234	V	91.2	Very high	91.5	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-36.6	176.7	173.1	0	0	0	0	111.3	L154 I157 R158 F179 F230 K236 Q237	L154-V234 HydrophobicContact CD1-CG1 3.94Å; I157-V234 HydrophobicContact CG2-CG1 4.04Å; R158-V234 HydrophobicContact CG-CG1 3.8Å; F179-V234 HydrophobicContact CD1-CG2 4.14Å; F179-V234 HydrophobicContact CD2-CG2 3.87Å; F179-V234 HydrophobicContact CE1-CG2 4.26Å; F179-V234 HydrophobicContact CE2-CG2 3.97Å; F179-V234 HydrophobicContact CG-CG2 3.97Å; F179-V234 HydrophobicContact CZ-CG2 4.17Å; F230-V234 HydrophobicContact CD1-CG2 3.98Å; F230-V234 HydrophobicContact CD2-CG2 4.39Å; F230-V234 HydrophobicContact CE1-CG2 3.7Å; F230-V234 HydrophobicContact CE2-CG2 4.15Å; F230-V234 HydrophobicContact CG-CG2 4.32Å; F230-V234 HydrophobicContact CZ-CG2 3.79Å; F230-V234 WeakPolarHBondContact O-CB 3.33Å; F230-V234 WeakPolarHBondContact O-CG2 3.3Å; F230-V234 PolarHBondContact O-N 3.33Å; V234-K236 PolarHBondContact O-N 2.89Å; V234-Q237 WeakPolarHBondContact O-CB 3.49Å; V234-Q237 PolarHBondContact O-N 3.08Å; V234-Q237 VanDerWaalsContact O-N 3.12Å
235	Q	91.2	Very high	91.4	Very high	112 Å²	112	63.9 Å²	63.9	52%	0.523	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-31.3	176.1	-78.3	175.2	15.4	0	0	113	R158 N231 E233 Q237	R158-Q235 HydrophobicContact CB-CG 4.4Å; R158-Q235 HydrophobicContact CG-CG 4.1Å; R158-Q235 PolarHBondContact NH2-O 3.02Å; N231-Q235 WeakPolarHBondContact O-CB 2.97Å; N231-Q235 WeakPolarHBondContact O-CG 3.45Å; N231-Q235 PolarHBondContact O-N 3.03Å; E233-Q235 VanDerWaalsContact C-N 3.33Å; E233-Q235 PolarHBondContact O-N 2.88Å; Q235-Q237 VanDerWaalsContact C-N 3.28Å; Q235-Q237 PolarHBondContact O-N 2.66Å
236	K	93.9	Very high	91.7	Very high	127 Å²	127	60.3 Å²	60.3	55%	0.552	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.9	177.8	-62.4	170.6	-155.8	164.9	0	113.2	E232 E233 V234	E232-K236 WeakPolarHBondContact O-CE 2.99Å; E232-K236 WeakPolarHBondContact O-CG 3.48Å; E233-K236 PolarHBondContact O-N 2.81Å; E233-K236 IonicContact OE1-NZ 3.66Å; E233-K236 PolarHBondContact OE1-NZ 2.7Å; E233-K236 WeakPolarHBondContact OE2-CD 3.28Å; E233-K236 IonicContact OE2-NZ 2.89Å; E233-K236 PolarHBondContact OE2-NZ 3.3Å; V234-K236 PolarHBondContact O-N 2.89Å
237	Q	93.8	Very high	92	Very high	30 Å²	30	54.3 Å²	54.3	14%	0.14	26%	0.26	C	S	.	.			trans	-75.7	150.3	-175.9	-54.2	-49	-53.4	0	0	112	L146 L154 R158 F179 I220 E233 V234 Q235	L146-Q237 HydrophobicContact CD1-CB 4.19Å; L154-Q237 HydrophobicContact CD1-CB 4.27Å; L154-Q237 HydrophobicContact CD2-CB 4.39Å; R158-Q237 PolarHBondContact NH2-O 3.02Å; F179-Q237 HydrophobicContact CE1-CG 3.91Å; I220-Q237 HydrophobicContact CD1-CG 4.1Å; I220-Q237 VanDerWaalsContact CD1-OE1 3.3Å; E233-Q237 WeakPolarHBondContact O-CG 3.3Å; E233-Q237 PolarHBondContact O-NE2 2.84Å; V234-Q237 WeakPolarHBondContact O-CB 3.49Å; V234-Q237 PolarHBondContact O-N 3.08Å; V234-Q237 VanDerWaalsContact O-N 3.12Å; Q235-Q237 VanDerWaalsContact C-N 3.28Å; Q235-Q237 PolarHBondContact O-N 2.66Å
238	M	92.8	Very high	92.6	Very high	94 Å²	94	52.9 Å²	52.9	46%	0.463	25%	0.251	S	S	.	.			trans	-135.7	144.8	175	-68.9	-174.2	66.7	0	0	108.6	V212	V212-M238 HydrophobicContact CG1-CB 3.85Å
239	V	94.5	Very high	93.1	Very high	8 Å²	8	47.7 Å²	47.7	5%	0.048	22%	0.224	C	C	.	.			trans	-65.8	159	173.7	-63.7	0	0	0	0	111.5	L146 S147 L148 K151 L154 C211 V212	L146-V239 CarbonylContact O-C 3.41Å; L146-V239 VanDerWaalsContact O-CA 3.31Å; L146-V239 WeakPolarHBondContact O-CA 3.47Å; L146-V239 WeakPolarHBondContact O-CB 3.37Å; S147-V239 WeakPolarHBondContact O-CG1 3.3Å; L148-V239 HydrophobicContact CD1-CG2 3.84Å; K151-V239 HydrophobicContact CB-CG1 4.04Å; K151-V239 HydrophobicContact CB-CG2 4.3Å; K151-V239 HydrophobicContact CD-CG1 4.07Å; K151-V239 HydrophobicContact CD-CG2 3.78Å; K151-V239 HydrophobicContact CG-CG2 4.48Å; L154-V239 HydrophobicContact CD2-CG1 4.28Å; C211-V239 WeakPolarHBondContact CA-O 3.33Å; C211-V239 WeakPolarHBondContact CB-O 3.48Å; V212-V239 PolarHBondContact N-O 3.15Å; V212-V239 VanDerWaalsContact N-O 3.08Å
240	S	95.2	Very high	93.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.204	C	C	.	.			trans	-115.7	-165.8	170.7	-164.9	0	0	0	0	109.9	L146 S147 L148 V212 P213 T214	L146-S240 PolarHBondContact O-N 3.07Å; S147-S240 CarbonylContact C-O 3.59Å; L148-S240 WeakPolarHBondContact CA-O 3.37Å; L148-S240 WeakPolarHBondContact CB-O 3.29Å; L148-S240 PolarHBondContact N-O 3.43Å; L148-S240 VanDerWaalsContact N-O 3.13Å; V212-S240 WeakPolarHBondContact O-CB 3.4Å; V212-S240 PolarHBondContact O-OG 2.71Å; P213-S240 PolarHBondContact O-OG 3.13Å; T214-S240 VanDerWaalsContact CA-OG 3.24Å; T214-S240 WeakPolarHBondContact CA-OG 3.44Å; T214-S240 PolarHBondContact N-OG 3.09Å
241	R	93.4	Very high	93.8	Very high	50 Å²	50	42.3 Å²	42.3	19%	0.189	20%	0.203	C	C	.	.			trans	-151.6	127.5	174	-178.3	-171.1	179.6	-164.5	3.3	110.6	L148 Y192 P201 T214	L148-R241 HydrophobicContact CB-CB 4.3Å; L148-R241 HydrophobicContact CB-CG 4.39Å; L148-R241 HydrophobicContact CD2-CG 4.32Å; Y192-R241 HydrophobicContact CE2-CG 4.2Å; Y192-R241 PolarHBondContact OH-NH2 2.95Å; P201-R241 HydrophobicContact CB-CB 4.02Å; P201-R241 WeakPolarHBondContact CB-O 3.43Å; P201-R241 PolarHBondContact O-NH1 3.22Å; T214-R241 PolarHBondContact OG1-O 2.81Å
242	N	90.6	Very high	94.3	Very high	17 Å²	17	41.4 Å²	41.4	9%	0.091	20%	0.198	C	C	.	.			trans	-97.3	176.8	168.9	60.6	-35.7	0	0	0	110.7	V183 Y192 D244 E247	V183-N242 HydrophobicContact CG1-CB 4.09Å; Y192-N242 WeakPolarHBondContact CE2-O 3.45Å; N242-D244 PolarHBondContact ND2-O 2.02Å; N242-E247 PolarHBondContact ND2-OE1 3.16Å; N242-E247 PolarHBondContact ND2-OE2 3Å; N242-E247 PolarHBondContact OD1-OE1 3.24Å
243	R	92.2	Very high	94.6	Very high	154 Å²	154	36.5 Å²	36.5	58%	0.581	18%	0.176	S	C	*	.	S	Bend	trans	-103.7	-45.6	-171.1	-178.9	177.2	174.2	-178.2	-2.6	113.1	P189 F190 Y192	P189-R243 WeakPolarHBondContact O-CD 3.45Å; F190-R243 WeakPolarHBondContact O-CB 3.35Å; F190-R243 PolarHBondContact O-N 2.95Å; Y192-R243 HydrophobicContact CD2-CB 4.44Å; Y192-R243 HydrophobicContact CE1-CB 4.41Å; Y192-R243 HydrophobicContact CE1-CG 4.11Å; Y192-R243 HydrophobicContact CE2-CB 4.13Å
244	D	92.3	Very high	94.8	Very high	53 Å²	53	35 Å²	35	28%	0.283	17%	0.169	S	C	.	.	S	Bend	trans	-87.6	-179	173.1	50	-20.6	0	0	0	111.2	F190 N242 H282	F190-D244 WeakPolarHBondContact CA-OD1 3.25Å; N242-D244 PolarHBondContact ND2-O 2.02Å; D244-H282 IonicContact OD2-CE1 2.83Å; D244-H282 IonicContact OD2-NE2 3.81Å; D244-H282 PolarHBondContact OD2-NE2 3.18Å
245	A	91.9	Very high	95.2	Very high	50 Å²	50	35 Å²	35	41%	0.413	17%	0.169	S	C	.	.	S	Bend	trans	-90.2	-41	-178.5	0	0	0	0	0	112.9	D279	A245-D279 WeakPolarHBondContact O-CB 3.43Å
246	P	95.9	Very high	95.5	Very high	32 Å²	32	29.7 Å²	29.7	21%	0.208	14%	0.144	C	C	.	.			trans	-66.4	147.6	178.1	-16.5	30.8	0	0	0	112.2	V280	P246-V280 CarbonylContact C-O 3.23Å; P246-V280 WeakPolarHBondContact CA-O 3.38Å; P246-V280 HydrophobicContact CB-CG2 3.91Å; P246-V280 HydrophobicContact CG-CG2 3.89Å
247	E	96.4	Very high	95.7	Very high	5 Å²	5	23.6 Å²	23.6	2%	0.023	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-117.5	158.6	-176.4	-58.2	-68	176	0	0	112	S147 F182 N242 G249 D279 V280 P281 H282	S147-E247 WeakPolarHBondContact CB-OE1 3.23Å; F182-E247 HydrophobicContact CE2-CB 4.23Å; N242-E247 PolarHBondContact ND2-OE1 3.16Å; N242-E247 PolarHBondContact ND2-OE2 3Å; N242-E247 PolarHBondContact OD1-OE1 3.24Å; E247-G249 PolarHBondContact O-N 3.13Å; E247-G249 VanDerWaalsContact O-N 3.08Å; E247-D279 HydrophobicContact CG-CB 4.31Å; E247-V280 PolarHBondContact N-O 2.82Å; E247-P281 CarbonylContact O-C 3.03Å; E247-P281 WeakPolarHBondContact O-CA 3.47Å; E247-H282 PolarHBondContact O-N 2.94Å
248	G	97.1	Very high	95.8	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.01	12%	0.118	C	C	.	.			trans	-81.8	25.8	-177.9	0	0	0	0	0	115.1	V183 D184 F250 D251	V183-G248 PolarHBondContact O-N 2.89Å; D184-G248 VanDerWaalsContact OD1-CA 3.31Å; D184-G248 WeakPolarHBondContact OD1-CA 3.39Å; D184-G248 PolarHBondContact OD1-N 2.95Å; G248-F250 PolarHBondContact O-N 3.01Å; G248-F250 VanDerWaalsContact O-N 3.13Å; G248-D251 PolarHBondContact O-N 3.49Å
249	G	97.4	Very high	96.1	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-26.7	-172.3	0	0	0	0	0	115.1	E247 A252 I253	E247-G249 PolarHBondContact O-N 3.13Å; E247-G249 VanDerWaalsContact O-N 3.08Å; G249-A252 WeakPolarHBondContact O-CB 3.24Å; G249-A252 PolarHBondContact O-N 3.43Å; G249-I253 WeakPolarHBondContact O-CG1 3.26Å; G249-I253 PolarHBondContact O-N 2.96Å
250	F	98	Very high	96.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-72.8	-30.4	179.4	-79.5	10	0	0	0	113.5	G248 A252 I253 L254 P281 L283 P317 L319 L322 F335 F348	G248-F250 PolarHBondContact O-N 3.01Å; G248-F250 VanDerWaalsContact O-N 3.13Å; F250-A252 VanDerWaalsContact C-N 3.26Å; F250-A252 PolarHBondContact O-N 3.19Å; F250-I253 HydrophobicContact CD1-CD1 3.77Å; F250-I253 HydrophobicContact CE1-CD1 4.09Å; F250-L254 WeakPolarHBondContact O-CB 3.28Å; F250-L254 PolarHBondContact O-N 2.83Å; F250-L254 VanDerWaalsContact O-N 3.13Å; F250-P281 HydrophobicContact CD1-CB 3.81Å; F250-P281 HydrophobicContact CD1-CG 4.31Å; F250-P281 HydrophobicContact CD2-CB 4.29Å; F250-P281 HydrophobicContact CE1-CB 3.75Å; F250-P281 HydrophobicContact CE1-CG 3.73Å; F250-P281 HydrophobicContact CE2-CB 4.2Å; F250-P281 HydrophobicContact CE2-CG 3.95Å; F250-P281 HydrophobicContact CG-CB 4.11Å; F250-P281 HydrophobicContact CZ-CB 3.95Å; F250-P281 HydrophobicContact CZ-CG 3.53Å; F250-L283 HydrophobicContact CD2-CD2 3.9Å; F250-L283 HydrophobicContact CE2-CD2 3.46Å; F250-L283 VanDerWaalsContact CE2-CD2 3.46Å; F250-L283 HydrophobicContact CZ-CD2 4.48Å; F250-P317 HydrophobicContact CB-CG 4.02Å; F250-P317 VanDerWaalsContact O-CG 3.32Å; F250-P317 WeakPolarHBondContact O-CG 3.27Å; F250-L319 HydrophobicContact CD2-CD2 4.39Å; F250-L319 HydrophobicContact CE2-CD2 3.46Å; F250-L319 VanDerWaalsContact CE2-CD2 3.46Å; F250-L319 HydrophobicContact CZ-CD2 3.97Å; F250-L322 HydrophobicContact CB-CD1 4Å; F250-L322 HydrophobicContact CD1-CD1 4.22Å; F250-L322 HydrophobicContact CD2-CD1 3.55Å; F250-L322 HydrophobicContact CE2-CD1 4.01Å; F250-L322 HydrophobicContact CG-CD1 3.66Å; F250-F335 HydrophobicContact CE1-CE1 4.26Å; F250-F335 HydrophobicContact CE1-CZ 4.49Å; F250-F348 HydrophobicContact CZ-CD2 4.02Å; F250-F348 HydrophobicContact CZ-CE2 4.01Å
251	D	98.4	Very high	96	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-59.7	-44.6	167.8	-83.1	-17.7	0	0	0	109.7	K185 G248 L254 Q255 H296 Y308 P317	K185-D251 IonicContact NZ-OD1 3.98Å; K185-D251 IonicContact NZ-OD2 3.39Å; K185-D251 PolarHBondContact NZ-OD2 3.24Å; G248-D251 PolarHBondContact O-N 3.49Å; D251-L254 PolarHBondContact O-N 2.98Å; D251-Q255 WeakPolarHBondContact O-CB 3.23Å; D251-Q255 WeakPolarHBondContact O-CG 3.5Å; D251-Q255 PolarHBondContact O-N 2.03Å; D251-H296 IonicContact OD1-CD2 3.85Å; D251-Y308 HydrophobicContact CB-CD1 4.21Å; D251-Y308 HydrophobicContact CB-CE1 3.93Å; D251-Y308 WeakPolarHBondContact OD2-CE1 3.39Å; D251-P317 WeakPolarHBondContact OD1-CD 3.39Å
252	A	98.5	Very high	96.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-42.6	-176.8	0	0	0	0	0	112.9	L143 F182 F217 G249 F250 L254 Q255 A256	L143-A252 HydrophobicContact CD1-CB 3.99Å; L143-A252 HydrophobicContact CD2-CB 3.81Å; L143-A252 HydrophobicContact CG-CB 4.34Å; F182-A252 HydrophobicContact CB-CB 3.57Å; F182-A252 HydrophobicContact CD1-CB 3.98Å; F182-A252 HydrophobicContact CG-CB 3.9Å; F217-A252 HydrophobicContact CB-CB 3.88Å; F217-A252 HydrophobicContact CD2-CB 3.48Å; F217-A252 VanDerWaalsContact CD2-CB 3.48Å; F217-A252 HydrophobicContact CE2-CB 4.23Å; F217-A252 HydrophobicContact CG-CB 3.82Å; G249-A252 WeakPolarHBondContact O-CB 3.24Å; G249-A252 PolarHBondContact O-N 3.43Å; F250-A252 VanDerWaalsContact C-N 3.26Å; F250-A252 PolarHBondContact O-N 3.19Å; A252-L254 VanDerWaalsContact C-N 3.32Å; A252-L254 PolarHBondContact O-N 2.95Å; A252-Q255 PolarHBondContact O-N 2.86Å; A252-A256 VanDerWaalsContact O-CB 3.25Å; A252-A256 WeakPolarHBondContact O-CB 3.42Å; A252-A256 PolarHBondContact O-N 2.79Å
253	I	98.4	Very high	96.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.1	-47.9	173.6	-68.4	170.1	0	0	0	110	L143 G249 F250 A256 A257 L273 F275 L322 L326 L333 F335	L143-I253 HydrophobicContact CD2-CG1 3.86Å; G249-I253 WeakPolarHBondContact O-CG1 3.26Å; G249-I253 PolarHBondContact O-N 2.96Å; F250-I253 HydrophobicContact CD1-CD1 3.77Å; F250-I253 HydrophobicContact CE1-CD1 4.09Å; I253-A256 PolarHBondContact O-N 3.32Å; I253-A257 WeakPolarHBondContact O-CB 3.31Å; I253-A257 PolarHBondContact O-N 3.27Å; I253-L273 HydrophobicContact CB-CD2 4.47Å; I253-L273 HydrophobicContact CG2-CD2 3.92Å; I253-F275 HydrophobicContact CD1-CB 4.4Å; I253-F275 HydrophobicContact CD1-CD1 4.46Å; I253-F275 HydrophobicContact CD1-CD2 3.55Å; I253-F275 HydrophobicContact CD1-CE2 3.8Å; I253-F275 HydrophobicContact CD1-CG 3.89Å; I253-F275 HydrophobicContact CD1-CZ 4.33Å; I253-F275 HydrophobicContact CG1-CD2 3.54Å; I253-F275 HydrophobicContact CG1-CE2 3.94Å; I253-F275 HydrophobicContact CG1-CG 4.24Å; I253-L322 HydrophobicContact CB-CD2 4.2Å; I253-L322 HydrophobicContact CG2-CD2 3.83Å; I253-L326 HydrophobicContact CG2-CD1 4.37Å; I253-L326 HydrophobicContact CG2-CD2 4.23Å; I253-L333 HydrophobicContact CD1-CD1 4.07Å; I253-L333 HydrophobicContact CD1-CD2 3.98Å; I253-L333 HydrophobicContact CG1-CD1 4.26Å; I253-L333 HydrophobicContact CG2-CD1 4.32Å; I253-L333 HydrophobicContact CG2-CD2 4.11Å; I253-F335 HydrophobicContact CD1-CE1 4.1Å
254	L	98.1	Very high	96.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.1	-47.4	-177.6	-168.2	87.2	0	0	0	111.3	F250 D251 A252 A256 A257 V258 H296 P317 L321 L322 K325	F250-L254 WeakPolarHBondContact O-CB 3.28Å; F250-L254 PolarHBondContact O-N 2.83Å; F250-L254 VanDerWaalsContact O-N 3.13Å; D251-L254 PolarHBondContact O-N 2.98Å; A252-L254 VanDerWaalsContact C-N 3.32Å; A252-L254 PolarHBondContact O-N 2.95Å; L254-A256 VanDerWaalsContact C-N 3.35Å; L254-A256 PolarHBondContact O-N 3.07Å; L254-A257 WeakPolarHBondContact O-CB 3.42Å; L254-A257 PolarHBondContact O-N 3.01Å; L254-V258 HydrophobicContact CG-CG1 4.48Å; L254-V258 WeakPolarHBondContact O-CG2 3.37Å; L254-V258 PolarHBondContact O-N 3.25Å; L254-H296 WeakPolarHBondContact CD2-CE1 3.31Å; L254-H296 WeakPolarHBondContact CD2-ND1 3.44Å; L254-H296 WeakPolarHBondContact CD2-NE2 3.5Å; L254-P317 HydrophobicContact CB-CG 4.13Å; L254-P317 HydrophobicContact CD1-CB 4.37Å; L254-P317 HydrophobicContact CD2-CB 4Å; L254-P317 HydrophobicContact CD2-CG 4.29Å; L254-L321 HydrophobicContact CD1-CG 4.18Å; L254-L321 HydrophobicContact CD2-CD2 4.45Å; L254-L322 HydrophobicContact CB-CD2 3.79Å; L254-L322 HydrophobicContact CD1-CD2 3.84Å; L254-L322 HydrophobicContact CD1-CG 4.48Å; L254-L322 HydrophobicContact CG-CD2 4.44Å; L254-K325 HydrophobicContact CD1-CB 4Å; L254-K325 HydrophobicContact CD1-CG 3.98Å
255	Q	98.4	Very high	96.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-43.4	177.8	-69.7	-57.9	-62.7	0	0	111.4	F217 D251 A252 A257 V258 C259 R299 Y308	F217-Q255 HydrophobicContact CD1-CB 3.55Å; F217-Q255 HydrophobicContact CD1-CG 4.14Å; F217-Q255 HydrophobicContact CE1-CB 3.62Å; D251-Q255 WeakPolarHBondContact O-CB 3.23Å; D251-Q255 WeakPolarHBondContact O-CG 3.5Å; D251-Q255 PolarHBondContact O-N 2.03Å; A252-Q255 PolarHBondContact O-N 2.86Å; Q255-A257 PolarHBondContact O-N 3.12Å; Q255-V258 PolarHBondContact O-N 3.33Å; Q255-C259 WeakPolarHBondContact O-CB 3.39Å; Q255-C259 PolarHBondContact O-N 2.84Å; Q255-C259 PolarHBondContact O-SG 3.28Å; Q255-R299 PolarHBondContact NE2-O 2.66Å; Q255-Y308 VanDerWaalsContact CD-CD2 3.48Å; Q255-Y308 VanDerWaalsContact CD-CE2 3.5Å; Q255-Y308 HydrophobicContact CG-CD2 3.58Å; Q255-Y308 HydrophobicContact CG-CE2 3.85Å; Q255-Y308 HydrophobicContact CG-CG 3.96Å
256	A	98.3	Very high	96.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-28.4	174.7	0	0	0	0	0	112.8	Y141 F217 A252 I253 L254 W265 L273	Y141-A256 HydrophobicContact CD1-CB 4.21Å; Y141-A256 HydrophobicContact CE1-CB 4.05Å; F217-A256 HydrophobicContact CZ-CB 4.48Å; A252-A256 VanDerWaalsContact O-CB 3.25Å; A252-A256 WeakPolarHBondContact O-CB 3.42Å; A252-A256 PolarHBondContact O-N 2.79Å; I253-A256 PolarHBondContact O-N 3.32Å; L254-A256 VanDerWaalsContact C-N 3.35Å; L254-A256 PolarHBondContact O-N 3.07Å; A256-W265 PolarHBondContact O-NE1 3.49Å; A256-L273 HydrophobicContact CB-CD1 4.24Å; A256-L273 HydrophobicContact CB-CD2 4.42Å
257	A	97.1	Very high	96.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-79.9	-40.8	178.1	0	0	0	0	0	113.7	I253 L254 Q255 L326 N329 I331	I253-A257 WeakPolarHBondContact O-CB 3.31Å; I253-A257 PolarHBondContact O-N 3.27Å; L254-A257 WeakPolarHBondContact O-CB 3.42Å; L254-A257 PolarHBondContact O-N 3.01Å; Q255-A257 PolarHBondContact O-N 3.12Å; A257-L326 HydrophobicContact CB-CD2 4.08Å; A257-N329 PolarHBondContact O-ND2 2.87Å; A257-N329 VanDerWaalsContact O-ND2 3.17Å; A257-I331 VanDerWaalsContact CA-CD1 3.43Å; A257-I331 HydrophobicContact CB-CD1 3.69Å
258	V	97.8	Very high	95.4	Very high	24 Å²	24	32.8 Å²	32.8	15%	0.145	16%	0.155	C	C	.	.	H	α-helix	trans	-92.3	-26.5	-172	-57.2	0	0	0	0	113.9	L254 Q255 K260 R299 C300 K325	L254-V258 HydrophobicContact CG-CG1 4.48Å; L254-V258 WeakPolarHBondContact O-CG2 3.37Å; L254-V258 PolarHBondContact O-N 3.25Å; Q255-V258 PolarHBondContact O-N 3.33Å; V258-K260 PolarHBondContact O-N 2.89Å; V258-R299 VanDerWaalsContact CG2-C 3.5Å; V258-C300 HydrophobicContact CG2-CB 4.09Å; V258-K325 HydrophobicContact CG1-CB 3.97Å; V258-K325 HydrophobicContact CG1-CD 4.35Å; V258-K325 HydrophobicContact CG1-CG 3.92Å
259	C	97.6	Very high	94.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.			trans	-80.6	64.3	178.1	-61.8	0	0	0	0	111.7	Q255 E261 E262 I263 C300 L302	Q255-C259 WeakPolarHBondContact O-CB 3.39Å; Q255-C259 PolarHBondContact O-N 2.84Å; Q255-C259 PolarHBondContact O-SG 3.28Å; C259-E261 VanDerWaalsContact C-N 3.33Å; C259-E261 PolarHBondContact O-N 3.38Å; C259-E262 VanDerWaalsContact CA-OE2 3.25Å; C259-E262 WeakPolarHBondContact CA-OE2 3.24Å; C259-E262 HydrophobicContact CB-CB 4.24Å; C259-E262 HydrophobicContact CB-CG 4.47Å; C259-E262 WeakPolarHBondContact CB-OE2 3.4Å; C259-I263 HydrophobicContact CB-CG1 4.27Å; C259-I263 WeakPolarHBondContact O-CB 3.41Å; C259-I263 WeakPolarHBondContact O-CG1 3.42Å; C259-I263 PolarHBondContact O-N 2.82Å; C259-C300 VanDerWaalsContact CA-SG 3.51Å; C259-C300 HydrophobicContact CB-CB 3.97Å; C259-C300 WeakPolarHBondContact CB-SG 3.49Å; C259-C300 WeakPolarHBondContact SG-CA 3.17Å; C259-C300 WeakPolarHBondContact SG-CB 3.44Å; C259-C300 CovalentContact SG-SG 2.03Å; C259-C300 PolarHBondContact SG-SG 3.44Å; C259-L302 HydrophobicContact CB-CD1 3.89Å; C259-L302 HydrophobicContact CB-CG 4.47Å
260	K	94.6	Very high	94.4	Very high	99 Å²	99	33.3 Å²	33.3	43%	0.43	16%	0.158	S	C	.	.	H	α-helix	trans	-59.3	-40.9	-170.7	-67.3	176.9	-178.2	173.5	0	113.6	V258 G264 W265 N329	V258-K260 PolarHBondContact O-N 2.89Å; K260-G264 WeakPolarHBondContact O-CA 3.46Å; K260-G264 PolarHBondContact O-N 3.3Å; K260-W265 PolarHBondContact O-N 3.01Å; K260-N329 VanDerWaalsContact CE-CG 3.46Å; K260-N329 WeakPolarHBondContact CE-OD1 3.32Å; K260-N329 PolarHBondContact NZ-OD1 3.34Å
261	E	94	Very high	94.2	Very high	182 Å²	182	34 Å²	34	85%	0.85	16%	0.161	S	C	*	.	H	α-helix	trans	-77.2	-40.1	-172.5	-62.1	-171.4	171.9	0	0	111	C259	C259-E261 VanDerWaalsContact C-N 3.33Å; C259-E261 PolarHBondContact O-N 3.38Å
262	E	95.8	Very high	93.9	Very high	70 Å²	70	33.9 Å²	33.9	33%	0.327	16%	0.161	S	C	.	.	H	α-helix	trans	-69.7	-47	-179.6	-56.9	81.7	171.7	0	0	110.8	H219 S222 C259 L302	H219-E262 PolarHBondContact NE2-O 3.1Å; H219-E262 VanDerWaalsContact NE2-O 3.12Å; S222-E262 PolarHBondContact OG-O 3.07Å; C259-E262 VanDerWaalsContact CA-OE2 3.25Å; C259-E262 WeakPolarHBondContact CA-OE2 3.24Å; C259-E262 HydrophobicContact CB-CB 4.24Å; C259-E262 HydrophobicContact CB-CG 4.47Å; C259-E262 WeakPolarHBondContact CB-OE2 3.4Å; E262-L302 HydrophobicContact CB-CD1 3.92Å; E262-L302 HydrophobicContact CG-CD1 4.24Å
263	I	97.9	Very high	93.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-71.1	-38.5	176.2	-57.7	-53.7	0	0	0	111.1	Y141 H219 L223 C259 W265	Y141-I263 HydrophobicContact CD2-CG2 3.53Å; Y141-I263 HydrophobicContact CE1-CD1 4.47Å; Y141-I263 HydrophobicContact CE2-CD1 3.84Å; Y141-I263 HydrophobicContact CE2-CG2 3.76Å; Y141-I263 HydrophobicContact CG-CG2 4.12Å; H219-I263 HydrophobicContact CB-CD1 4.2Å; H219-I263 VanDerWaalsContact ND1-CD1 3.27Å; H219-I263 WeakPolarHBondContact ND1-CD1 3.47Å; L223-I263 HydrophobicContact CD1-CG2 4Å; L223-I263 HydrophobicContact CG-CG2 4.38Å; L223-I263 PolarHBondContact N-O 2.84Å; C259-I263 HydrophobicContact CB-CG1 4.27Å; C259-I263 WeakPolarHBondContact O-CB 3.41Å; C259-I263 WeakPolarHBondContact O-CG1 3.42Å; C259-I263 PolarHBondContact O-N 2.82Å; I263-W265 HydrophobicContact CG2-CD2 4.27Å; I263-W265 HydrophobicContact CG2-CG 4.4Å; I263-W265 HydrophobicContact CG2-CZ2 4.13Å
264	G	96.3	Very high	93.6	Very high	24 Å²	24	34 Å²	34	25%	0.247	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	32.7	175.4	0	0	0	0	0	115.3	K260 R266	K260-G264 WeakPolarHBondContact O-CA 3.46Å; K260-G264 PolarHBondContact O-N 3.3Å; G264-R266 PolarHBondContact O-N 3.3Å
265	W	94.8	Very high	93.6	Very high	25 Å²	25	34 Å²	34	10%	0.095	16%	0.161	C	C	.	.			trans	-61.6	125.9	178.5	-66.6	114.8	0	0	0	111.7	D139 Y141 L223 A256 K260 I263 H271 I331	D139-W265 HydrophobicContact CB-CE3 3.66Å; D139-W265 HydrophobicContact CB-CZ3 3.63Å; Y141-W265 VanDerWaalsContact CB-CH2 3.44Å; Y141-W265 HydrophobicContact CG-CZ2 4.36Å; L223-W265 HydrophobicContact CD1-CD2 3.73Å; L223-W265 HydrophobicContact CD1-CE3 3.45Å; L223-W265 VanDerWaalsContact CD1-CE3 3.45Å; L223-W265 HydrophobicContact CD1-CG 4.23Å; L223-W265 HydrophobicContact CD1-CZ3 3.88Å; A256-W265 PolarHBondContact O-NE1 3.49Å; K260-W265 PolarHBondContact O-N 3.01Å; I263-W265 HydrophobicContact CG2-CD2 4.27Å; I263-W265 HydrophobicContact CG2-CG 4.4Å; I263-W265 HydrophobicContact CG2-CZ2 4.13Å; W265-H271 HydrophobicContact CD2-CB 4.26Å; W265-H271 HydrophobicContact CE3-CB 3.57Å; W265-H271 AromaticContact CE3-CD2 3.44Å; W265-H271 VanDerWaalsContact CE3-CD2 3.44Å; W265-H271 AromaticContact CE3-CG 3.49Å; W265-H271 VanDerWaalsContact CE3-CG 3.49Å; W265-H271 HydrophobicContact CH2-CB 4.16Å; W265-H271 HydrophobicContact CZ3-CB 3.52Å; W265-H271 AromaticContact CZ3-CG 3.98Å; W265-I331 HydrophobicContact CZ2-CD1 4.18Å
266	R	90.8	Very high	93.4	Very high	36 Å²	36	34 Å²	34	14%	0.136	16%	0.161	C	C	.	.			trans	-78.7	137	178.2	-68.6	-176.6	-72.8	-179.6	-6.3	111.3	V138 D139 N174 G264 E268 A269 H271	V138-R266 PolarHBondContact O-NH2 3.36Å; V138-R266 VanDerWaalsContact O-NH2 3.09Å; D139-R266 IonicContact OD1-CZ 3.74Å; D139-R266 IonicContact OD1-NE 2.98Å; D139-R266 PolarHBondContact OD1-NE 3.3Å; D139-R266 IonicContact OD1-NH2 3.2Å; D139-R266 PolarHBondContact OD1-NH2 3.04Å; D139-R266 WeakPolarHBondContact OD2-CB 3.44Å; D139-R266 WeakPolarHBondContact OD2-CG 3.45Å; D139-R266 PolarHBondContact OD2-N 3.43Å; D139-R266 IonicContact OD2-NE 2.68Å; D139-R266 PolarHBondContact OD2-NE 3.2Å; N174-R266 PolarHBondContact ND2-NH1 3.42Å; N174-R266 PolarHBondContact O-NH2 3.32Å; N174-R266 PolarHBondContact OD1-NH1 3.5Å; G264-R266 PolarHBondContact O-N 3.3Å; R266-E268 PolarHBondContact O-N 3.48Å; R266-A269 HydrophobicContact CB-CB 3.96Å; R266-H271 PolarHBondContact O-NE2 3.04Å
267	K	83.5	Confident	93.2	Very high	184 Å²	184	34 Å²	34	80%	0.8	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.3	177.5	-63.1	-176.8	-179.2	179.1	0	114.5	K450	K267-K450 WeakPolarHBondContact O-CD 3.41Å
268	E	79.9	Confident	93.1	Very high	41 Å²	41	36.2 Å²	36.2	19%	0.192	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	53.6	-173.6	-70.1	170.4	-154.1	0	0	111.6	P137 R266 K450	P137-E268 WeakPolarHBondContact CG-O 3.42Å; R266-E268 PolarHBondContact O-N 3.48Å; E268-K450 HydrophobicContact CG-CD 3.57Å; E268-K450 IonicContact OE1-NZ 2.76Å; E268-K450 PolarHBondContact OE1-NZ 2.84Å
269	A	87.1	Confident	92.9	Very high	8 Å²	8	37.2 Å²	37.2	7%	0.066	18%	0.178	C	C	.	.	S	Bend	trans	-144.1	157.7	176	0	0	0	0	0	111.1	P137 D139 R266 H271	P137-A269 HydrophobicContact CB-CB 3.99Å; P137-A269 CarbonylContact O-C 3.55Å; P137-A269 WeakPolarHBondContact O-CA 3.32Å; D139-A269 HydrophobicContact CB-CB 4.47Å; R266-A269 HydrophobicContact CB-CB 3.96Å; A269-H271 PolarHBondContact O-CD2 2.87Å; A269-H271 PolarHBondContact O-N 2.63Å
270	Y	87.7	Confident	92.8	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.02	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	123.5	161.9	-76.7	-65	0	0	0	109.1	Y136 P137 D139 F332 Y375 F449	Y136-Y270 AromaticContact CD1-CD2 3.49Å; Y136-Y270 HydrophobicContact CD1-CD2 3.49Å; Y136-Y270 VanDerWaalsContact CD1-CD2 3.49Å; Y136-Y270 AromaticContact CD1-CE2 3.59Å; Y136-Y270 HydrophobicContact CD1-CE2 3.59Å; Y136-Y270 HydrophobicContact CD1-CG 4.22Å; Y136-Y270 HydrophobicContact CE1-CD2 4.27Å; Y136-Y270 HydrophobicContact CE1-CE2 4.39Å; Y136-Y270 HydrophobicContact CG-CD2 4.31Å; Y136-Y270 HydrophobicContact CG-CE2 4.09Å; P137-Y270 PolarHBondContact O-N 2.84Å; D139-Y270 PolarHBondContact N-O 2.94Å; Y270-F332 HydrophobicContact CD1-CD2 4.47Å; Y270-F332 AromaticContact CD1-CE2 3.89Å; Y270-F332 HydrophobicContact CD1-CE2 3.89Å; Y270-F332 HydrophobicContact CE1-CE2 4.29Å; Y270-Y375 HydrophobicContact CD2-CE2 4.37Å; Y270-F449 HydrophobicContact CE1-CE2 4.43Å; Y270-F449 WeakPolarHBondContact OH-CZ 3Å
271	H	92.6	Very high	92.9	Very high	14 Å²	14	34.9 Å²	34.9	7%	0.065	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	108	176	-54.2	154.2	0	0	0	109.8	W265 R266 A269 N329 N330 I331 F332	W265-H271 HydrophobicContact CD2-CB 4.26Å; W265-H271 HydrophobicContact CE3-CB 3.57Å; W265-H271 AromaticContact CE3-CD2 3.44Å; W265-H271 VanDerWaalsContact CE3-CD2 3.44Å; W265-H271 AromaticContact CE3-CG 3.49Å; W265-H271 VanDerWaalsContact CE3-CG 3.49Å; W265-H271 HydrophobicContact CH2-CB 4.16Å; W265-H271 HydrophobicContact CZ3-CB 3.52Å; W265-H271 AromaticContact CZ3-CG 3.98Å; R266-H271 PolarHBondContact O-NE2 3.04Å; A269-H271 PolarHBondContact O-CD2 2.87Å; A269-H271 PolarHBondContact O-N 2.63Å; H271-N329 PolarHBondContact ND1-O 3.12Å; H271-N330 WeakPolarHBondContact CB-O 3.38Å; H271-N330 PolarHBondContact ND1-O 3.48Å; H271-I331 HydrophobicContact CB-CB 4.33Å; H271-I331 HydrophobicContact CB-CG1 3.82Å; H271-F332 PolarHBondContact O-N 3.3Å
272	L	93.3	Very high	93.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.1	175.2	-55.5	-177.9	0	0	0	109	V138 D139 L140 Y141 F332 I334 Y375 I378	V138-L272 HydrophobicContact CG1-CD1 3.75Å; V138-L272 HydrophobicContact CG1-CG 4.11Å; D139-L272 PolarHBondContact O-N 3.33Å; L140-L272 WeakPolarHBondContact CA-O 3.41Å; L140-L272 HydrophobicContact CD1-CD1 4.47Å; L140-L272 HydrophobicContact CG-CB 4.33Å; Y141-L272 PolarHBondContact N-O 3.18Å; L272-F332 HydrophobicContact CD2-CB 4Å; L272-I334 HydrophobicContact CB-CD1 4.46Å; L272-Y375 HydrophobicContact CD1-CD2 4.24Å; L272-I378 HydrophobicContact CD2-CD1 3.74Å
273	L	95.7	Very high	93.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	107.2	173.7	178.1	59.2	0	0	0	108.4	Y141 L143 I253 A256 L326 I331 F332 L333 I334	Y141-L273 HydrophobicContact CD1-CD1 3.65Å; Y141-L273 HydrophobicContact CG-CD1 4.35Å; L143-L273 HydrophobicContact CB-CD1 3.98Å; L143-L273 HydrophobicContact CD2-CD1 4.36Å; I253-L273 HydrophobicContact CB-CD2 4.47Å; I253-L273 HydrophobicContact CG2-CD2 3.92Å; A256-L273 HydrophobicContact CB-CD1 4.24Å; A256-L273 HydrophobicContact CB-CD2 4.42Å; L273-L326 HydrophobicContact CD2-CD2 4.37Å; L273-I331 HydrophobicContact CB-CG2 3.53Å; L273-I331 HydrophobicContact CD2-CG2 4.15Å; L273-F332 PolarHBondContact N-O 3.12Å; L273-L333 HydrophobicContact CB-CD1 4.34Å; L273-L333 HydrophobicContact CD2-CD1 3.98Å; L273-L333 HydrophobicContact CG-CD1 3.91Å; L273-L333 WeakPolarHBondContact O-CA 3.23Å; L273-I334 PolarHBondContact O-N 3.49Å
274	V	95.4	Very high	93.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	117.2	177.4	-178.7	0	0	0	0	107.9	L140 Y141 Y142 L143 I334 A336 I371	L140-V274 HydrophobicContact CD1-CG2 4.12Å; L140-V274 HydrophobicContact CD2-CG2 4.07Å; L140-V274 HydrophobicContact CG-CG2 4.11Å; Y141-V274 PolarHBondContact O-N 3.21Å; Y142-V274 HydrophobicContact CD2-CB 4.16Å; Y142-V274 HydrophobicContact CD2-CG1 4.08Å; Y142-V274 HydrophobicContact CE2-CG1 3.93Å; L143-V274 WeakPolarHBondContact CA-O 3.37Å; L143-V274 WeakPolarHBondContact CB-O 3.48Å; L143-V274 PolarHBondContact N-O 3.4Å; V274-I334 HydrophobicContact CG2-CD1 4.25Å; V274-A336 HydrophobicContact CG1-CB 4.25Å; V274-I371 HydrophobicContact CG2-CD1 4.07Å; V274-I371 HydrophobicContact CG2-CG1 3.86Å
275	F	96.5	Very high	93.1	Very high	1 Å²	1	33 Å²	33	0%	0.004	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	109.7	176.6	178.1	-96.2	0	0	0	109.3	L143 F182 I253 T277 L333 I334 F335 A336 Y345	L143-F275 HydrophobicContact CD2-CD2 3.96Å; L143-F275 HydrophobicContact CG-CD2 4.29Å; F182-F275 HydrophobicContact CD1-CE2 4.26Å; F182-F275 AromaticContact CE1-CD2 3.8Å; F182-F275 HydrophobicContact CE1-CD2 3.8Å; F182-F275 AromaticContact CE1-CE2 3.32Å; F182-F275 HydrophobicContact CE1-CE2 3.32Å; F182-F275 HydrophobicContact CE1-CZ 4.07Å; F182-F275 HydrophobicContact CE2-CE2 4.02Å; F182-F275 HydrophobicContact CE2-CZ 4.11Å; F182-F275 HydrophobicContact CZ-CD2 4.02Å; F182-F275 HydrophobicContact CZ-CE1 4.43Å; F182-F275 AromaticContact CZ-CE2 3.17Å; F182-F275 HydrophobicContact CZ-CE2 3.17Å; F182-F275 AromaticContact CZ-CZ 3.43Å; F182-F275 HydrophobicContact CZ-CZ 3.43Å; F182-F275 VanDerWaalsContact CZ-CZ 3.43Å; I253-F275 HydrophobicContact CD1-CB 4.4Å; I253-F275 HydrophobicContact CD1-CD1 4.46Å; I253-F275 HydrophobicContact CD1-CD2 3.55Å; I253-F275 HydrophobicContact CD1-CE2 3.8Å; I253-F275 HydrophobicContact CD1-CG 3.89Å; I253-F275 HydrophobicContact CD1-CZ 4.33Å; I253-F275 HydrophobicContact CG1-CD2 3.54Å; I253-F275 HydrophobicContact CG1-CE2 3.94Å; I253-F275 HydrophobicContact CG1-CG 4.24Å; F275-T277 HydrophobicContact CD1-CG2 4Å; F275-T277 HydrophobicContact CE1-CG2 3.28Å; F275-T277 HydrophobicContact CZ-CG2 3.92Å; F275-L333 HydrophobicContact CB-CD1 3.77Å; F275-I334 PolarHBondContact N-O 3.48Å; F275-F335 HydrophobicContact CB-CD1 4.27Å; F275-F335 AromaticContact CD1-CD1 3.64Å; F275-F335 HydrophobicContact CD1-CD1 3.64Å; F275-F335 HydrophobicContact CD1-CE1 4.07Å; F275-F335 HydrophobicContact CE1-CD1 4.32Å; F275-F335 HydrophobicContact CG-CD1 4.25Å; F275-A336 PolarHBondContact O-N 2.04Å; F275-Y345 HydrophobicContact CD1-CE1 4.34Å; F275-Y345 AromaticContact CE1-CE1 3.82Å; F275-Y345 HydrophobicContact CE1-CE1 3.82Å
276	A	94.9	Very high	93.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120	-177.6	0	0	0	0	0	111	Y142 L143 D145 A336 L360	Y142-A276 HydrophobicContact CE1-CB 4.14Å; L143-A276 PolarHBondContact O-N 3.12Å; D145-A276 VanDerWaalsContact CB-O 3.27Å; D145-A276 WeakPolarHBondContact CB-O 3.4Å; D145-A276 PolarHBondContact N-O 3.08Å; A276-A336 WeakPolarHBondContact CA-O 3.43Å; A276-L360 HydrophobicContact CB-CD2 4.28Å
277	T	94.9	Very high	93.6	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	157.8	176.4	-176.8	0	0	0	0	111.1	D145 F275 D279 A336 V337 Y345	D145-T277 PolarHBondContact OD2-OG1 3.02Å; F275-T277 HydrophobicContact CD1-CG2 4Å; F275-T277 HydrophobicContact CE1-CG2 3.28Å; F275-T277 HydrophobicContact CZ-CG2 3.92Å; T277-D279 PolarHBondContact OG1-N 3.14Å; T277-A336 PolarHBondContact N-O 2.85Å; T277-V337 HydrophobicContact CG2-CG1 3.97Å; T277-V337 WeakPolarHBondContact O-CA 3.21Å; T277-Y345 HydrophobicContact CG2-CE2 4.46Å; T277-Y345 WeakPolarHBondContact CG2-OH 3.06Å
278	D	93.3	Very high	94.2	Very high	45 Å²	45	33 Å²	33	24%	0.241	17%	0.166	C	C	.	.	S	Bend	trans	-113.7	4.6	174.5	76.5	-37.1	0	0	0	114.5	S149 M150 T338 L341	S149-D278 WeakPolarHBondContact CB-OD2 3.18Å; S149-D278 VanDerWaalsContact OG-CG 3.31Å; S149-D278 PolarHBondContact OG-OD1 2.95Å; S149-D278 PolarHBondContact OG-OD2 3.47Å; S149-D278 VanDerWaalsContact OG-OD2 3.05Å; M150-D278 HydrophobicContact SD-CB 3.77Å; M150-D278 VanDerWaalsContact SD-OD1 3.42Å; D278-T338 HydrophobicContact CB-CG2 3.55Å; D278-L341 WeakPolarHBondContact O-CD1 3.33Å
279	D	94.9	Very high	95	Very high	46 Å²	46	37.3 Å²	37.3	25%	0.246	19%	0.19	C	C	.	.	S	Bend	trans	-126.9	174.8	174.8	-136.8	-42.9	0	0	0	113.6	A245 E247 T277 L341 Y345	A245-D279 WeakPolarHBondContact O-CB 3.43Å; E247-D279 HydrophobicContact CG-CB 4.31Å; T277-D279 PolarHBondContact OG1-N 3.14Å; D279-L341 VanDerWaalsContact CA-CD1 3.42Å; D279-L341 VanDerWaalsContact O-CD1 3.29Å; D279-L341 WeakPolarHBondContact O-CD1 3.25Å; D279-Y345 PolarHBondContact O-OH 3.31Å; D279-Y345 VanDerWaalsContact O-OH 3.05Å
280	V	95.2	Very high	95.3	Very high	39 Å²	39	37.8 Å²	37.8	24%	0.236	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-77	153.8	179.5	-64.9	0	0	0	0	111.5	P246 E247 L341 I344	P246-V280 CarbonylContact C-O 3.23Å; P246-V280 WeakPolarHBondContact CA-O 3.38Å; P246-V280 HydrophobicContact CB-CG2 3.91Å; P246-V280 HydrophobicContact CG-CG2 3.89Å; E247-V280 PolarHBondContact N-O 2.82Å; V280-L341 HydrophobicContact CG1-CD2 3.75Å; V280-I344 HydrophobicContact CG1-CD1 3.93Å
281	P	96.5	Very high	95.7	Very high	10 Å²	10	40.2 Å²	40.2	7%	0.065	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-88.9	150.4	175.9	34	-27.4	0	0	0	111.3	E247 F250 Y345 F348	E247-P281 CarbonylContact O-C 3.03Å; E247-P281 WeakPolarHBondContact O-CA 3.47Å; F250-P281 HydrophobicContact CD1-CB 3.81Å; F250-P281 HydrophobicContact CD1-CG 4.31Å; F250-P281 HydrophobicContact CD2-CB 4.29Å; F250-P281 HydrophobicContact CE1-CB 3.75Å; F250-P281 HydrophobicContact CE1-CG 3.73Å; F250-P281 HydrophobicContact CE2-CB 4.2Å; F250-P281 HydrophobicContact CE2-CG 3.95Å; F250-P281 HydrophobicContact CG-CB 4.11Å; F250-P281 HydrophobicContact CZ-CB 3.95Å; F250-P281 HydrophobicContact CZ-CG 3.53Å; P281-Y345 VanDerWaalsContact CD-OH 3.28Å; P281-Y345 WeakPolarHBondContact CD-OH 3.41Å; P281-Y345 HydrophobicContact CG-CE1 4.36Å; P281-F348 HydrophobicContact CG-CE2 3.7Å; P281-F348 HydrophobicContact CG-CZ 4.21Å
282	H	97.8	Very high	95.9	Very high	8 Å²	8	40 Å²	40	4%	0.037	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-66.6	145.6	159	-89.8	-57.1	0	0	0	111.6	D184 F190 D244 E247 D286 Y316	D184-H282 IonicContact OD1-CD2 2.88Å; D184-H282 IonicContact OD2-CD2 2.65Å; D184-H282 PolarHBondContact OD2-CD2 3.49Å; D184-H282 IonicContact OD2-NE2 3.73Å; F190-H282 AromaticContact CD1-NE2 3.48Å; F190-H282 WeakPolarHBondContact CD1-NE2 3.27Å; F190-H282 AromaticContact CE1-CE1 3.88Å; F190-H282 AromaticContact CE1-NE2 3.74Å; D244-H282 IonicContact OD2-CE1 2.83Å; D244-H282 IonicContact OD2-NE2 3.81Å; D244-H282 PolarHBondContact OD2-NE2 3.18Å; E247-H282 PolarHBondContact O-N 2.94Å; H282-D286 HydrophobicContact CB-CB 4.42Å; H282-D286 IonicContact CE1-OD2 3.58Å; H282-D286 IonicContact CG-OD2 2.7Å; H282-D286 WeakPolarHBondContact ND1-CB 3.46Å; H282-D286 IonicContact ND1-OD2 2.65Å; H282-D286 PolarHBondContact ND1-OD2 3.08Å; H282-Y316 HydrophobicContact CB-CD1 3.78Å; H282-Y316 HydrophobicContact CB-CD2 3.76Å; H282-Y316 HydrophobicContact CB-CE1 3.53Å; H282-Y316 HydrophobicContact CB-CE2 3.53Å; H282-Y316 HydrophobicContact CB-CG 3.88Å; H282-Y316 AromaticContact CD2-CZ 3.63Å; H282-Y316 PolarHBondContact CD2-OH 2.76Å; H282-Y316 VanDerWaalsContact CD2-OH 3.25Å; H282-Y316 AromaticContact CG-CE2 3.72Å; H282-Y316 AromaticContact CG-CZ 3.57Å
283	L	96.6	Very high	96.1	Very high	63 Å²	63	45.5 Å²	45.5	33%	0.33	26%	0.255	S	S	.	.			trans	-112.6	163.1	179	-59.5	-179.6	0	0	0	111.1	F250 L285 D286 F348	F250-L283 HydrophobicContact CD2-CD2 3.9Å; F250-L283 HydrophobicContact CE2-CD2 3.46Å; F250-L283 VanDerWaalsContact CE2-CD2 3.46Å; F250-L283 HydrophobicContact CZ-CD2 4.48Å; L283-L285 PolarHBondContact O-N 2.93Å; L283-D286 PolarHBondContact N-OD2 3.36Å; L283-D286 VanDerWaalsContact O-CB 3.26Å; L283-D286 WeakPolarHBondContact O-CB 3.4Å; L283-D286 PolarHBondContact O-N 3.08Å; L283-F348 HydrophobicContact CD2-CZ 4.27Å
284	A	97.1	Very high	96.1	Very high	33 Å²	33	50.8 Å²	50.8	27%	0.273	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	140.8	168.9	0	0	0	0	0	111	D286 Y316	A284-D286 VanDerWaalsContact C-N 3.33Å; A284-Y316 WeakPolarHBondContact CA-O 3.42Å; A284-Y316 WeakPolarHBondContact CB-O 3.34Å
285	L	97.4	Very high	96.2	Very high	133 Å²	133	55.5 Å²	55.5	70%	0.696	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-14.4	-171.8	-49	175.7	0	0	0	115.8	L283 G287 R288 D315	L283-L285 PolarHBondContact O-N 2.93Å; L285-G287 VanDerWaalsContact C-N 3.28Å; L285-G287 PolarHBondContact O-N 3.28Å; L285-R288 WeakPolarHBondContact O-CB 3.32Å; L285-R288 PolarHBondContact O-N 3.46Å; L285-D315 WeakPolarHBondContact CA-OD2 3.43Å; L285-D315 PolarHBondContact N-OD1 3.48Å; L285-D315 PolarHBondContact N-OD2 2.98Å
286	D	97.8	Very high	96.3	Very high	55 Å²	55	56.2 Å²	56.2	29%	0.294	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-67.1	-32.8	174.4	-70.7	-14.4	0	0	0	111.7	H282 L283 A284 R288 L289 Y316	H282-D286 HydrophobicContact CB-CB 4.42Å; H282-D286 IonicContact CE1-OD2 3.58Å; H282-D286 IonicContact CG-OD2 2.7Å; H282-D286 WeakPolarHBondContact ND1-CB 3.46Å; H282-D286 IonicContact ND1-OD2 2.65Å; H282-D286 PolarHBondContact ND1-OD2 3.08Å; L283-D286 PolarHBondContact N-OD2 3.36Å; L283-D286 VanDerWaalsContact O-CB 3.26Å; L283-D286 WeakPolarHBondContact O-CB 3.4Å; L283-D286 PolarHBondContact O-N 3.08Å; A284-D286 VanDerWaalsContact C-N 3.33Å; D286-R288 PolarHBondContact O-N 2.9Å; D286-L289 WeakPolarHBondContact O-CB 3.04Å; D286-L289 PolarHBondContact O-N 2.83Å; D286-Y316 HydrophobicContact CB-CD2 4.11Å; D286-Y316 HydrophobicContact CB-CE2 4.1Å
287	G	96.9	Very high	96.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-58.4	-20.5	176.6	0	0	0	0	0	113.3	L285 L289 G290 G291 L292 D315	L285-G287 VanDerWaalsContact C-N 3.28Å; L285-G287 PolarHBondContact O-N 3.28Å; G287-L289 PolarHBondContact O-N 2.89Å; G287-G290 CarbonylContact O-C 3.6Å; G287-G290 WeakPolarHBondContact O-CA 3.15Å; G287-G290 PolarHBondContact O-N 3.05Å; G287-G291 PolarHBondContact O-N 3.25Å; G287-L292 CarbonylContact C-O 3.6Å; G287-L292 WeakPolarHBondContact O-CB 3.47Å; G287-L292 PolarHBondContact O-N 3.42Å; G287-D315 WeakPolarHBondContact CA-OD1 3.44Å; G287-D315 PolarHBondContact N-OD1 3.21Å
288	R	97.2	Very high	96.5	Very high	190 Å²	190	59.6 Å²	59.6	72%	0.717	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-56.4	-31.9	174.2	-172.5	178.3	177.5	-177.1	0.1	112.3	L285 D286 G290 G291 L292	L285-R288 WeakPolarHBondContact O-CB 3.32Å; L285-R288 PolarHBondContact O-N 3.46Å; D286-R288 PolarHBondContact O-N 2.9Å; R288-G290 VanDerWaalsContact C-N 3.27Å; R288-G290 PolarHBondContact O-N 3.42Å; R288-G291 PolarHBondContact O-N 2.93Å; R288-L292 WeakPolarHBondContact CA-O 3.38Å; R288-L292 PolarHBondContact N-O 2.76Å
289	L	96.3	Very high	96.7	Very high	132 Å²	132	65.8 Å²	65.8	69%	0.691	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.7	-31.8	175.9	-65.5	176.2	0	0	0	112.5	P189 F190 D286 G287 G291	P189-L289 HydrophobicContact CG-CB 4.22Å; F190-L289 HydrophobicContact CZ-CB 4.38Å; D286-L289 WeakPolarHBondContact O-CB 3.04Å; D286-L289 PolarHBondContact O-N 2.83Å; G287-L289 PolarHBondContact O-N 2.89Å; L289-G291 VanDerWaalsContact C-N 3.33Å
290	G	93.8	Very high	96.8	Very high	18 Å²	18	65.6 Å²	65.6	19%	0.186	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-85.9	0.2	171.5	0	0	0	0	0	114	M187 S188 G287 R288	M187-G290 WeakPolarHBondContact CE-O 3Å; S188-G290 WeakPolarHBondContact O-CA 3.25Å; G287-G290 CarbonylContact O-C 3.6Å; G287-G290 WeakPolarHBondContact O-CA 3.15Å; G287-G290 PolarHBondContact O-N 3.05Å; R288-G290 VanDerWaalsContact C-N 3.27Å; R288-G290 PolarHBondContact O-N 3.42Å
291	G	96.6	Very high	97	Very high	55 Å²	55	66 Å²	66	57%	0.567	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	11.9	-174.6	0	0	0	0	0	114.6	G287 R288 L289 V293	G287-G291 PolarHBondContact O-N 3.25Å; R288-G291 PolarHBondContact O-N 2.93Å; L289-G291 VanDerWaalsContact C-N 3.33Å; G291-V293 PolarHBondContact O-N 2.64Å
292	L	97	Very high	97	Very high	10 Å²	10	66.8 Å²	66.8	5%	0.052	36%	0.358	C	S	.	.			trans	-85.6	103	175.2	-52.2	176	0	0	0	109.2	K185 M187 G287 R288 T312 M314	K185-L292 HydrophobicContact CD-CD1 3.4Å; K185-L292 VanDerWaalsContact CD-CD1 3.4Å; M187-L292 HydrophobicContact CE-CD1 4.46Å; M187-L292 HydrophobicContact CE-CD2 3.99Å; M187-L292 HydrophobicContact CE-CG 4.09Å; M187-L292 HydrophobicContact SD-CD1 3.72Å; M187-L292 HydrophobicContact SD-CD2 3.91Å; M187-L292 HydrophobicContact SD-CG 3.96Å; G287-L292 CarbonylContact C-O 3.6Å; G287-L292 WeakPolarHBondContact O-CB 3.47Å; G287-L292 PolarHBondContact O-N 3.42Å; R288-L292 WeakPolarHBondContact CA-O 3.38Å; R288-L292 PolarHBondContact N-O 2.76Å; L292-T312 VanDerWaalsContact CD2-C 3.5Å; L292-T312 VanDerWaalsContact CD2-O 3.23Å; L292-T312 WeakPolarHBondContact CD2-O 3.26Å; L292-M314 WeakPolarHBondContact CD1-O 3.25Å
293	V	95.9	Very high	96.9	Very high	115 Å²	115	68.8 Å²	68.8	70%	0.697	37%	0.368	S	S	*	.			trans	-109.4	-5	-179.5	-62	0	0	0	0	112.9	G291 P295	G291-V293 PolarHBondContact O-N 2.64Å; V293-P295 WeakPolarHBondContact O-CD 3.37Å
294	Q	97.3	Very high	96.7	Very high	112 Å²	112	73.7 Å²	73.7	52%	0.523	40%	0.395	S	S	.	.	S	Bend	trans	-81.5	118	175.8	-175.6	172.4	13.1	0	0	108.8	M314 D315	Q294-M314 HydrophobicContact CG-CG 4.27Å; Q294-D315 WeakPolarHBondContact O-CB 3.41Å; Q294-D315 PolarHBondContact O-N 2.93Å
295	P	97.1	Very high	96.6	Very high	99 Å²	99	79.4 Å²	79.4	64%	0.643	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-60.9	151.3	175.7	-21	33.2	0	0	0	111.5	V293 D297	V293-P295 WeakPolarHBondContact O-CD 3.37Å; P295-D297 PolarHBondContact O-N 2.81Å
296	H	97.7	Very high	96.5	Very high	16 Å²	16	76 Å²	76	7%	0.074	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-63.2	132.6	174.5	-161.5	-60.4	0	0	0	110.9	D251 L254 G298 Y308 P317 L321	D251-H296 IonicContact OD1-CD2 3.85Å; L254-H296 WeakPolarHBondContact CD2-CE1 3.31Å; L254-H296 WeakPolarHBondContact CD2-ND1 3.44Å; L254-H296 WeakPolarHBondContact CD2-NE2 3.5Å; H296-G298 PolarHBondContact ND1-N 3.28Å; H296-G298 VanDerWaalsContact ND1-N 3.1Å; H296-Y308 PolarHBondContact CD2-OH 3.2Å; H296-Y308 AromaticContact NE2-CZ 3.77Å; H296-Y308 PolarHBondContact NE2-OH 3.18Å; H296-P317 HydrophobicContact CB-CB 4.18Å; H296-L321 HydrophobicContact CB-CD2 4.1Å
297	D	97.1	Very high	96.5	Very high	64 Å²	64	76.6 Å²	76.6	34%	0.342	40%	0.4	S	S	.	.			trans	-88.6	-11.8	-171.9	71.5	-8.5	0	0	0	115.5	P295 R299 H301 M314	P295-D297 PolarHBondContact O-N 2.81Å; D297-R299 PolarHBondContact OD1-N 3.21Å; D297-H301 VanDerWaalsContact CG-NE2 3.26Å; D297-H301 IonicContact OD1-CD2 2.97Å; D297-H301 IonicContact OD1-NE2 3.03Å; D297-H301 PolarHBondContact OD1-NE2 3.16Å; D297-H301 IonicContact OD2-CE1 3.65Å; D297-H301 PolarHBondContact OD2-CE1 3.28Å; D297-H301 VanDerWaalsContact OD2-CE1 3.28Å; D297-H301 IonicContact OD2-NE2 3.25Å; D297-H301 PolarHBondContact OD2-NE2 3.08Å; D297-M314 HydrophobicContact CB-SD 4.13Å
298	G	96.9	Very high	96.5	Very high	8 Å²	8	77.1 Å²	77.1	8%	0.082	40%	0.401	C	S	.	.	S	Bend	trans	81.7	17.5	177.4	0	0	0	0	0	113.9	H296	H296-G298 PolarHBondContact ND1-N 3.28Å; H296-G298 VanDerWaalsContact ND1-N 3.1Å
299	R	97.6	Very high	96.5	Very high	175 Å²	175	70.5 Å²	70.5	66%	0.66	38%	0.384	S	S	*	.	S	Bend	trans	-111.6	165.1	-177.9	-58.5	-179.1	178.8	-172.8	-1.1	112.3	Q255 V258 D297 H301	Q255-R299 PolarHBondContact NE2-O 2.66Å; V258-R299 VanDerWaalsContact CG2-C 3.5Å; D297-R299 PolarHBondContact OD1-N 3.21Å; R299-H301 PolarHBondContact O-CD2 3.37Å
300	C	97.9	Very high	96.5	Very high	42 Å²	42	64.4 Å²	64.4	28%	0.284	35%	0.353	S	S	.	.			trans	-76.9	133.4	174.1	-176.3	0	0	0	0	111	V258 C259	V258-C300 HydrophobicContact CG2-CB 4.09Å; C259-C300 VanDerWaalsContact CA-SG 3.51Å; C259-C300 HydrophobicContact CB-CB 3.97Å; C259-C300 WeakPolarHBondContact CB-SG 3.49Å; C259-C300 WeakPolarHBondContact SG-CA 3.17Å; C259-C300 WeakPolarHBondContact SG-CB 3.44Å; C259-C300 CovalentContact SG-SG 2.03Å; C259-C300 PolarHBondContact SG-SG 3.44Å
301	H	97.8	Very high	96.6	Very high	48 Å²	48	64 Å²	64	22%	0.222	35%	0.347	C	S	.	.			trans	-138.2	37.2	179	-62	-84	0	0	0	112.4	D297 R299 Y308 S309 A310 M314	D297-H301 VanDerWaalsContact CG-NE2 3.26Å; D297-H301 IonicContact OD1-CD2 2.97Å; D297-H301 IonicContact OD1-NE2 3.03Å; D297-H301 PolarHBondContact OD1-NE2 3.16Å; D297-H301 IonicContact OD2-CE1 3.65Å; D297-H301 PolarHBondContact OD2-CE1 3.28Å; D297-H301 VanDerWaalsContact OD2-CE1 3.28Å; D297-H301 IonicContact OD2-NE2 3.25Å; D297-H301 PolarHBondContact OD2-NE2 3.08Å; R299-H301 PolarHBondContact O-CD2 3.37Å; H301-Y308 HydrophobicContact CB-CD2 3.93Å; H301-Y308 HydrophobicContact CB-CE2 3.8Å; H301-S309 PolarHBondContact O-N 3.03Å; H301-S309 PolarHBondContact O-OG 3.23Å; H301-A310 HydrophobicContact CB-CB 3.95Å; H301-M314 WeakPolarHBondContact CD2-CE 3.35Å; H301-M314 VanDerWaalsContact NE2-CE 3.29Å; H301-M314 WeakPolarHBondContact NE2-CE 3.46Å
302	L	97.3	Very high	96.6	Very high	26 Å²	26	64.6 Å²	64.6	14%	0.136	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-73.5	134.1	169.1	-66.5	-179.3	0	0	0	110.1	F217 H219 C259 E262 E307	F217-L302 HydrophobicContact CD1-CD2 3.84Å; F217-L302 HydrophobicContact CE1-CD1 4.42Å; F217-L302 HydrophobicContact CE1-CD2 3.79Å; H219-L302 HydrophobicContact CB-CD1 4.02Å; C259-L302 HydrophobicContact CB-CD1 3.89Å; C259-L302 HydrophobicContact CB-CG 4.47Å; E262-L302 HydrophobicContact CB-CD1 3.92Å; E262-L302 HydrophobicContact CG-CD1 4.24Å; L302-E307 WeakPolarHBondContact CA-O 3.44Å
303	N	95.3	Very high	96.6	Very high	50 Å²	50	70.1 Å²	70.1	27%	0.267	36%	0.364	S	S	.	.			trans	-86.2	179.1	172.8	64.9	18	0	0	0	111.4	H305 N306 E307	N303-H305 PolarHBondContact O-N 3.26Å; N303-H305 VanDerWaalsContact OD1-C 3.31Å; N303-H305 WeakPolarHBondContact OD1-CA 3.25Å; N303-H305 WeakPolarHBondContact OD1-CB 3.33Å; N303-H305 PolarHBondContact OD1-N 3.02Å; N303-N306 WeakPolarHBondContact O-CA 3.05Å; N303-N306 PolarHBondContact O-N 3.45Å; N303-N306 PolarHBondContact OD1-N 3.25Å; N303-E307 PolarHBondContact N-O 2.78Å; N303-E307 PolarHBondContact OD1-N 3.02Å; N303-E307 PolarHBondContact OD1-O 2.83Å
304	D	93.9	Very high	96.7	Very high	166 Å²	166	65 Å²	65	89%	0.888	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.2	177.3	-56	-30	0	0	0	114.2
305	H	93.2	Very high	96.7	Very high	154 Å²	154	60 Å²	60	71%	0.713	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	11.4	175	-57.9	86.9	0	0	0	112.4	N303 E307	N303-H305 PolarHBondContact O-N 3.26Å; N303-H305 VanDerWaalsContact OD1-C 3.31Å; N303-H305 WeakPolarHBondContact OD1-CA 3.25Å; N303-H305 WeakPolarHBondContact OD1-CB 3.33Å; N303-H305 PolarHBondContact OD1-N 3.02Å; H305-E307 HydrophobicContact CB-CG 4.26Å; H305-E307 PolarHBondContact O-N 2.9Å
306	N	96	Very high	96.8	Very high	61 Å²	61	55.4 Å²	55.4	33%	0.326	28%	0.279	S	S	.	.	S	Bend	trans	59.1	27.5	-177.1	-63.6	-28.2	0	0	0	114.2	H219 N303	H219-N306 HydrophobicContact CB-CB 4.01Å; H219-N306 PolarHBondContact N-O 2.95Å; H219-N306 WeakPolarHBondContact O-CB 3.36Å; N303-N306 WeakPolarHBondContact O-CA 3.05Å; N303-N306 PolarHBondContact O-N 3.45Å; N303-N306 PolarHBondContact OD1-N 3.25Å
307	E	96.9	Very high	96.8	Very high	68 Å²	68	54.6 Å²	54.6	32%	0.318	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-105.2	146.2	175.3	-49.5	-164.8	140.1	0	0	111.5	R218 L302 N303 H305 S309	R218-E307 HydrophobicContact CG-CG 4.1Å; R218-E307 IonicContact CZ-OE1 3.75Å; R218-E307 IonicContact NE-OE1 3.22Å; R218-E307 PolarHBondContact NE-OE1 3.1Å; R218-E307 IonicContact NH2-OE1 3.54Å; R218-E307 PolarHBondContact NH2-OE1 3.31Å; L302-E307 WeakPolarHBondContact CA-O 3.44Å; N303-E307 PolarHBondContact N-O 2.78Å; N303-E307 PolarHBondContact OD1-N 3.02Å; N303-E307 PolarHBondContact OD1-O 2.83Å; H305-E307 HydrophobicContact CB-CG 4.26Å; H305-E307 PolarHBondContact O-N 2.9Å; E307-S309 PolarHBondContact O-N 3.06Å
308	Y	98	Very high	96.8	Very high	10 Å²	10	53.9 Å²	53.9	4%	0.039	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-70.4	98.4	176.1	177.2	-135.9	0	0	0	111.8	F217 D251 Q255 H296 H301 A310 S311 M314	F217-Y308 PolarHBondContact O-N 3.38Å; D251-Y308 HydrophobicContact CB-CD1 4.21Å; D251-Y308 HydrophobicContact CB-CE1 3.93Å; D251-Y308 WeakPolarHBondContact OD2-CE1 3.39Å; Q255-Y308 VanDerWaalsContact CD-CD2 3.48Å; Q255-Y308 VanDerWaalsContact CD-CE2 3.5Å; Q255-Y308 HydrophobicContact CG-CD2 3.58Å; Q255-Y308 HydrophobicContact CG-CE2 3.85Å; Q255-Y308 HydrophobicContact CG-CG 3.96Å; H296-Y308 PolarHBondContact CD2-OH 3.2Å; H296-Y308 AromaticContact NE2-CZ 3.77Å; H296-Y308 PolarHBondContact NE2-OH 3.18Å; H301-Y308 HydrophobicContact CB-CD2 3.93Å; H301-Y308 HydrophobicContact CB-CE2 3.8Å; Y308-A310 VanDerWaalsContact C-N 3.28Å; Y308-A310 HydrophobicContact CD2-CB 4.41Å; Y308-A310 HydrophobicContact CE2-CB 3.71Å; Y308-A310 PolarHBondContact O-N 3.43Å; Y308-S311 VanDerWaalsContact CD1-CB 3.47Å; Y308-S311 VanDerWaalsContact CE1-N 3.35Å; Y308-S311 WeakPolarHBondContact O-CB 3.3Å; Y308-S311 PolarHBondContact O-N 2.93Å; Y308-M314 HydrophobicContact CE2-CE 4.47Å
309	S	96.6	Very high	96.6	Very high	51 Å²	51	55.2 Å²	55.2	36%	0.357	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-15.4	-171.4	67.9	0	0	0	0	115	H301 E307	H301-S309 PolarHBondContact O-N 3.03Å; H301-S309 PolarHBondContact O-OG 3.23Å; E307-S309 PolarHBondContact O-N 3.06Å
310	A	96.9	Very high	96.3	Very high	5 Å²	5	50.5 Å²	50.5	4%	0.041	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	5.2	179.6	0	0	0	0	0	113.7	H301 Y308 T312 K313 M314	H301-A310 HydrophobicContact CB-CB 3.95Å; Y308-A310 VanDerWaalsContact C-N 3.28Å; Y308-A310 HydrophobicContact CD2-CB 4.41Å; Y308-A310 HydrophobicContact CE2-CB 3.71Å; Y308-A310 PolarHBondContact O-N 3.43Å; A310-T312 PolarHBondContact O-N 3.49Å; A310-T312 VanDerWaalsContact O-N 3.13Å; A310-K313 HydrophobicContact CB-CB 4.49Å; A310-K313 PolarHBondContact O-N 3.12Å; A310-M314 HydrophobicContact CB-CE 3.26Å; A310-M314 HydrophobicContact CB-CG 4.47Å; A310-M314 PolarHBondContact O-N 2.8Å
311	S	96.4	Very high	96	Very high	8 Å²	8	49.7 Å²	49.7	6%	0.056	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-39.6	179.1	-176.7	0	0	0	0	113.6	K185 Y308	K185-S311 VanDerWaalsContact CD-O 3.29Å; K185-S311 WeakPolarHBondContact CD-O 3.26Å; K185-S311 WeakPolarHBondContact CG-O 3.47Å; K185-S311 PolarHBondContact NZ-O 3.47Å; Y308-S311 VanDerWaalsContact CD1-CB 3.47Å; Y308-S311 VanDerWaalsContact CE1-N 3.35Å; Y308-S311 WeakPolarHBondContact O-CB 3.3Å; Y308-S311 PolarHBondContact O-N 2.93Å
312	T	95.6	Very high	95.9	Very high	68 Å²	68	47.5 Å²	47.5	42%	0.417	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	13.7	179.8	56.4	0	0	0	0	113.8	M187 L292 A310	M187-T312 HydrophobicContact CB-CG2 4.31Å; M187-T312 HydrophobicContact CG-CG2 4.38Å; M187-T312 HydrophobicContact SD-CG2 4.05Å; L292-T312 VanDerWaalsContact CD2-C 3.5Å; L292-T312 VanDerWaalsContact CD2-O 3.23Å; L292-T312 WeakPolarHBondContact CD2-O 3.26Å; A310-T312 PolarHBondContact O-N 3.49Å; A310-T312 VanDerWaalsContact O-N 3.13Å
313	K	96.8	Very high	95.6	Very high	127 Å²	127	46.8 Å²	46.8	55%	0.552	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	-37	-178.4	-60	177.2	-173.2	163.9	0	112.3	A310	A310-K313 HydrophobicContact CB-CB 4.49Å; A310-K313 PolarHBondContact O-N 3.12Å
314	M	97.7	Very high	95.3	Very high	6 Å²	6	49.5 Å²	49.5	3%	0.03	27%	0.272	C	S	.	.	S	Bend	trans	-114.1	149.6	-178.2	-65.1	-169.5	-75.6	0	0	111.6	K185 L292 Q294 D297 H301 Y308 A310	K185-M314 PolarHBondContact NZ-O 3.49Å; L292-M314 WeakPolarHBondContact CD1-O 3.25Å; Q294-M314 HydrophobicContact CG-CG 4.27Å; D297-M314 HydrophobicContact CB-SD 4.13Å; H301-M314 WeakPolarHBondContact CD2-CE 3.35Å; H301-M314 VanDerWaalsContact NE2-CE 3.29Å; H301-M314 WeakPolarHBondContact NE2-CE 3.46Å; Y308-M314 HydrophobicContact CE2-CE 4.47Å; A310-M314 HydrophobicContact CB-CE 3.26Å; A310-M314 HydrophobicContact CB-CG 4.47Å; A310-M314 PolarHBondContact O-N 2.8Å
315	D	98.4	Very high	95.2	Very high	8 Å²	8	43.1 Å²	43.1	4%	0.043	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.2	168.6	171.5	-164.3	9.1	0	0	0	111.7	L285 G287 Q294	L285-D315 WeakPolarHBondContact CA-OD2 3.43Å; L285-D315 PolarHBondContact N-OD1 3.48Å; L285-D315 PolarHBondContact N-OD2 2.98Å; G287-D315 WeakPolarHBondContact CA-OD1 3.44Å; G287-D315 PolarHBondContact N-OD1 3.21Å; Q294-D315 WeakPolarHBondContact O-CB 3.41Å; Q294-D315 PolarHBondContact O-N 2.93Å
316	Y	98.4	Very high	95.2	Very high	2 Å²	2	36 Å²	36	1%	0.008	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-65.8	152.8	173.8	-56	-85	0	0	0	110.9	D184 K185 H282 A284 D286	D184-Y316 WeakPolarHBondContact OD1-CE1 3.17Å; D184-Y316 PolarHBondContact OD1-OH 3.28Å; D184-Y316 PolarHBondContact OD2-OH 2.86Å; K185-Y316 HydrophobicContact CD-CE1 3.85Å; K185-Y316 HydrophobicContact CD-CE2 3.91Å; K185-Y316 VanDerWaalsContact CD-CZ 3.49Å; K185-Y316 WeakPolarHBondContact CD-OH 3.22Å; K185-Y316 VanDerWaalsContact CE-CE2 3.45Å; K185-Y316 HydrophobicContact CG-CE1 3.86Å; H282-Y316 HydrophobicContact CB-CD1 3.78Å; H282-Y316 HydrophobicContact CB-CD2 3.76Å; H282-Y316 HydrophobicContact CB-CE1 3.53Å; H282-Y316 HydrophobicContact CB-CE2 3.53Å; H282-Y316 HydrophobicContact CB-CG 3.88Å; H282-Y316 AromaticContact CD2-CZ 3.63Å; H282-Y316 PolarHBondContact CD2-OH 2.76Å; H282-Y316 VanDerWaalsContact CD2-OH 3.25Å; H282-Y316 AromaticContact CG-CE2 3.72Å; H282-Y316 AromaticContact CG-CZ 3.57Å; A284-Y316 WeakPolarHBondContact CA-O 3.42Å; A284-Y316 WeakPolarHBondContact CB-O 3.34Å; D286-Y316 HydrophobicContact CB-CD2 4.11Å; D286-Y316 HydrophobicContact CB-CE2 4.1Å
317	P	97.8	Very high	94.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-73	149.9	178	29.4	-34.5	0	0	0	112.4	F250 D251 L254 H296 L321 L322	F250-P317 HydrophobicContact CB-CG 4.02Å; F250-P317 VanDerWaalsContact O-CG 3.32Å; F250-P317 WeakPolarHBondContact O-CG 3.27Å; D251-P317 WeakPolarHBondContact OD1-CD 3.39Å; L254-P317 HydrophobicContact CB-CG 4.13Å; L254-P317 HydrophobicContact CD1-CB 4.37Å; L254-P317 HydrophobicContact CD2-CB 4Å; L254-P317 HydrophobicContact CD2-CG 4.29Å; H296-P317 HydrophobicContact CB-CB 4.18Å; P317-L321 HydrophobicContact CB-CD2 4.07Å; P317-L322 HydrophobicContact CB-CG 4.24Å; P317-L322 HydrophobicContact CG-CD1 4.37Å; P317-L322 HydrophobicContact CG-CD2 4.1Å; P317-L322 HydrophobicContact CG-CG 4.12Å
318	S	96.3	Very high	94.2	Very high	49 Å²	49	37.6 Å²	37.6	34%	0.343	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-75.7	156.3	171.9	71.5	0	0	0	0	110.8	A320 L321 L322	S318-A320 PolarHBondContact O-N 2.97Å; S318-L321 PolarHBondContact O-N 3.29Å; S318-L321 VanDerWaalsContact O-N 3.15Å; S318-L321 WeakPolarHBondContact OG-CB 3.2Å; S318-L321 PolarHBondContact OG-N 2.82Å; S318-L322 PolarHBondContact O-N 3.09Å
319	L	93.6	Very high	93.8	Very high	35 Å²	35	37.6 Å²	37.6	18%	0.183	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-35.8	175.5	-65.9	173.7	0	0	0	112.3	F250 L322 G323 F348 L351 I352	F250-L319 HydrophobicContact CD2-CD2 4.39Å; F250-L319 HydrophobicContact CE2-CD2 3.46Å; F250-L319 VanDerWaalsContact CE2-CD2 3.46Å; F250-L319 HydrophobicContact CZ-CD2 3.97Å; L319-L322 PolarHBondContact O-N 2.71Å; L319-G323 PolarHBondContact O-N 3.37Å; L319-F348 HydrophobicContact CD1-CD1 3.83Å; L319-F348 HydrophobicContact CD1-CE1 4.07Å; L319-F348 HydrophobicContact CD2-CD1 4.01Å; L319-F348 HydrophobicContact CD2-CE1 4.39Å; L319-F348 HydrophobicContact CD2-CG 4.33Å; L319-L351 HydrophobicContact CD1-CD1 3.64Å; L319-I352 HydrophobicContact CD2-CD1 3.96Å
320	A	90.4	Very high	93.4	Very high	76 Å²	76	36.8 Å²	36.8	63%	0.628	21%	0.211	S	C	*	.	H	α-helix	trans	-65.9	-44.5	176.9	0	0	0	0	0	111.8	S318 L322 G323 E324	S318-A320 PolarHBondContact O-N 2.97Å; A320-L322 VanDerWaalsContact C-N 3.34Å; A320-L322 PolarHBondContact O-N 3.41Å; A320-G323 PolarHBondContact O-N 2.89Å; A320-E324 WeakPolarHBondContact O-CB 3.4Å; A320-E324 PolarHBondContact O-N 3.42Å
321	L	93.5	Very high	93.2	Very high	26 Å²	26	37 Å²	37	14%	0.136	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-40.3	176.6	-179.1	62.4	0	0	0	111.4	L254 H296 P317 S318 E324 K325	L254-L321 HydrophobicContact CD1-CG 4.18Å; L254-L321 HydrophobicContact CD2-CD2 4.45Å; H296-L321 HydrophobicContact CB-CD2 4.1Å; P317-L321 HydrophobicContact CB-CD2 4.07Å; S318-L321 PolarHBondContact O-N 3.29Å; S318-L321 VanDerWaalsContact O-N 3.15Å; S318-L321 WeakPolarHBondContact OG-CB 3.2Å; S318-L321 PolarHBondContact OG-N 2.82Å; L321-E324 PolarHBondContact O-N 3.23Å; L321-K325 HydrophobicContact CD1-CG 4.24Å; L321-K325 WeakPolarHBondContact O-CG 3.41Å; L321-K325 PolarHBondContact O-N 2.67Å
322	L	94.5	Very high	92.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-59.9	-50.3	173.1	-77	169.7	0	0	0	111.5	F250 I253 L254 P317 S318 L319 A320 E324 K325 L326 I352	F250-L322 HydrophobicContact CB-CD1 4Å; F250-L322 HydrophobicContact CD1-CD1 4.22Å; F250-L322 HydrophobicContact CD2-CD1 3.55Å; F250-L322 HydrophobicContact CE2-CD1 4.01Å; F250-L322 HydrophobicContact CG-CD1 3.66Å; I253-L322 HydrophobicContact CB-CD2 4.2Å; I253-L322 HydrophobicContact CG2-CD2 3.83Å; L254-L322 HydrophobicContact CB-CD2 3.79Å; L254-L322 HydrophobicContact CD1-CD2 3.84Å; L254-L322 HydrophobicContact CD1-CG 4.48Å; L254-L322 HydrophobicContact CG-CD2 4.44Å; P317-L322 HydrophobicContact CB-CG 4.24Å; P317-L322 HydrophobicContact CG-CD1 4.37Å; P317-L322 HydrophobicContact CG-CD2 4.1Å; P317-L322 HydrophobicContact CG-CG 4.12Å; S318-L322 PolarHBondContact O-N 3.09Å; L319-L322 PolarHBondContact O-N 2.71Å; A320-L322 VanDerWaalsContact C-N 3.34Å; A320-L322 PolarHBondContact O-N 3.41Å; L322-E324 VanDerWaalsContact C-N 3.34Å; L322-E324 PolarHBondContact O-N 3.42Å; L322-K325 PolarHBondContact O-N 3.36Å; L322-L326 WeakPolarHBondContact O-CB 3.43Å; L322-L326 WeakPolarHBondContact O-CG 3.21Å; L322-L326 PolarHBondContact O-N 3.47Å; L322-I352 HydrophobicContact CB-CD1 4.42Å
323	G	90.9	Very high	92.8	Very high	12 Å²	12	34.3 Å²	34.3	12%	0.124	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-41.9	178.6	0	0	0	0	0	113.2	L319 A320 A327	L319-G323 PolarHBondContact O-N 3.37Å; A320-G323 PolarHBondContact O-N 2.89Å; G323-A327 VanDerWaalsContact O-CB 3.25Å; G323-A327 WeakPolarHBondContact O-CB 3.37Å; G323-A327 PolarHBondContact O-N 2.88Å
324	E	88.5	Confident	92.7	Very high	107 Å²	107	28.3 Å²	28.3	50%	0.5	17%	0.166	S	C	.	.	H	α-helix	trans	-59	-53.4	174.7	-172.7	-162.6	136.3	0	0	111.1	A320 L321 L322 A327 E328	A320-E324 WeakPolarHBondContact O-CB 3.4Å; A320-E324 PolarHBondContact O-N 3.42Å; L321-E324 PolarHBondContact O-N 3.23Å; L322-E324 VanDerWaalsContact C-N 3.34Å; L322-E324 PolarHBondContact O-N 3.42Å; E324-A327 PolarHBondContact O-N 2.93Å; E324-E328 VanDerWaalsContact O-CB 3.3Å; E324-E328 WeakPolarHBondContact O-CB 3.48Å; E324-E328 PolarHBondContact O-N 3.22Å
325	K	93.2	Very high	92.5	Very high	32 Å²	32	28 Å²	28	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-71.5	-32.7	-175.9	-64.4	-44.5	-176.8	-156.3	0	113.4	L254 V258 L321 L322 E328 N329	L254-K325 HydrophobicContact CD1-CB 4Å; L254-K325 HydrophobicContact CD1-CG 3.98Å; V258-K325 HydrophobicContact CG1-CB 3.97Å; V258-K325 HydrophobicContact CG1-CD 4.35Å; V258-K325 HydrophobicContact CG1-CG 3.92Å; L321-K325 HydrophobicContact CD1-CG 4.24Å; L321-K325 WeakPolarHBondContact O-CG 3.41Å; L321-K325 PolarHBondContact O-N 2.67Å; L322-K325 PolarHBondContact O-N 3.36Å; K325-E328 VanDerWaalsContact CD-OE2 3.25Å; K325-E328 WeakPolarHBondContact CD-OE2 3.41Å; K325-E328 IonicContact NZ-OE2 3.93Å; K325-E328 PolarHBondContact NZ-OE2 3.41Å; K325-N329 VanDerWaalsContact O-CB 3.26Å; K325-N329 WeakPolarHBondContact O-CB 3.5Å; K325-N329 VanDerWaalsContact O-CG 3.23Å; K325-N329 PolarHBondContact O-N 3.42Å; K325-N329 VanDerWaalsContact O-N 3.12Å; K325-N329 PolarHBondContact O-ND2 2.82Å
326	L	92.4	Very high	92.3	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-43.4	172.6	-70.4	167.2	0	0	0	111.1	I253 A257 L273 L322 N329 N330 I331 L333 I352	I253-L326 HydrophobicContact CG2-CD1 4.37Å; I253-L326 HydrophobicContact CG2-CD2 4.23Å; A257-L326 HydrophobicContact CB-CD2 4.08Å; L273-L326 HydrophobicContact CD2-CD2 4.37Å; L322-L326 WeakPolarHBondContact O-CB 3.43Å; L322-L326 WeakPolarHBondContact O-CG 3.21Å; L322-L326 PolarHBondContact O-N 3.47Å; L326-N329 CarbonylContact O-C 3.57Å; L326-N329 PolarHBondContact O-N 3.2Å; L326-N330 PolarHBondContact O-N 3.05Å; L326-I331 HydrophobicContact CD2-CB 3.82Å; L326-I331 HydrophobicContact CD2-CG2 3.72Å; L326-I331 PolarHBondContact O-N 2.92Å; L326-L333 HydrophobicContact CD1-CB 4.13Å; L326-L333 HydrophobicContact CD1-CD2 3.86Å; L326-L333 HydrophobicContact CD2-CB 4.44Å; L326-I352 HydrophobicContact CD1-CG2 3.87Å
327	A	85.9	Confident	91.9	Very high	55 Å²	55	27.6 Å²	27.6	46%	0.455	16%	0.163	S	C	.	.	H	α-helix	trans	-70.8	-37.2	178.8	0	0	0	0	0	113.3	G323 E324 N329 N330	G323-A327 VanDerWaalsContact O-CB 3.25Å; G323-A327 WeakPolarHBondContact O-CB 3.37Å; G323-A327 PolarHBondContact O-N 2.88Å; E324-A327 PolarHBondContact O-N 2.93Å; A327-N329 VanDerWaalsContact C-N 3.28Å; A327-N329 PolarHBondContact O-N 3.45Å; A327-N330 PolarHBondContact O-N 3.48Å; A327-N330 PolarHBondContact O-OD1 3.44Å
328	E	86.5	Confident	91.4	Very high	106 Å²	106	28.8 Å²	28.8	50%	0.495	17%	0.17	S	C	.	.	H	α-helix	trans	-62.4	-38.5	174.4	-171.9	-173.3	160.4	0	0	111.1	E324 K325	E324-E328 VanDerWaalsContact O-CB 3.3Å; E324-E328 WeakPolarHBondContact O-CB 3.48Å; E324-E328 PolarHBondContact O-N 3.22Å; K325-E328 VanDerWaalsContact CD-OE2 3.25Å; K325-E328 WeakPolarHBondContact CD-OE2 3.41Å; K325-E328 IonicContact NZ-OE2 3.93Å; K325-E328 PolarHBondContact NZ-OE2 3.41Å
329	N	89.9	Confident	90.9	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.059	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	5.7	-175.3	-59.1	-42.4	0	0	0	113.7	A257 K260 H271 K325 L326 A327 I331	A257-N329 PolarHBondContact O-ND2 2.87Å; A257-N329 VanDerWaalsContact O-ND2 3.17Å; K260-N329 VanDerWaalsContact CE-CG 3.46Å; K260-N329 WeakPolarHBondContact CE-OD1 3.32Å; K260-N329 PolarHBondContact NZ-OD1 3.34Å; H271-N329 PolarHBondContact ND1-O 3.12Å; K325-N329 VanDerWaalsContact O-CB 3.26Å; K325-N329 WeakPolarHBondContact O-CB 3.5Å; K325-N329 VanDerWaalsContact O-CG 3.23Å; K325-N329 PolarHBondContact O-N 3.42Å; K325-N329 VanDerWaalsContact O-N 3.12Å; K325-N329 PolarHBondContact O-ND2 2.82Å; L326-N329 CarbonylContact O-C 3.57Å; L326-N329 PolarHBondContact O-N 3.2Å; A327-N329 VanDerWaalsContact C-N 3.28Å; A327-N329 PolarHBondContact O-N 3.45Å; N329-I331 VanDerWaalsContact C-N 3.31Å; N329-I331 HydrophobicContact CB-CD1 3.94Å; N329-I331 HydrophobicContact CB-CG1 4.1Å; N329-I331 WeakPolarHBondContact O-CG1 3.49Å; N329-I331 PolarHBondContact O-N 2.03Å
330	N	87.9	Confident	90.6	Very high	34 Å²	34	43.5 Å²	43.5	18%	0.182	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	43.2	-179.1	-60.8	-38.9	0	0	0	113.2	H271 L326 A327	H271-N330 WeakPolarHBondContact CB-O 3.38Å; H271-N330 PolarHBondContact ND1-O 3.48Å; L326-N330 PolarHBondContact O-N 3.05Å; A327-N330 PolarHBondContact O-N 3.48Å; A327-N330 PolarHBondContact O-OD1 3.44Å
331	I	91.4	Very high	90.5	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.051	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124	-178.1	-60.9	175.7	0	0	0	110.6	A257 W265 H271 L273 L326 N329	A257-I331 VanDerWaalsContact CA-CD1 3.43Å; A257-I331 HydrophobicContact CB-CD1 3.69Å; W265-I331 HydrophobicContact CZ2-CD1 4.18Å; H271-I331 HydrophobicContact CB-CB 4.33Å; H271-I331 HydrophobicContact CB-CG1 3.82Å; L273-I331 HydrophobicContact CB-CG2 3.53Å; L273-I331 HydrophobicContact CD2-CG2 4.15Å; L326-I331 HydrophobicContact CD2-CB 3.82Å; L326-I331 HydrophobicContact CD2-CG2 3.72Å; L326-I331 PolarHBondContact O-N 2.92Å; N329-I331 VanDerWaalsContact C-N 3.31Å; N329-I331 HydrophobicContact CB-CD1 3.94Å; N329-I331 HydrophobicContact CB-CG1 4.1Å; N329-I331 WeakPolarHBondContact O-CG1 3.49Å; N329-I331 PolarHBondContact O-N 2.03Å
332	F	91.4	Very high	90.1	Very high	17 Å²	17	41 Å²	41	8%	0.075	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	107.8	172	-66.6	-82.3	0	0	0	109.6	Y270 H271 L272 L273 G354 I378 V447	Y270-F332 HydrophobicContact CD1-CD2 4.47Å; Y270-F332 AromaticContact CD1-CE2 3.89Å; Y270-F332 HydrophobicContact CD1-CE2 3.89Å; Y270-F332 HydrophobicContact CE1-CE2 4.29Å; H271-F332 PolarHBondContact O-N 3.3Å; L272-F332 HydrophobicContact CD2-CB 4Å; L273-F332 PolarHBondContact N-O 3.12Å; F332-G354 WeakPolarHBondContact CD1-O 3.28Å; F332-I378 HydrophobicContact CB-CD1 3.78Å; F332-I378 HydrophobicContact CD1-CD1 3.95Å; F332-I378 HydrophobicContact CD1-CG1 4.06Å; F332-I378 HydrophobicContact CD1-CG2 4.17Å; F332-I378 HydrophobicContact CD2-CD1 4.44Å; F332-I378 HydrophobicContact CD2-CG2 4.37Å; F332-I378 HydrophobicContact CE1-CG1 4.36Å; F332-I378 HydrophobicContact CE1-CG2 3.79Å; F332-I378 HydrophobicContact CE2-CG2 4Å; F332-I378 HydrophobicContact CG-CD1 3.81Å; F332-I378 HydrophobicContact CG-CG1 4.4Å; F332-I378 HydrophobicContact CG-CG2 4.42Å; F332-I378 HydrophobicContact CZ-CG2 3.66Å; F332-V447 HydrophobicContact CE1-CG1 4.26Å; F332-V447 HydrophobicContact CZ-CG1 4.49Å
333	L	93.8	Very high	89.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.4	177.1	174.7	67.4	0	0	0	110.5	I253 L273 F275 L326 F335 T355 T356	I253-L333 HydrophobicContact CD1-CD1 4.07Å; I253-L333 HydrophobicContact CD1-CD2 3.98Å; I253-L333 HydrophobicContact CG1-CD1 4.26Å; I253-L333 HydrophobicContact CG2-CD1 4.32Å; I253-L333 HydrophobicContact CG2-CD2 4.11Å; L273-L333 HydrophobicContact CB-CD1 4.34Å; L273-L333 HydrophobicContact CD2-CD1 3.98Å; L273-L333 HydrophobicContact CG-CD1 3.91Å; L273-L333 WeakPolarHBondContact O-CA 3.23Å; F275-L333 HydrophobicContact CB-CD1 3.77Å; L326-L333 HydrophobicContact CD1-CB 4.13Å; L326-L333 HydrophobicContact CD1-CD2 3.86Å; L326-L333 HydrophobicContact CD2-CB 4.44Å; L333-F335 HydrophobicContact CD1-CE1 4.46Å; L333-F335 HydrophobicContact CD2-CD1 4.37Å; L333-F335 HydrophobicContact CD2-CE1 3.6Å; L333-F335 HydrophobicContact CD2-CE2 4Å; L333-F335 HydrophobicContact CD2-CZ 3.39Å; L333-F335 HydrophobicContact CG-CD1 4.41Å; L333-F335 HydrophobicContact CG-CE1 4.11Å; L333-F335 HydrophobicContact CG-CE2 4.48Å; L333-F335 HydrophobicContact CG-CZ 4.15Å; L333-T355 HydrophobicContact CB-CG2 3.83Å; L333-T355 HydrophobicContact CD2-CG2 4.18Å; L333-T355 HydrophobicContact CG-CG2 4.38Å; L333-T355 VanDerWaalsContact O-CA 3.3Å; L333-T355 WeakPolarHBondContact O-CA 3.36Å; L333-T356 PolarHBondContact O-N 3.24Å
334	I	93.8	Very high	89.5	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.9	176.7	-55.9	166.5	0	0	0	107.4	L272 L273 V274 F275 A336 A374	L272-I334 HydrophobicContact CB-CD1 4.46Å; L273-I334 PolarHBondContact O-N 3.49Å; V274-I334 HydrophobicContact CG2-CD1 4.25Å; F275-I334 PolarHBondContact N-O 3.48Å; I334-A336 PolarHBondContact O-N 3.31Å; I334-A374 HydrophobicContact CD1-CB 3.58Å; I334-A374 HydrophobicContact CG1-CB 4Å; I334-A374 HydrophobicContact CG2-CB 4.32Å
335	F	94.3	Very high	89.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	104.7	171.1	-66.7	-59.2	0	0	0	109.4	F250 I253 F275 L333 V337 Y345 F348 T349 T356 V357 E358	F250-F335 HydrophobicContact CE1-CE1 4.26Å; F250-F335 HydrophobicContact CE1-CZ 4.49Å; I253-F335 HydrophobicContact CD1-CE1 4.1Å; F275-F335 HydrophobicContact CB-CD1 4.27Å; F275-F335 AromaticContact CD1-CD1 3.64Å; F275-F335 HydrophobicContact CD1-CD1 3.64Å; F275-F335 HydrophobicContact CD1-CE1 4.07Å; F275-F335 HydrophobicContact CE1-CD1 4.32Å; F275-F335 HydrophobicContact CG-CD1 4.25Å; L333-F335 HydrophobicContact CD1-CE1 4.46Å; L333-F335 HydrophobicContact CD2-CD1 4.37Å; L333-F335 HydrophobicContact CD2-CE1 3.6Å; L333-F335 HydrophobicContact CD2-CE2 4Å; L333-F335 HydrophobicContact CD2-CZ 3.39Å; L333-F335 HydrophobicContact CG-CD1 4.41Å; L333-F335 HydrophobicContact CG-CE1 4.11Å; L333-F335 HydrophobicContact CG-CE2 4.48Å; L333-F335 HydrophobicContact CG-CZ 4.15Å; F335-V337 HydrophobicContact CB-CG1 4.28Å; F335-Y345 HydrophobicContact CB-CD1 4.07Å; F335-Y345 HydrophobicContact CB-CG 4.45Å; F335-Y345 AromaticContact CD1-CD1 3.42Å; F335-Y345 HydrophobicContact CD1-CD1 3.42Å; F335-Y345 VanDerWaalsContact CD1-CD1 3.42Å; F335-Y345 AromaticContact CD1-CE1 3.73Å; F335-Y345 HydrophobicContact CD1-CE1 3.73Å; F335-Y345 HydrophobicContact CD2-CD1 4.08Å; F335-Y345 AromaticContact CE1-CD1 3.71Å; F335-Y345 HydrophobicContact CE1-CD1 3.71Å; F335-Y345 AromaticContact CE1-CE1 3.85Å; F335-Y345 HydrophobicContact CE1-CE1 3.85Å; F335-Y345 HydrophobicContact CE2-CD1 4.33Å; F335-Y345 AromaticContact CG-CD1 3.6Å; F335-Y345 HydrophobicContact CG-CD1 3.6Å; F335-Y345 HydrophobicContact CG-CE1 4.36Å; F335-Y345 HydrophobicContact CG-CG 4.37Å; F335-Y345 HydrophobicContact CZ-CD1 4.16Å; F335-F348 HydrophobicContact CE2-CB 4.33Å; F335-T349 HydrophobicContact CD2-CG2 4.05Å; F335-T349 HydrophobicContact CE2-CG2 4.36Å; F335-T356 PolarHBondContact N-O 3.48Å; F335-V357 HydrophobicContact CB-CB 4.14Å; F335-V357 HydrophobicContact CB-CG2 4.02Å; F335-V357 WeakPolarHBondContact O-CA 3.23Å; F335-E358 PolarHBondContact O-N 3.12Å
336	A	92.9	Very high	89.2	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	95.6	171.3	0	0	0	0	0	108.2	V274 F275 A276 T277 I334 L360	V274-A336 HydrophobicContact CG1-CB 4.25Å; F275-A336 PolarHBondContact O-N 2.04Å; A276-A336 WeakPolarHBondContact CA-O 3.43Å; T277-A336 PolarHBondContact N-O 2.85Å; I334-A336 PolarHBondContact O-N 3.31Å; A336-L360 HydrophobicContact CB-CB 4.43Å; A336-L360 HydrophobicContact CB-CD1 4.35Å; A336-L360 HydrophobicContact CB-CD2 4.35Å
337	V	91.8	Very high	88.9	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	153.2	-170.9	-59.4	0	0	0	0	111.9	T277 F335 L341 Y345 V357 E358 I359 L360	T277-V337 HydrophobicContact CG2-CG1 3.97Å; T277-V337 WeakPolarHBondContact O-CA 3.21Å; F335-V337 HydrophobicContact CB-CG1 4.28Å; V337-L341 HydrophobicContact CB-CB 4.41Å; V337-L341 HydrophobicContact CG2-CB 4.44Å; V337-Y345 HydrophobicContact CB-CD2 4.12Å; V337-Y345 HydrophobicContact CB-CE2 4.41Å; V337-Y345 HydrophobicContact CG1-CD1 4.11Å; V337-Y345 HydrophobicContact CG1-CD2 3.69Å; V337-Y345 HydrophobicContact CG1-CE1 4.19Å; V337-Y345 HydrophobicContact CG1-CE2 3.79Å; V337-Y345 HydrophobicContact CG1-CG 3.84Å; V337-Y345 HydrophobicContact CG2-CD2 3.98Å; V337-Y345 HydrophobicContact CG2-CG 4.18Å; V337-V357 HydrophobicContact CG2-CG2 3.89Å; V337-E358 PolarHBondContact N-O 2.9Å; V337-E358 VanDerWaalsContact N-O 3.16Å; V337-I359 WeakPolarHBondContact O-CA 2.92Å; V337-L360 PolarHBondContact O-N 3.2Å
338	T	87.3	Confident	89	Confident	25 Å²	25	47.6 Å²	47.6	15%	0.153	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	154.3	178.3	65.7	0	0	0	0	112	D278 R340 L341 Y342	D278-T338 HydrophobicContact CB-CG2 3.55Å; T338-R340 PolarHBondContact O-N 3.06Å; T338-L341 PolarHBondContact O-N 3.23Å; T338-Y342 PolarHBondContact O-N 2.83Å
339	K	85.7	Confident	88.9	Confident	166 Å²	166	43.5 Å²	43.5	72%	0.722	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-34.4	-176.5	-175.1	178.6	179.1	-177	0	113.8	L341 I359	K339-L341 VanDerWaalsContact C-N 3.27Å; K339-L341 PolarHBondContact O-N 3.49Å; K339-I359 HydrophobicContact CB-CG2 3.97Å
340	R	86.4	Confident	88.2	Confident	227 Å²	227	47.1 Å²	47.1	86%	0.857	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-33.4	-179.5	-176.7	-179.5	176.1	-160.1	-3.6	112.4	T338	T338-R340 PolarHBondContact O-N 3.06Å
341	L	88.4	Confident	87.9	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.052	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.3	-173.4	-60.9	179.5	0	0	0	113.9	D278 D279 V280 V337 T338 K339 V343 I344 Y345	D278-L341 WeakPolarHBondContact O-CD1 3.33Å; D279-L341 VanDerWaalsContact CA-CD1 3.42Å; D279-L341 VanDerWaalsContact O-CD1 3.29Å; D279-L341 WeakPolarHBondContact O-CD1 3.25Å; V280-L341 HydrophobicContact CG1-CD2 3.75Å; V337-L341 HydrophobicContact CB-CB 4.41Å; V337-L341 HydrophobicContact CG2-CB 4.44Å; T338-L341 PolarHBondContact O-N 3.23Å; K339-L341 VanDerWaalsContact C-N 3.27Å; K339-L341 PolarHBondContact O-N 3.49Å; L341-V343 PolarHBondContact O-N 3.41Å; L341-V343 VanDerWaalsContact O-N 3.07Å; L341-I344 HydrophobicContact CD2-CD1 4.49Å; L341-I344 PolarHBondContact O-N 3.04Å; L341-Y345 HydrophobicContact CB-CD2 4Å; L341-Y345 HydrophobicContact CB-CE2 4.15Å; L341-Y345 HydrophobicContact CD1-CE2 4.27Å; L341-Y345 PolarHBondContact O-N 3.31Å
342	Y	85.9	Confident	87.5	Confident	38 Å²	38	50.4 Å²	50.4	15%	0.149	25%	0.252	C	S	.	.	H	α-helix	trans	-45.5	-45.4	-177.9	-180	-95.8	0	0	0	113	T338 I344 K346 V357 I359	T338-Y342 PolarHBondContact O-N 2.83Å; Y342-I344 PolarHBondContact O-N 3.45Å; Y342-K346 HydrophobicContact CE1-CB 4.39Å; Y342-K346 WeakPolarHBondContact O-CB 3.48Å; Y342-K346 PolarHBondContact O-N 3.29Å; Y342-V357 HydrophobicContact CD2-CG1 4.35Å; Y342-V357 HydrophobicContact CD2-CG2 3.85Å; Y342-V357 HydrophobicContact CE2-CB 4.41Å; Y342-V357 HydrophobicContact CE2-CG1 3.74Å; Y342-V357 HydrophobicContact CE2-CG2 4Å; Y342-I359 HydrophobicContact CD2-CD1 4.17Å; Y342-I359 HydrophobicContact CD2-CG1 3.47Å; Y342-I359 VanDerWaalsContact CD2-CG1 3.47Å; Y342-I359 HydrophobicContact CE2-CG1 3.95Å; Y342-I359 HydrophobicContact CG-CD1 4.46Å; Y342-I359 HydrophobicContact CG-CG1 4.1Å
343	V	85.4	Confident	86.5	Confident	78 Å²	78	54.6 Å²	54.6	47%	0.473	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-41.4	-177	-179.9	0	0	0	0	112.2	L341 K346 N347	L341-V343 PolarHBondContact O-N 3.41Å; L341-V343 VanDerWaalsContact O-N 3.07Å; V343-K346 PolarHBondContact O-N 3.15Å; V343-N347 VanDerWaalsContact O-CG 3.31Å; V343-N347 PolarHBondContact O-N 2.7Å; V343-N347 PolarHBondContact O-ND2 2.97Å
344	I	86.7	Confident	85.5	Confident	71 Å²	71	56.2 Å²	56.2	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-50.5	-178.5	-64.6	173.9	0	0	0	109.6	V280 L341 Y342 K346 N347 F348	V280-I344 HydrophobicContact CG1-CD1 3.93Å; L341-I344 HydrophobicContact CD2-CD1 4.49Å; L341-I344 PolarHBondContact O-N 3.04Å; Y342-I344 PolarHBondContact O-N 3.45Å; I344-K346 VanDerWaalsContact C-N 3.28Å; I344-K346 PolarHBondContact O-N 3.48Å; I344-N347 WeakPolarHBondContact O-CB 3.43Å; I344-N347 PolarHBondContact O-N 2.85Å; I344-N347 VanDerWaalsContact O-N 3.1Å; I344-F348 HydrophobicContact CG2-CE2 3.77Å; I344-F348 HydrophobicContact CG2-CZ 3.83Å; I344-F348 PolarHBondContact O-N 2.83Å; I344-F348 VanDerWaalsContact O-N 3.17Å
345	Y	90.3	Very high	85.1	Confident	1 Å²	1	57 Å²	57	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-32.3	177.9	-77.3	-87.8	0	0	0	112.5	F275 T277 D279 P281 F335 V337 L341 N347 F348 T349	F275-Y345 HydrophobicContact CD1-CE1 4.34Å; F275-Y345 AromaticContact CE1-CE1 3.82Å; F275-Y345 HydrophobicContact CE1-CE1 3.82Å; T277-Y345 HydrophobicContact CG2-CE2 4.46Å; T277-Y345 WeakPolarHBondContact CG2-OH 3.06Å; D279-Y345 PolarHBondContact O-OH 3.31Å; D279-Y345 VanDerWaalsContact O-OH 3.05Å; P281-Y345 VanDerWaalsContact CD-OH 3.28Å; P281-Y345 WeakPolarHBondContact CD-OH 3.41Å; P281-Y345 HydrophobicContact CG-CE1 4.36Å; F335-Y345 HydrophobicContact CB-CD1 4.07Å; F335-Y345 HydrophobicContact CB-CG 4.45Å; F335-Y345 AromaticContact CD1-CD1 3.42Å; F335-Y345 HydrophobicContact CD1-CD1 3.42Å; F335-Y345 VanDerWaalsContact CD1-CD1 3.42Å; F335-Y345 AromaticContact CD1-CE1 3.73Å; F335-Y345 HydrophobicContact CD1-CE1 3.73Å; F335-Y345 HydrophobicContact CD2-CD1 4.08Å; F335-Y345 AromaticContact CE1-CD1 3.71Å; F335-Y345 HydrophobicContact CE1-CD1 3.71Å; F335-Y345 AromaticContact CE1-CE1 3.85Å; F335-Y345 HydrophobicContact CE1-CE1 3.85Å; F335-Y345 HydrophobicContact CE2-CD1 4.33Å; F335-Y345 AromaticContact CG-CD1 3.6Å; F335-Y345 HydrophobicContact CG-CD1 3.6Å; F335-Y345 HydrophobicContact CG-CE1 4.36Å; F335-Y345 HydrophobicContact CG-CG 4.37Å; F335-Y345 HydrophobicContact CZ-CD1 4.16Å; V337-Y345 HydrophobicContact CB-CD2 4.12Å; V337-Y345 HydrophobicContact CB-CE2 4.41Å; V337-Y345 HydrophobicContact CG1-CD1 4.11Å; V337-Y345 HydrophobicContact CG1-CD2 3.69Å; V337-Y345 HydrophobicContact CG1-CE1 4.19Å; V337-Y345 HydrophobicContact CG1-CE2 3.79Å; V337-Y345 HydrophobicContact CG1-CG 3.84Å; V337-Y345 HydrophobicContact CG2-CD2 3.98Å; V337-Y345 HydrophobicContact CG2-CG 4.18Å; L341-Y345 HydrophobicContact CB-CD2 4Å; L341-Y345 HydrophobicContact CB-CE2 4.15Å; L341-Y345 HydrophobicContact CD1-CE2 4.27Å; L341-Y345 PolarHBondContact O-N 3.31Å; Y345-N347 VanDerWaalsContact C-N 3.3Å; Y345-N347 PolarHBondContact O-N 2.79Å; Y345-F348 AromaticContact CD1-CD2 3.92Å; Y345-F348 HydrophobicContact CD1-CD2 3.92Å; Y345-F348 HydrophobicContact CD1-CE2 4.41Å; Y345-F348 HydrophobicContact CE1-CD2 4.34Å; Y345-F348 HydrophobicContact CE1-CE2 4.49Å; Y345-F348 HydrophobicContact CG-CD2 4.31Å; Y345-F348 WeakPolarHBondContact O-CB 3.38Å; Y345-F348 PolarHBondContact O-N 2.96Å; Y345-F348 VanDerWaalsContact O-N 3.14Å; Y345-T349 WeakPolarHBondContact O-CG2 3.34Å; Y345-T349 PolarHBondContact O-N 2.92Å; Y345-T349 VanDerWaalsContact O-N 3.08Å
346	K	84.9	Confident	84.7	Confident	76 Å²	76	58.1 Å²	58.1	33%	0.33	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-40.7	172	-175.3	63.8	-170.7	158	0	111.6	Y342 V343 I344 F348 T349 V357	Y342-K346 HydrophobicContact CE1-CB 4.39Å; Y342-K346 WeakPolarHBondContact O-CB 3.48Å; Y342-K346 PolarHBondContact O-N 3.29Å; V343-K346 PolarHBondContact O-N 3.15Å; I344-K346 VanDerWaalsContact C-N 3.28Å; I344-K346 PolarHBondContact O-N 3.48Å; K346-F348 VanDerWaalsContact C-N 3.31Å; K346-F348 PolarHBondContact O-N 3.01Å; K346-T349 PolarHBondContact NZ-OG1 3.26Å; K346-T349 PolarHBondContact O-N 3.42Å; K346-T349 VanDerWaalsContact O-N 3.12Å; K346-T349 PolarHBondContact O-OG1 3.43Å; K346-V357 HydrophobicContact CB-CG1 3.91Å; K346-V357 HydrophobicContact CD-CG1 3.41Å; K346-V357 VanDerWaalsContact CD-CG1 3.41Å; K346-V357 HydrophobicContact CG-CG1 4.27Å
347	N	86.1	Confident	84.4	Confident	101 Å²	101	58.4 Å²	58.4	54%	0.54	31%	0.311	S	S	.	.	H	α-helix	trans	-65	-35.8	175.3	-67.9	-17.4	0	0	0	111.8	V343 I344 Y345 T349 A350	V343-N347 VanDerWaalsContact O-CG 3.31Å; V343-N347 PolarHBondContact O-N 2.7Å; V343-N347 PolarHBondContact O-ND2 2.97Å; I344-N347 WeakPolarHBondContact O-CB 3.43Å; I344-N347 PolarHBondContact O-N 2.85Å; I344-N347 VanDerWaalsContact O-N 3.1Å; Y345-N347 VanDerWaalsContact C-N 3.3Å; Y345-N347 PolarHBondContact O-N 2.79Å; N347-T349 VanDerWaalsContact C-N 3.28Å; N347-T349 PolarHBondContact O-N 3.04Å; N347-A350 WeakPolarHBondContact O-CB 3.46Å; N347-A350 PolarHBondContact O-N 2.93Å
348	F	88.8	Confident	84.1	Confident	24 Å²	24	60.5 Å²	60.5	11%	0.105	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-34.1	171.9	-60.9	-34.7	0	0	0	112.6	F250 P281 L283 L319 F335 I344 Y345 K346 A350 L351 I352	F250-F348 HydrophobicContact CZ-CD2 4.02Å; F250-F348 HydrophobicContact CZ-CE2 4.01Å; P281-F348 HydrophobicContact CG-CE2 3.7Å; P281-F348 HydrophobicContact CG-CZ 4.21Å; L283-F348 HydrophobicContact CD2-CZ 4.27Å; L319-F348 HydrophobicContact CD1-CD1 3.83Å; L319-F348 HydrophobicContact CD1-CE1 4.07Å; L319-F348 HydrophobicContact CD2-CD1 4.01Å; L319-F348 HydrophobicContact CD2-CE1 4.39Å; L319-F348 HydrophobicContact CD2-CG 4.33Å; F335-F348 HydrophobicContact CE2-CB 4.33Å; I344-F348 HydrophobicContact CG2-CE2 3.77Å; I344-F348 HydrophobicContact CG2-CZ 3.83Å; I344-F348 PolarHBondContact O-N 2.83Å; I344-F348 VanDerWaalsContact O-N 3.17Å; Y345-F348 AromaticContact CD1-CD2 3.92Å; Y345-F348 HydrophobicContact CD1-CD2 3.92Å; Y345-F348 HydrophobicContact CD1-CE2 4.41Å; Y345-F348 HydrophobicContact CE1-CD2 4.34Å; Y345-F348 HydrophobicContact CE1-CE2 4.49Å; Y345-F348 HydrophobicContact CG-CD2 4.31Å; Y345-F348 WeakPolarHBondContact O-CB 3.38Å; Y345-F348 PolarHBondContact O-N 2.96Å; Y345-F348 VanDerWaalsContact O-N 3.14Å; K346-F348 VanDerWaalsContact C-N 3.31Å; K346-F348 PolarHBondContact O-N 3.01Å; F348-A350 PolarHBondContact O-N 3.46Å; F348-L351 PolarHBondContact O-N 3.21Å; F348-I352 PolarHBondContact O-N 3.31Å
349	T	83.4	Confident	84	Confident	20 Å²	20	62.4 Å²	62.4	12%	0.123	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-22.8	177.2	70	0	0	0	0	114.2	F335 Y345 K346 N347 L351 T355 V357	F335-T349 HydrophobicContact CD2-CG2 4.05Å; F335-T349 HydrophobicContact CE2-CG2 4.36Å; Y345-T349 WeakPolarHBondContact O-CG2 3.34Å; Y345-T349 PolarHBondContact O-N 2.92Å; Y345-T349 VanDerWaalsContact O-N 3.08Å; K346-T349 PolarHBondContact NZ-OG1 3.26Å; K346-T349 PolarHBondContact O-N 3.42Å; K346-T349 VanDerWaalsContact O-N 3.12Å; K346-T349 PolarHBondContact O-OG1 3.43Å; N347-T349 VanDerWaalsContact C-N 3.28Å; N347-T349 PolarHBondContact O-N 3.04Å; T349-L351 VanDerWaalsContact C-N 3.28Å; T349-T355 VanDerWaalsContact CA-OG1 3.25Å; T349-T355 WeakPolarHBondContact CA-OG1 3.14Å; T349-T355 WeakPolarHBondContact CB-OG1 3.21Å; T349-T355 WeakPolarHBondContact CG2-OG1 3.29Å; T349-V357 HydrophobicContact CG2-CB 4.1Å; T349-V357 HydrophobicContact CG2-CG1 4.13Å
350	A	76.4	Confident	83.7	Confident	88 Å²	88	54.7 Å²	54.7	73%	0.727	30%	0.296	S	S	*	.	H	α-helix	trans	-73.4	-23.3	173.9	0	0	0	0	0	112.6	N347 F348	N347-A350 WeakPolarHBondContact O-CB 3.46Å; N347-A350 PolarHBondContact O-N 2.93Å; F348-A350 PolarHBondContact O-N 3.46Å
351	L	81	Confident	83.2	Confident	112 Å²	112	47.4 Å²	47.4	59%	0.586	27%	0.274	S	S	*	.	H	α-helix	trans	-99.6	-21.8	-177.2	-59.8	175.6	0	0	0	112.7	L319 F348 T349	L319-L351 HydrophobicContact CD1-CD1 3.64Å; F348-L351 PolarHBondContact O-N 3.21Å; T349-L351 VanDerWaalsContact C-N 3.28Å
352	I	82	Confident	82.3	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	31%	0.309	C	S	.	.	S	Bend	trans	-115.9	97.8	179.9	-48.9	179.2	0	0	0	108.7	L319 L322 L326 F348 T355	L319-I352 HydrophobicContact CD2-CD1 3.96Å; L322-I352 HydrophobicContact CB-CD1 4.42Å; L326-I352 HydrophobicContact CD1-CG2 3.87Å; F348-I352 PolarHBondContact O-N 3.31Å; I352-T355 HydrophobicContact CB-CG2 3.75Å; I352-T355 HydrophobicContact CG2-CG2 3.37Å; I352-T355 WeakPolarHBondContact O-CG2 3.49Å; I352-T355 PolarHBondContact O-N 2.99Å; I352-T355 PolarHBondContact O-OG1 2.92Å
353	P	71.8	Confident	81.5	Confident	105 Å²	105	55.1 Å²	55.1	68%	0.682	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	147	179.8	-22.6	33.2	0	0	0	112.3	T355	P353-T355 VanDerWaalsContact C-N 3.28Å; P353-T355 PolarHBondContact O-N 3.31Å
354	G	72.7	Confident	80.9	Confident	35 Å²	35	51.4 Å²	51.4	36%	0.361	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	8.7	179.4	0	0	0	0	0	114.7	F332	F332-G354 WeakPolarHBondContact CD1-O 3.28Å
355	T	84.5	Confident	80.3	Confident	18 Å²	18	54.7 Å²	54.7	11%	0.11	30%	0.302	C	S	.	.			trans	-99.2	150.5	177.3	64.6	0	0	0	0	112.6	L333 T349 I352 P353	L333-T355 HydrophobicContact CB-CG2 3.83Å; L333-T355 HydrophobicContact CD2-CG2 4.18Å; L333-T355 HydrophobicContact CG-CG2 4.38Å; L333-T355 VanDerWaalsContact O-CA 3.3Å; L333-T355 WeakPolarHBondContact O-CA 3.36Å; T349-T355 VanDerWaalsContact CA-OG1 3.25Å; T349-T355 WeakPolarHBondContact CA-OG1 3.14Å; T349-T355 WeakPolarHBondContact CB-OG1 3.21Å; T349-T355 WeakPolarHBondContact CG2-OG1 3.29Å; I352-T355 HydrophobicContact CB-CG2 3.75Å; I352-T355 HydrophobicContact CG2-CG2 3.37Å; I352-T355 WeakPolarHBondContact O-CG2 3.49Å; I352-T355 PolarHBondContact O-N 2.99Å; I352-T355 PolarHBondContact O-OG1 2.92Å; P353-T355 VanDerWaalsContact C-N 3.28Å; P353-T355 PolarHBondContact O-N 3.31Å
356	T	86.4	Confident	80	Confident	23 Å²	23	55.7 Å²	55.7	14%	0.141	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	154.5	176.4	55.9	0	0	0	0	109.8	L333 F335	L333-T356 PolarHBondContact O-N 3.24Å; F335-T356 PolarHBondContact N-O 3.48Å
357	V	86.9	Confident	79.8	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.4	175.6	60.9	0	0	0	0	108.7	F335 V337 Y342 K346 T349	F335-V357 HydrophobicContact CB-CB 4.14Å; F335-V357 HydrophobicContact CB-CG2 4.02Å; F335-V357 WeakPolarHBondContact O-CA 3.23Å; V337-V357 HydrophobicContact CG2-CG2 3.89Å; Y342-V357 HydrophobicContact CD2-CG1 4.35Å; Y342-V357 HydrophobicContact CD2-CG2 3.85Å; Y342-V357 HydrophobicContact CE2-CB 4.41Å; Y342-V357 HydrophobicContact CE2-CG1 3.74Å; Y342-V357 HydrophobicContact CE2-CG2 4Å; K346-V357 HydrophobicContact CB-CG1 3.91Å; K346-V357 HydrophobicContact CD-CG1 3.41Å; K346-V357 VanDerWaalsContact CD-CG1 3.41Å; K346-V357 HydrophobicContact CG-CG1 4.27Å; T349-V357 HydrophobicContact CG2-CB 4.1Å; T349-V357 HydrophobicContact CG2-CG1 4.13Å
358	E	85.8	Confident	79.6	Confident	45 Å²	45	47.9 Å²	47.9	21%	0.21	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.5	-178.9	-67.4	-58.7	158.8	0	0	109.5	F335 V337 L360 L370	F335-E358 PolarHBondContact O-N 3.12Å; V337-E358 PolarHBondContact N-O 2.9Å; V337-E358 VanDerWaalsContact N-O 3.16Å; E358-L360 PolarHBondContact O-N 3.47Å; E358-L370 HydrophobicContact CB-CB 4.06Å; E358-L370 HydrophobicContact CB-CD1 3.92Å; E358-L370 HydrophobicContact CB-CD2 3.88Å; E358-L370 HydrophobicContact CB-CG 4.13Å; E358-L370 HydrophobicContact CG-CB 4.36Å; E358-L370 HydrophobicContact CG-CD2 4.44Å
359	I	83.4	Confident	79.4	Confident	65 Å²	65	53.6 Å²	53.6	33%	0.333	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	113.7	-178	-60.9	173.5	0	0	0	108.3	V337 K339 Y342 N366 L370	V337-I359 WeakPolarHBondContact O-CA 2.92Å; K339-I359 HydrophobicContact CB-CG2 3.97Å; Y342-I359 HydrophobicContact CD2-CD1 4.17Å; Y342-I359 HydrophobicContact CD2-CG1 3.47Å; Y342-I359 VanDerWaalsContact CD2-CG1 3.47Å; Y342-I359 HydrophobicContact CE2-CG1 3.95Å; Y342-I359 HydrophobicContact CG-CD1 4.46Å; Y342-I359 HydrophobicContact CG-CG1 4.1Å; I359-N366 PolarHBondContact O-ND2 3.24Å; I359-L370 WeakPolarHBondContact O-CD1 3.38Å
360	L	80.4	Confident	79.5	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	131.3	171	-168.1	62.9	0	0	0	109.5	A276 A336 V337 E358 S364 V367 L370	A276-L360 HydrophobicContact CB-CD2 4.28Å; A336-L360 HydrophobicContact CB-CB 4.43Å; A336-L360 HydrophobicContact CB-CD1 4.35Å; A336-L360 HydrophobicContact CB-CD2 4.35Å; V337-L360 PolarHBondContact O-N 3.2Å; E358-L360 PolarHBondContact O-N 3.47Å; L360-S364 WeakPolarHBondContact CD2-OG 3.43Å; L360-V367 HydrophobicContact CD1-CB 3.81Å; L360-V367 HydrophobicContact CD1-CG2 4.06Å; L360-L370 HydrophobicContact CD1-CD1 4.17Å
361	D	76.8	Confident	79.9	Confident	73 Å²	73	49.3 Å²	49.3	39%	0.39	26%	0.26	S	S	.	.			trans	-64.5	153.3	169.3	-73	-23.5	0	0	0	109.8	D363 S364 N366	D361-D363 PolarHBondContact O-N 3.13Å; D361-S364 PolarHBondContact O-N 2.7Å; D361-N366 VanDerWaalsContact CG-CG 3.48Å; D361-N366 PolarHBondContact N-OD1 3.17Å; D361-N366 WeakPolarHBondContact OD2-CB 3.11Å
362	Q	68.1	Low	80.1	Confident	167 Å²	167	45.7 Å²	45.7	78%	0.78	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-20	-178.2	-73.4	-176.3	-33.9	0	0	114.1
363	D	68.9	Low	80.2	Confident	43 Å²	43	47.9 Å²	47.9	23%	0.23	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	12.2	177.8	61.3	6	0	0	0	112.8	T156 D361 K365	T156-D363 WeakPolarHBondContact CB-O 3.49Å; T156-D363 VanDerWaalsContact CG2-O 3.26Å; T156-D363 WeakPolarHBondContact CG2-O 3.44Å; T156-D363 PolarHBondContact OG1-O 2.85Å; D361-D363 PolarHBondContact O-N 3.13Å; D363-K365 PolarHBondContact O-N 2.71Å; D363-K365 VanDerWaalsContact O-N 3.1Å; D363-K365 WeakPolarHBondContact OD1-CB 3.36Å; D363-K365 WeakPolarHBondContact OD1-CG 3.38Å; D363-K365 PolarHBondContact OD1-N 2.71Å; D363-K365 WeakPolarHBondContact OD2-CD 3.31Å; D363-K365 WeakPolarHBondContact OD2-CE 3.49Å; D363-K365 IonicContact OD2-NZ 2.79Å; D363-K365 PolarHBondContact OD2-NZ 3.05Å
364	S	72.7	Confident	80.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.			trans	57.9	16	-178.6	-74.3	0	0	0	0	116.5	D153 L360 D361 N366 V367	D153-S364 VanDerWaalsContact OD1-CB 3.3Å; D153-S364 WeakPolarHBondContact OD1-CB 3.48Å; D153-S364 PolarHBondContact OD1-N 3.5Å; D153-S364 PolarHBondContact OD1-OG 2.79Å; L360-S364 WeakPolarHBondContact CD2-OG 3.43Å; D361-S364 PolarHBondContact O-N 2.7Å; S364-N366 VanDerWaalsContact C-N 3.29Å; S364-N366 PolarHBondContact O-N 2.81Å; S364-V367 WeakPolarHBondContact O-CB 3.04Å; S364-V367 VanDerWaalsContact O-CG1 3.28Å; S364-V367 WeakPolarHBondContact O-CG1 3.5Å; S364-V367 PolarHBondContact O-N 3Å
365	K	75.9	Confident	81.2	Confident	140 Å²	140	41.3 Å²	41.3	61%	0.609	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.1	-175.3	-77.6	179	-173.6	145.3	0	114.7	T156 D363	T156-K365 HydrophobicContact CG2-CG 4.13Å; D363-K365 PolarHBondContact O-N 2.71Å; D363-K365 VanDerWaalsContact O-N 3.1Å; D363-K365 WeakPolarHBondContact OD1-CB 3.36Å; D363-K365 WeakPolarHBondContact OD1-CG 3.38Å; D363-K365 PolarHBondContact OD1-N 2.71Å; D363-K365 WeakPolarHBondContact OD2-CD 3.31Å; D363-K365 WeakPolarHBondContact OD2-CE 3.49Å; D363-K365 IonicContact OD2-NZ 2.79Å; D363-K365 PolarHBondContact OD2-NZ 3.05Å
366	N	83.3	Confident	81.1	Confident	23 Å²	23	43.8 Å²	43.8	12%	0.123	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.7	-178	68.8	-20.6	0	0	0	114.1	I359 D361 S364 I368 Q369 L370	I359-N366 PolarHBondContact O-ND2 3.24Å; D361-N366 VanDerWaalsContact CG-CG 3.48Å; D361-N366 PolarHBondContact N-OD1 3.17Å; D361-N366 WeakPolarHBondContact OD2-CB 3.11Å; S364-N366 VanDerWaalsContact C-N 3.29Å; S364-N366 PolarHBondContact O-N 2.81Å; N366-I368 VanDerWaalsContact C-N 3.25Å; N366-I368 PolarHBondContact O-N 2.96Å; N366-I368 VanDerWaalsContact O-N 3.09Å; N366-Q369 WeakPolarHBondContact O-CB 3.38Å; N366-Q369 PolarHBondContact O-N 3.38Å; N366-L370 WeakPolarHBondContact O-CG 3.41Å; N366-L370 PolarHBondContact O-N 2.91Å; N366-L370 VanDerWaalsContact O-N 3.13Å
367	V	81	Confident	80.9	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-57	-33.5	-169.9	72.8	0	0	0	0	114.1	Y142 L160 L360 S364 Q369 L370 I371	Y142-V367 HydrophobicContact CE2-CG2 3.91Å; L160-V367 HydrophobicContact CD1-CG1 4.39Å; L160-V367 HydrophobicContact CD2-CG1 3.15Å; L160-V367 HydrophobicContact CG-CG1 4.36Å; L360-V367 HydrophobicContact CD1-CB 3.81Å; L360-V367 HydrophobicContact CD1-CG2 4.06Å; S364-V367 WeakPolarHBondContact O-CB 3.04Å; S364-V367 VanDerWaalsContact O-CG1 3.28Å; S364-V367 WeakPolarHBondContact O-CG1 3.5Å; S364-V367 PolarHBondContact O-N 3Å; V367-Q369 PolarHBondContact O-N 3.1Å; V367-L370 WeakPolarHBondContact O-CB 3.49Å; V367-L370 PolarHBondContact O-N 3.5Å; V367-I371 HydrophobicContact CG2-CD1 4.21Å; V367-I371 WeakPolarHBondContact O-CD1 3.33Å; V367-I371 VanDerWaalsContact O-CG1 3.3Å; V367-I371 WeakPolarHBondContact O-CG1 3.33Å; V367-I371 PolarHBondContact O-N 2.7Å
368	I	82	Confident	80.6	Confident	11 Å²	11	46 Å²	46	6%	0.056	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-46.1	174.8	-66	173.5	0	0	0	110.9	L160 K163 L164 E167 N366 L370 I371 I372	L160-I368 HydrophobicContact CD1-CD1 3.41Å; L160-I368 VanDerWaalsContact CD1-CD1 3.41Å; L160-I368 HydrophobicContact CD1-CG1 3.75Å; L160-I368 HydrophobicContact CD2-CG1 4.17Å; L160-I368 HydrophobicContact CG-CD1 3.85Å; L160-I368 HydrophobicContact CG-CG1 3.96Å; K163-I368 HydrophobicContact CB-CD1 3.89Å; K163-I368 HydrophobicContact CD-CD1 3.76Å; K163-I368 HydrophobicContact CG-CD1 3.67Å; L164-I368 HydrophobicContact CB-CD1 4.39Å; L164-I368 HydrophobicContact CB-CG1 4.21Å; L164-I368 HydrophobicContact CD1-CG1 4.08Å; L164-I368 HydrophobicContact CD1-CG2 4.36Å; E167-I368 HydrophobicContact CB-CG2 4Å; E167-I368 HydrophobicContact CG-CG2 3.9Å; N366-I368 VanDerWaalsContact C-N 3.25Å; N366-I368 PolarHBondContact O-N 2.96Å; N366-I368 VanDerWaalsContact O-N 3.09Å; I368-L370 VanDerWaalsContact C-N 3.28Å; I368-L370 PolarHBondContact O-N 2.77Å; I368-I371 PolarHBondContact O-N 3.48Å; I368-I372 HydrophobicContact CG2-CD1 3.82Å; I368-I372 VanDerWaalsContact O-CG1 3.32Å; I368-I372 WeakPolarHBondContact O-CG1 3.28Å; I368-I372 PolarHBondContact O-N 3.19Å
369	Q	84.2	Confident	80.4	Confident	144 Å²	144	44.1 Å²	44.1	67%	0.673	22%	0.224	S	C	*	.	H	α-helix	trans	-65.7	-36	179.8	-64.7	-178.9	0.8	0	0	111	N366 V367 I372 A373	N366-Q369 WeakPolarHBondContact O-CB 3.38Å; N366-Q369 PolarHBondContact O-N 3.38Å; V367-Q369 PolarHBondContact O-N 3.1Å; Q369-I372 PolarHBondContact O-N 3.26Å; Q369-A373 VanDerWaalsContact O-CB 3.28Å; Q369-A373 WeakPolarHBondContact O-CB 3.34Å; Q369-A373 PolarHBondContact O-N 3.37Å
370	L	85.5	Confident	80.4	Confident	17 Å²	17	42 Å²	42	9%	0.089	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-46	175.3	-55.8	-176.6	0	0	0	111.3	E358 I359 L360 N366 V367 I368 I372 A373 A374	E358-L370 HydrophobicContact CB-CB 4.06Å; E358-L370 HydrophobicContact CB-CD1 3.92Å; E358-L370 HydrophobicContact CB-CD2 3.88Å; E358-L370 HydrophobicContact CB-CG 4.13Å; E358-L370 HydrophobicContact CG-CB 4.36Å; E358-L370 HydrophobicContact CG-CD2 4.44Å; I359-L370 WeakPolarHBondContact O-CD1 3.38Å; L360-L370 HydrophobicContact CD1-CD1 4.17Å; N366-L370 WeakPolarHBondContact O-CG 3.41Å; N366-L370 PolarHBondContact O-N 2.91Å; N366-L370 VanDerWaalsContact O-N 3.13Å; V367-L370 WeakPolarHBondContact O-CB 3.49Å; V367-L370 PolarHBondContact O-N 3.5Å; I368-L370 VanDerWaalsContact C-N 3.28Å; I368-L370 PolarHBondContact O-N 2.77Å; L370-I372 PolarHBondContact O-N 2.84Å; L370-A373 PolarHBondContact O-N 2.79Å; L370-A374 VanDerWaalsContact O-CB 3.3Å; L370-A374 WeakPolarHBondContact O-CB 3.49Å; L370-A374 PolarHBondContact O-N 3.45Å
371	I	84.7	Confident	80.6	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-45.5	177.9	-68	161.9	0	0	0	110.9	L140 L164 M168 V274 V367 I368 A374 Y375	L140-I371 HydrophobicContact CD1-CB 4.49Å; L140-I371 HydrophobicContact CD1-CD1 3.95Å; L140-I371 HydrophobicContact CD1-CG1 4.25Å; L140-I371 HydrophobicContact CD1-CG2 3.45Å; L140-I371 VanDerWaalsContact CD1-CG2 3.45Å; L164-I371 HydrophobicContact CD1-CD1 3.78Å; L164-I371 HydrophobicContact CD1-CG2 4.43Å; L164-I371 HydrophobicContact CD2-CD1 4.21Å; M168-I371 HydrophobicContact SD-CG2 4.01Å; V274-I371 HydrophobicContact CG2-CD1 4.07Å; V274-I371 HydrophobicContact CG2-CG1 3.86Å; V367-I371 HydrophobicContact CG2-CD1 4.21Å; V367-I371 WeakPolarHBondContact O-CD1 3.33Å; V367-I371 VanDerWaalsContact O-CG1 3.3Å; V367-I371 WeakPolarHBondContact O-CG1 3.33Å; V367-I371 PolarHBondContact O-N 2.7Å; I368-I371 PolarHBondContact O-N 3.48Å; I371-A374 PolarHBondContact O-N 3.08Å; I371-Y375 WeakPolarHBondContact O-CB 3.33Å; I371-Y375 PolarHBondContact O-N 3.32Å
372	I	85	Confident	81.1	Confident	35 Å²	35	43.3 Å²	43.3	18%	0.179	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-43.7	178.3	-65.8	166.7	0	0	0	110.8	E167 L171 I368 Q369 L370 Y375 N376	E167-I372 HydrophobicContact CB-CD1 3.92Å; E167-I372 HydrophobicContact CG-CD1 4.43Å; L171-I372 HydrophobicContact CD1-CG1 4.3Å; L171-I372 HydrophobicContact CD1-CG2 4.22Å; I368-I372 HydrophobicContact CG2-CD1 3.82Å; I368-I372 VanDerWaalsContact O-CG1 3.32Å; I368-I372 WeakPolarHBondContact O-CG1 3.28Å; I368-I372 PolarHBondContact O-N 3.19Å; Q369-I372 PolarHBondContact O-N 3.26Å; L370-I372 PolarHBondContact O-N 2.84Å; I372-Y375 PolarHBondContact O-N 3.21Å; I372-N376 WeakPolarHBondContact O-CB 3.35Å; I372-N376 VanDerWaalsContact O-CG 3.3Å; I372-N376 PolarHBondContact O-N 2.04Å; I372-N376 PolarHBondContact O-ND2 2.69Å
373	A	83.3	Confident	81.9	Confident	47 Å²	47	38.8 Å²	38.8	39%	0.388	20%	0.196	S	C	.	.	H	α-helix	trans	-63.4	-43.9	177.5	0	0	0	0	0	111.5	Q369 L370 N376 N377	Q369-A373 VanDerWaalsContact O-CB 3.28Å; Q369-A373 WeakPolarHBondContact O-CB 3.34Å; Q369-A373 PolarHBondContact O-N 3.37Å; L370-A373 PolarHBondContact O-N 2.79Å; A373-N376 PolarHBondContact O-N 2.85Å; A373-N377 VanDerWaalsContact O-CB 3.27Å; A373-N377 WeakPolarHBondContact O-CB 3.27Å; A373-N377 PolarHBondContact O-N 2.93Å
374	A	81.6	Confident	82.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-46.2	176	0	0	0	0	0	111.3	I334 L370 I371 N376 N377 I378	I334-A374 HydrophobicContact CD1-CB 3.58Å; I334-A374 HydrophobicContact CG1-CB 4Å; I334-A374 HydrophobicContact CG2-CB 4.32Å; L370-A374 VanDerWaalsContact O-CB 3.3Å; L370-A374 WeakPolarHBondContact O-CB 3.49Å; L370-A374 PolarHBondContact O-N 3.45Å; I371-A374 PolarHBondContact O-N 3.08Å; A374-N376 PolarHBondContact O-N 2.94Å; A374-N377 PolarHBondContact O-N 3.11Å; A374-I378 WeakPolarHBondContact O-CD1 3.36Å; A374-I378 VanDerWaalsContact O-CG1 3.25Å; A374-I378 WeakPolarHBondContact O-CG1 3.25Å; A374-I378 PolarHBondContact O-N 2.96Å
375	Y	83.8	Confident	83.3	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-57.4	-49.6	175.3	176.8	-98.6	0	0	0	111.8	V138 L171 Y270 L272 I371 I372 N377 I378 R379	V138-Y375 HydrophobicContact CG2-CD2 4.32Å; V138-Y375 HydrophobicContact CG2-CE2 3.52Å; L171-Y375 HydrophobicContact CB-CE1 4.03Å; L171-Y375 HydrophobicContact CD1-CD1 3.78Å; L171-Y375 HydrophobicContact CD1-CE1 4.05Å; Y270-Y375 HydrophobicContact CD2-CE2 4.37Å; L272-Y375 HydrophobicContact CD1-CD2 4.24Å; I371-Y375 WeakPolarHBondContact O-CB 3.33Å; I371-Y375 PolarHBondContact O-N 3.32Å; I372-Y375 PolarHBondContact O-N 3.21Å; Y375-N377 VanDerWaalsContact C-N 3.32Å; Y375-N377 PolarHBondContact O-N 3.35Å; Y375-I378 PolarHBondContact O-N 3.21Å; Y375-R379 VanDerWaalsContact CE1-CD 3.44Å; Y375-R379 HydrophobicContact CE1-CG 4.35Å; Y375-R379 HydrophobicContact CE2-CG 4.35Å; Y375-R379 WeakPolarHBondContact O-CB 3.31Å; Y375-R379 WeakPolarHBondContact O-CG 3.44Å; Y375-R379 PolarHBondContact O-N 2.8Å; Y375-R379 WeakPolarHBondContact OH-CD 3.29Å; Y375-R379 PolarHBondContact OH-NH1 2.66Å
376	N	83.9	Confident	83.9	Confident	70 Å²	70	33.9 Å²	33.9	37%	0.374	18%	0.18	S	C	.	.	H	α-helix	trans	-64.3	-36.3	178.3	-72.2	-29.8	0	0	0	112.2	I372 A373 A374 R379 S380	I372-N376 WeakPolarHBondContact O-CB 3.35Å; I372-N376 VanDerWaalsContact O-CG 3.3Å; I372-N376 PolarHBondContact O-N 2.04Å; I372-N376 PolarHBondContact O-ND2 2.69Å; A373-N376 PolarHBondContact O-N 2.85Å; A374-N376 PolarHBondContact O-N 2.94Å; N376-R379 CarbonylContact O-C 3.49Å; N376-R379 PolarHBondContact O-N 3.21Å; N376-S380 WeakPolarHBondContact O-CB 3.25Å; N376-S380 PolarHBondContact O-N 2.74Å
377	N	82	Confident	83.9	Confident	52 Å²	52	34.7 Å²	34.7	28%	0.278	19%	0.187	S	C	.	.	H	α-helix	trans	-66.7	-45.2	176.4	-175.1	-10.8	0	0	0	111.5	A373 A374 Y375 R379 S380 K381	A373-N377 VanDerWaalsContact O-CB 3.27Å; A373-N377 WeakPolarHBondContact O-CB 3.27Å; A373-N377 PolarHBondContact O-N 2.93Å; A374-N377 PolarHBondContact O-N 3.11Å; Y375-N377 VanDerWaalsContact C-N 3.32Å; Y375-N377 PolarHBondContact O-N 3.35Å; N377-R379 VanDerWaalsContact C-N 3.29Å; N377-R379 PolarHBondContact O-N 3.39Å; N377-S380 PolarHBondContact O-N 2.97Å; N377-S380 VanDerWaalsContact O-N 3.09Å; N377-S380 PolarHBondContact O-OG 3.31Å; N377-K381 WeakPolarHBondContact OD1-CE 3.22Å; N377-K381 PolarHBondContact OD1-NZ 3.2Å
378	I	80.1	Confident	84	Confident	25 Å²	25	40.7 Å²	40.7	13%	0.128	22%	0.219	C	C	.	.	H	α-helix	trans	-58	-46.2	174.6	-67.9	161.6	0	0	0	109.6	L272 F332 A374 Y375 S380 K381	L272-I378 HydrophobicContact CD2-CD1 3.74Å; F332-I378 HydrophobicContact CB-CD1 3.78Å; F332-I378 HydrophobicContact CD1-CD1 3.95Å; F332-I378 HydrophobicContact CD1-CG1 4.06Å; F332-I378 HydrophobicContact CD1-CG2 4.17Å; F332-I378 HydrophobicContact CD2-CD1 4.44Å; F332-I378 HydrophobicContact CD2-CG2 4.37Å; F332-I378 HydrophobicContact CE1-CG1 4.36Å; F332-I378 HydrophobicContact CE1-CG2 3.79Å; F332-I378 HydrophobicContact CE2-CG2 4Å; F332-I378 HydrophobicContact CG-CD1 3.81Å; F332-I378 HydrophobicContact CG-CG1 4.4Å; F332-I378 HydrophobicContact CG-CG2 4.42Å; F332-I378 HydrophobicContact CZ-CG2 3.66Å; A374-I378 WeakPolarHBondContact O-CD1 3.36Å; A374-I378 VanDerWaalsContact O-CG1 3.25Å; A374-I378 WeakPolarHBondContact O-CG1 3.25Å; A374-I378 PolarHBondContact O-N 2.96Å; Y375-I378 PolarHBondContact O-N 3.21Å; I378-S380 VanDerWaalsContact C-N 3.29Å; I378-S380 PolarHBondContact O-N 3Å; I378-K381 PolarHBondContact O-N 3.07Å
379	R	82.1	Confident	83.9	Confident	5 Å²	5	44.3 Å²	44.3	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-72.8	-16.8	177.5	-66.5	-162.5	67.5	170.2	8.1	114.2	Q132 V133 Y375 N376 N377 K381 I418	Q132-R379 PolarHBondContact NE2-O 3.34Å; Q132-R379 PolarHBondContact OE1-O 2.77Å; V133-R379 PolarHBondContact O-NH2 3.39Å; Y375-R379 VanDerWaalsContact CE1-CD 3.44Å; Y375-R379 HydrophobicContact CE1-CG 4.35Å; Y375-R379 HydrophobicContact CE2-CG 4.35Å; Y375-R379 WeakPolarHBondContact O-CB 3.31Å; Y375-R379 WeakPolarHBondContact O-CG 3.44Å; Y375-R379 PolarHBondContact O-N 2.8Å; Y375-R379 WeakPolarHBondContact OH-CD 3.29Å; Y375-R379 PolarHBondContact OH-NH1 2.66Å; N376-R379 CarbonylContact O-C 3.49Å; N376-R379 PolarHBondContact O-N 3.21Å; N377-R379 VanDerWaalsContact C-N 3.29Å; N377-R379 PolarHBondContact O-N 3.39Å; R379-K381 PolarHBondContact O-N 3.07Å; R379-I418 VanDerWaalsContact NH2-CG2 3.34Å
380	S	83.5	Confident	83.8	Confident	22 Å²	22	38.1 Å²	38.1	15%	0.154	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-4.7	175	72	0	0	0	0	113.5	N376 N377 I378 A414 D415 L416	N376-S380 WeakPolarHBondContact O-CB 3.25Å; N376-S380 PolarHBondContact O-N 2.74Å; N377-S380 PolarHBondContact O-N 2.97Å; N377-S380 VanDerWaalsContact O-N 3.09Å; N377-S380 PolarHBondContact O-OG 3.31Å; I378-S380 VanDerWaalsContact C-N 3.29Å; I378-S380 PolarHBondContact O-N 3Å; S380-A414 CarbonylContact O-C 3.49Å; S380-A414 VanDerWaalsContact O-C 3.3Å; S380-A414 WeakPolarHBondContact O-CA 3.43Å; S380-D415 PolarHBondContact O-N 2.96Å; S380-L416 WeakPolarHBondContact CA-O 3.34Å; S380-L416 WeakPolarHBondContact O-CB 3.43Å; S380-L416 PolarHBondContact O-N 3.46Å
381	K	83.9	Confident	83.4	Confident	100 Å²	100	45.4 Å²	45.4	44%	0.435	24%	0.241	S	C	.	.			trans	-132.5	145.7	-170.8	-65.2	168.2	-174.1	161.8	0	112.2	Q132 N377 I378 R379 C413 A414	Q132-K381 PolarHBondContact NE2-O 3.19Å; Q132-K381 VanDerWaalsContact NE2-O 3.11Å; N377-K381 WeakPolarHBondContact OD1-CE 3.22Å; N377-K381 PolarHBondContact OD1-NZ 3.2Å; I378-K381 PolarHBondContact O-N 3.07Å; R379-K381 PolarHBondContact O-N 3.07Å; K381-C413 VanDerWaalsContact CA-O 3.31Å; K381-C413 WeakPolarHBondContact CA-O 3.38Å; K381-A414 HydrophobicContact CG-CB 4.18Å
382	V	87.1	Confident	83.1	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.024	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	117.2	166.3	171.8	0	0	0	0	106.9	V130 Q132 K412 C413 L416 V422 F424 P446	V130-V382 HydrophobicContact CB-CG1 4Å; V130-V382 HydrophobicContact CG1-CG1 3.73Å; V130-V382 HydrophobicContact CG1-CG2 4.37Å; V130-V382 HydrophobicContact CG2-CG1 4.31Å; Q132-V382 HydrophobicContact CG-CG2 4.01Å; V382-K412 CarbonylContact O-C 3.49Å; V382-K412 WeakPolarHBondContact O-CA 3.41Å; V382-C413 PolarHBondContact N-O 3.47Å; V382-C413 PolarHBondContact O-N 3.13Å; V382-L416 HydrophobicContact CB-CD1 3.9Å; V382-L416 HydrophobicContact CG2-CD1 3.58Å; V382-V422 HydrophobicContact CB-CG2 4.17Å; V382-V422 HydrophobicContact CG1-CG2 4.05Å; V382-V422 HydrophobicContact CG2-CG2 4.44Å; V382-F424 HydrophobicContact CG1-CE2 3.96Å; V382-F424 HydrophobicContact CG1-CZ 4.13Å; V382-P446 HydrophobicContact CG1-CB 4.44Å
383	E	85.4	Confident	83	Confident	71 Å²	71	45.7 Å²	45.7	33%	0.332	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.7	174.3	178.9	170.6	-173.5	0	0	109.5	R411 K412 P446 V447	E383-R411 WeakPolarHBondContact CA-O 3.49Å; E383-R411 IonicContact OE1-CZ 3.69Å; E383-R411 IonicContact OE1-NE 2.98Å; E383-R411 PolarHBondContact OE1-NE 3.34Å; E383-R411 IonicContact OE1-NH2 3.94Å; E383-K412 HydrophobicContact CB-CB 4.18Å; E383-K412 HydrophobicContact CG-CB 4.22Å; E383-P446 CarbonylContact O-C 3.53Å; E383-P446 VanDerWaalsContact O-CA 3.28Å; E383-P446 WeakPolarHBondContact O-CA 3.44Å; E383-V447 HydrophobicContact CB-CG2 4.19Å; E383-V447 HydrophobicContact CG-CG2 4.38Å; E383-V447 PolarHBondContact O-N 2.99Å
384	L	86.2	Confident	82.9	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	140.2	175.9	-61.5	-178.5	0	0	0	111.7	L128 V130 F397 R411 F424 I444 P446	L128-L384 HydrophobicContact CD2-CD1 3.62Å; L128-L384 HydrophobicContact CD2-CD2 3.78Å; L128-L384 HydrophobicContact CD2-CG 4.37Å; V130-L384 HydrophobicContact CG2-CD2 4.09Å; L384-F397 HydrophobicContact CD1-CD1 4.3Å; L384-F397 HydrophobicContact CD1-CE1 4.36Å; L384-R411 HydrophobicContact CB-CB 4.48Å; L384-R411 PolarHBondContact N-O 3.32Å; L384-R411 WeakPolarHBondContact O-CD 3.1Å; L384-F424 HydrophobicContact CD1-CB 3.75Å; L384-F424 HydrophobicContact CD1-CD1 3.87Å; L384-F424 HydrophobicContact CD1-CD2 3.65Å; L384-F424 HydrophobicContact CD1-CE1 4.37Å; L384-F424 HydrophobicContact CD1-CE2 4.16Å; L384-F424 HydrophobicContact CD1-CG 3.48Å; L384-F424 VanDerWaalsContact CD1-CG 3.48Å; L384-F424 HydrophobicContact CD1-CZ 4.49Å; L384-F424 HydrophobicContact CD2-CD2 4.39Å; L384-F424 HydrophobicContact CD2-CE2 4.32Å; L384-F424 HydrophobicContact CG-CD1 4.41Å; L384-F424 HydrophobicContact CG-CD2 4.08Å; L384-F424 HydrophobicContact CG-CE1 4.43Å; L384-F424 HydrophobicContact CG-CE2 4.07Å; L384-F424 HydrophobicContact CG-CG 4.24Å; L384-F424 HydrophobicContact CG-CZ 4.25Å; L384-I444 HydrophobicContact CB-CG2 4.3Å; L384-I444 HydrophobicContact CD1-CG2 4.13Å; L384-I444 HydrophobicContact CD2-CG2 4.32Å; L384-P446 HydrophobicContact CD2-CB 4.31Å; L384-P446 HydrophobicContact CD2-CG 3.99Å
385	T	85.2	Confident	83.1	Confident	37 Å²	37	46.9 Å²	46.9	23%	0.227	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.4	170.5	54	0	0	0	0	109.9	I444 K445 V447	T385-I444 WeakPolarHBondContact O-CA 3.14Å; T385-K445 PolarHBondContact N-O 2.9Å; T385-K445 PolarHBondContact O-N 2.76Å; T385-K445 WeakPolarHBondContact OG1-CG 3.35Å; T385-K445 PolarHBondContact OG1-O 2.87Å; T385-V447 HydrophobicContact CG2-CG2 3.5Å
386	V	87.1	Confident	83	Confident	43 Å²	43	49.5 Å²	49.5	26%	0.261	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.8	175.7	-169.8	0	0	0	0	108	H389 L395 F397 F442 T443 I444	V386-H389 HydrophobicContact CG1-CB 3.94Å; V386-L395 HydrophobicContact CG1-CD1 3.91Å; V386-L395 HydrophobicContact CG2-CD1 4.02Å; V386-F397 HydrophobicContact CG2-CE2 4.39Å; V386-F397 HydrophobicContact CG2-CZ 3.69Å; V386-F442 HydrophobicContact CG1-CD2 3.85Å; V386-F442 HydrophobicContact CG1-CE2 4.43Å; V386-T443 CarbonylContact C-O 3.57Å; V386-T443 WeakPolarHBondContact CA-O 2.98Å; V386-I444 HydrophobicContact CG2-CG1 4.45Å
387	S	83.8	Confident	83.1	Confident	40 Å²	40	47.3 Å²	47.3	28%	0.28	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.7	175.7	-55.8	0	0	0	0	109.6	H389 T443	S387-H389 PolarHBondContact O-N 2.84Å; S387-T443 PolarHBondContact N-O 3.24Å; S387-T443 PolarHBondContact O-N 2.87Å
388	D	84.2	Confident	83.1	Confident	127 Å²	127	46.6 Å²	46.6	68%	0.679	25%	0.246	S	C	*	.	S	Bend	trans	57.1	36.9	-179.4	-48.1	-54.2	0	0	0	113.2	P390 F442	D388-P390 WeakPolarHBondContact O-CD 3.26Å; D388-F442 VanDerWaalsContact O-CB 3.27Å; D388-F442 WeakPolarHBondContact O-CB 3.46Å
389	H	80.2	Confident	83.4	Confident	86 Å²	86	45.4 Å²	45.4	40%	0.398	24%	0.24	S	C	.	.			trans	-68.5	119.7	-177.5	178.7	-99.3	0	0	0	111.8	V386 S387 I393	V386-H389 HydrophobicContact CG1-CB 3.94Å; S387-H389 PolarHBondContact O-N 2.84Å; H389-I393 PolarHBondContact CE1-O 2.87Å; H389-I393 PolarHBondContact NE2-O 3.22Å
390	P	81.3	Confident	83.8	Confident	14 Å²	14	46.4 Å²	46.4	9%	0.091	25%	0.247	C	C	.	.			trans	-72	141.2	178	-16.2	31.5	0	0	0	112.3	D388 D392 I393 Q440	D388-P390 WeakPolarHBondContact O-CD 3.26Å; P390-D392 PolarHBondContact O-N 2.81Å; P390-I393 HydrophobicContact CB-CD1 4.19Å; P390-I393 HydrophobicContact CB-CG1 4.19Å; P390-I393 HydrophobicContact CG-CD1 3.79Å; P390-I393 HydrophobicContact CG-CG1 4.33Å; P390-I393 PolarHBondContact O-N 2.89Å; P390-Q440 HydrophobicContact CG-CB 3.99Å; P390-Q440 HydrophobicContact CG-CG 4.48Å
391	E	76.5	Confident	84	Confident	170 Å²	170	46.8 Å²	46.8	79%	0.794	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.7	-178.6	-62.3	-173.6	170.3	0	0	113.2	I393	E391-I393 VanDerWaalsContact C-N 3.27Å; E391-I393 PolarHBondContact O-N 2.88Å
392	D	78.3	Confident	83.8	Confident	43 Å²	43	46.3 Å²	46.3	23%	0.23	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.2	-179.2	-63.9	-57.2	0	0	0	113.9	P390 A430 R431 S432	P390-D392 PolarHBondContact O-N 2.81Å; D392-A430 CarbonylContact O-C 3.47Å; D392-R431 PolarHBondContact O-N 3.12Å; D392-S432 VanDerWaalsContact CG-OG 3.29Å; D392-S432 PolarHBondContact OD1-OG 2.78Å
393	I	84.2	Confident	83.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.3	-179.6	-60.9	-176.1	0	0	0	110.4	H389 P390 E391 L395 V428 F442 V457 Y459	H389-I393 PolarHBondContact CE1-O 2.87Å; H389-I393 PolarHBondContact NE2-O 3.22Å; P390-I393 HydrophobicContact CB-CD1 4.19Å; P390-I393 HydrophobicContact CB-CG1 4.19Å; P390-I393 HydrophobicContact CG-CD1 3.79Å; P390-I393 HydrophobicContact CG-CG1 4.33Å; P390-I393 PolarHBondContact O-N 2.89Å; E391-I393 VanDerWaalsContact C-N 3.27Å; E391-I393 PolarHBondContact O-N 2.88Å; I393-L395 HydrophobicContact CG2-CD2 3.89Å; I393-L395 HydrophobicContact CG2-CG 4.15Å; I393-V428 HydrophobicContact CG2-CG1 3.58Å; I393-F442 HydrophobicContact CD1-CD1 4.27Å; I393-F442 HydrophobicContact CD1-CE1 4.05Å; I393-V457 HydrophobicContact CD1-CB 4.17Å; I393-V457 HydrophobicContact CD1-CG1 3.89Å; I393-V457 HydrophobicContact CD1-CG2 3.68Å; I393-Y459 WeakPolarHBondContact CD1-OH 3.43Å; I393-Y459 HydrophobicContact CG1-CE1 4.49Å; I393-Y459 VanDerWaalsContact CG1-OH 3.22Å; I393-Y459 WeakPolarHBondContact CG1-OH 3.37Å
394	N	81.1	Confident	82.6	Confident	36 Å²	36	51 Å²	51	19%	0.193	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.4	165.6	-85.7	-17.7	0	0	0	110.2	V428 E429 R431 A578	N394-V428 WeakPolarHBondContact O-CA 3.43Å; N394-E429 HydrophobicContact CB-CB 4.29Å; N394-E429 PolarHBondContact N-O 2.98Å; N394-E429 PolarHBondContact O-N 2.88Å; N394-R431 VanDerWaalsContact CG-NE 3.3Å; N394-R431 PolarHBondContact ND2-NE 3.2Å; N394-R431 PolarHBondContact OD1-NE 2.66Å; N394-R431 PolarHBondContact OD1-NH2 3.05Å; N394-A578 PolarHBondContact ND2-O 2.92Å
395	L	85.1	Confident	82.4	Confident	36 Å²	36	57.9 Å²	57.9	19%	0.188	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.4	172.3	-60.8	179.5	0	0	0	109.8	V386 I393 F397 V426 S427 V428 F442	V386-L395 HydrophobicContact CG1-CD1 3.91Å; V386-L395 HydrophobicContact CG2-CD1 4.02Å; I393-L395 HydrophobicContact CG2-CD2 3.89Å; I393-L395 HydrophobicContact CG2-CG 4.15Å; L395-F397 HydrophobicContact CB-CE2 3.83Å; L395-F397 HydrophobicContact CB-CZ 4.12Å; L395-F397 HydrophobicContact CD1-CZ 4.22Å; L395-V426 HydrophobicContact CD2-CG1 4.2Å; L395-S427 CarbonylContact C-O 3.59Å; L395-S427 WeakPolarHBondContact CA-O 3.39Å; L395-V428 HydrophobicContact CD2-CB 4.11Å; L395-V428 HydrophobicContact CD2-CG1 3.86Å; L395-V428 HydrophobicContact CD2-CG2 3.56Å; L395-F442 HydrophobicContact CD1-CD2 4.42Å; L395-F442 HydrophobicContact CD1-CE2 3.82Å; L395-F442 HydrophobicContact CD1-CZ 4.25Å; L395-F442 HydrophobicContact CD2-CE2 4.27Å; L395-F442 HydrophobicContact CD2-CZ 3.92Å
396	S	82.4	Confident	82.2	Confident	58 Å²	58	60.1 Å²	60.1	41%	0.406	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142	167.8	57.5	0	0	0	0	109.9	V426 S427	S396-V426 WeakPolarHBondContact O-CA 3.26Å; S396-S427 PolarHBondContact N-O 3.37Å; S396-S427 PolarHBondContact O-N 3.31Å; S396-S427 WeakPolarHBondContact OG-CB 3.33Å
397	F	85	Confident	81.8	Confident	24 Å²	24	61.2 Å²	61.2	11%	0.105	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.1	-172.9	-63.1	-93.3	0	0	0	110	L384 V386 L395 G409 F410 R411 V426 I444	L384-F397 HydrophobicContact CD1-CD1 4.3Å; L384-F397 HydrophobicContact CD1-CE1 4.36Å; V386-F397 HydrophobicContact CG2-CE2 4.39Å; V386-F397 HydrophobicContact CG2-CZ 3.69Å; L395-F397 HydrophobicContact CB-CE2 3.83Å; L395-F397 HydrophobicContact CB-CZ 4.12Å; L395-F397 HydrophobicContact CD1-CZ 4.22Å; F397-G409 VanDerWaalsContact O-CA 3.3Å; F397-G409 WeakPolarHBondContact O-CA 3.47Å; F397-G409 PolarHBondContact O-N 3.02Å; F397-F410 WeakPolarHBondContact CB-O 3.33Å; F397-R411 HydrophobicContact CB-CB 4.1Å; F397-R411 HydrophobicContact CD1-CB 4.37Å; F397-R411 HydrophobicContact CG-CB 4.07Å; F397-V426 HydrophobicContact CD1-CG1 4.28Å; F397-V426 HydrophobicContact CD1-CG2 3.82Å; F397-V426 HydrophobicContact CE1-CB 4.45Å; F397-V426 HydrophobicContact CE1-CG1 3.89Å; F397-V426 HydrophobicContact CE1-CG2 3.79Å; F397-V426 HydrophobicContact CZ-CG1 4.27Å; F397-I444 HydrophobicContact CE1-CD1 4.41Å
398	T	83.1	Confident	81.4	Confident	36 Å²	36	63.5 Å²	63.5	22%	0.221	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	115.6	168.4	-59.5	0	0	0	0	108.2	P406 L407 F424 D425	T398-P406 HydrophobicContact CG2-CB 3.7Å; T398-L407 WeakPolarHBondContact CA-O 3.01Å; T398-F424 CarbonylContact O-C 2.81Å; T398-F424 WeakPolarHBondContact O-CA 3.45Å; T398-D425 PolarHBondContact N-O 2.93Å; T398-D425 PolarHBondContact O-N 2.98Å
399	A	86.3	Confident	80.8	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	137.3	179	0	0	0	0	0	110.7	L407 F410 F424	A399-L407 PolarHBondContact N-O 3.3Å; A399-L407 VanDerWaalsContact N-O 3.08Å; A399-L407 WeakPolarHBondContact O-CB 3.25Å; A399-L407 PolarHBondContact O-N 2.9Å; A399-F410 HydrophobicContact CB-CB 3.85Å; A399-F410 WeakPolarHBondContact CB-O 3.41Å; A399-F410 PolarHBondContact N-O 3.33Å; A399-F424 HydrophobicContact CB-CD1 3.69Å; A399-F424 HydrophobicContact CB-CE1 3.57Å
400	T	90.4	Very high	80.5	Confident	27 Å²	27	57.8 Å²	57.8	17%	0.166	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	103.3	169.5	-54.8	0	0	0	0	108	S423	T400-S423 WeakPolarHBondContact CB-OG 3.26Å; T400-S423 PolarHBondContact N-O 2.94Å; T400-S423 PolarHBondContact O-N 2.91Å; T400-S423 VanDerWaalsContact O-N 3.12Å
401	C	87.3	Confident	80.6	Confident	29 Å²	29	62.7 Å²	62.7	20%	0.196	35%	0.351	C	S	.	.			trans	-95.4	-153.9	-178.1	-44.3	0	0	0	0	110.8	D403 G404 C413	C401-D403 VanDerWaalsContact C-N 3.31Å; C401-D403 PolarHBondContact O-N 3.02Å; C401-G404 PolarHBondContact O-N 3.07Å; C401-C413 HydrophobicContact CB-CB 3.85Å; C401-C413 WeakPolarHBondContact CB-SG 3.33Å; C401-C413 WeakPolarHBondContact SG-CA 3.43Å; C401-C413 WeakPolarHBondContact SG-CB 3.46Å; C401-C413 CovalentContact SG-SG 2.04Å; C401-C413 PolarHBondContact SG-SG 3.01Å
402	Q	79.5	Confident	80.9	Confident	91 Å²	91	58.7 Å²	58.7	43%	0.425	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-36.6	-175.9	-67.7	165.6	-5.8	0	0	114.8	G404 D415 L416 E420	Q402-G404 PolarHBondContact O-N 3.12Å; Q402-G404 VanDerWaalsContact O-N 3.1Å; Q402-D415 PolarHBondContact NE2-O 2.91Å; Q402-L416 HydrophobicContact CG-CD2 4.14Å; Q402-E420 PolarHBondContact NE2-OE1 2.87Å; Q402-E420 PolarHBondContact NE2-OE2 2.82Å
403	D	72.1	Confident	81.2	Confident	121 Å²	121	56.7 Å²	56.7	65%	0.647	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-7.1	-176.3	-68.7	-26.1	0	0	0	113.3	C401 K405	C401-D403 VanDerWaalsContact C-N 3.31Å; C401-D403 PolarHBondContact O-N 3.02Å; D403-K405 HydrophobicContact CB-CB 4.44Å; D403-K405 HydrophobicContact CB-CG 4.44Å; D403-K405 PolarHBondContact O-N 3.49Å
404	G	76.1	Confident	81.2	Confident	53 Å²	53	59.1 Å²	59.1	55%	0.546	34%	0.34	S	S	.	.			trans	64.3	3.6	-175	0	0	0	0	0	114	C401 Q402	C401-G404 PolarHBondContact O-N 3.07Å; Q402-G404 PolarHBondContact O-N 3.12Å; Q402-G404 VanDerWaalsContact O-N 3.1Å
405	K	81	Confident	81.2	Confident	145 Å²	145	61.9 Å²	61.9	63%	0.63	36%	0.355	S	S	*	.			trans	-87.9	128.9	178.6	-69.3	178	-177.3	173.6	0	109.5	D403 L407	D403-K405 HydrophobicContact CB-CB 4.44Å; D403-K405 HydrophobicContact CB-CG 4.44Å; D403-K405 PolarHBondContact O-N 3.49Å; K405-L407 PolarHBondContact O-N 3.44Å
406	P	81.9	Confident	81.1	Confident	83 Å²	83	60.8 Å²	60.8	54%	0.539	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	133.2	173.7	28.5	-32.5	0	0	0	109.6	T398 P408	T398-P406 HydrophobicContact CG2-CB 3.7Å; P406-P408 WeakPolarHBondContact O-CD 3.47Å
407	L	77.4	Confident	81.2	Confident	67 Å²	67	65 Å²	65	35%	0.351	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	93.1	177.4	-61.4	174.7	0	0	0	108.5	T398 A399 K405 F410	T398-L407 WeakPolarHBondContact CA-O 3.01Å; A399-L407 PolarHBondContact N-O 3.3Å; A399-L407 VanDerWaalsContact N-O 3.08Å; A399-L407 WeakPolarHBondContact O-CB 3.25Å; A399-L407 PolarHBondContact O-N 2.9Å; K405-L407 PolarHBondContact O-N 3.44Å; L407-F410 HydrophobicContact CB-CB 3.99Å; L407-F410 HydrophobicContact CB-CD2 3.7Å; L407-F410 HydrophobicContact CB-CE2 4.44Å; L407-F410 HydrophobicContact CB-CG 3.96Å; L407-F410 PolarHBondContact O-N 3.48Å
408	P	76.5	Confident	80.8	Confident	88 Å²	88	67.5 Å²	67.5	57%	0.571	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.8	-178.9	-18.4	31.6	0	0	0	111.4	P406 F410	P406-P408 WeakPolarHBondContact O-CD 3.47Å; P408-F410 VanDerWaalsContact C-N 3.26Å; P408-F410 WeakPolarHBondContact O-CD2 3.16Å; P408-F410 PolarHBondContact O-N 2.98Å
409	G	71.3	Confident	80.7	Confident	52 Å²	52	66.3 Å²	66.3	54%	0.536	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-6.1	-178.2	0	0	0	0	0	114.4	F397	F397-G409 VanDerWaalsContact O-CA 3.3Å; F397-G409 WeakPolarHBondContact O-CA 3.47Å; F397-G409 PolarHBondContact O-N 3.02Å
410	F	73.2	Confident	80.7	Confident	40 Å²	40	69 Å²	69	18%	0.175	38%	0.382	C	S	.	.			trans	-92.8	136.6	178.3	-71.4	-101.7	0	0	0	111.5	F397 A399 L407 P408 K412	F397-F410 WeakPolarHBondContact CB-O 3.33Å; A399-F410 HydrophobicContact CB-CB 3.85Å; A399-F410 WeakPolarHBondContact CB-O 3.41Å; A399-F410 PolarHBondContact N-O 3.33Å; L407-F410 HydrophobicContact CB-CB 3.99Å; L407-F410 HydrophobicContact CB-CD2 3.7Å; L407-F410 HydrophobicContact CB-CE2 4.44Å; L407-F410 HydrophobicContact CB-CG 3.96Å; L407-F410 PolarHBondContact O-N 3.48Å; P408-F410 VanDerWaalsContact C-N 3.26Å; P408-F410 WeakPolarHBondContact O-CD2 3.16Å; P408-F410 PolarHBondContact O-N 2.98Å; F410-K412 HydrophobicContact CD1-CG 4.49Å
411	R	83.3	Confident	80.6	Confident	118 Å²	118	70.7 Å²	70.7	45%	0.445	39%	0.392	S	S	.	.			trans	-119.1	11.4	170.6	70.3	179.1	-170.9	-162.9	-2.1	113	E383 L384 F397	E383-R411 WeakPolarHBondContact CA-O 3.49Å; E383-R411 IonicContact OE1-CZ 3.69Å; E383-R411 IonicContact OE1-NE 2.98Å; E383-R411 PolarHBondContact OE1-NE 3.34Å; E383-R411 IonicContact OE1-NH2 3.94Å; L384-R411 HydrophobicContact CB-CB 4.48Å; L384-R411 PolarHBondContact N-O 3.32Å; L384-R411 WeakPolarHBondContact O-CD 3.1Å; F397-R411 HydrophobicContact CB-CB 4.1Å; F397-R411 HydrophobicContact CD1-CB 4.37Å; F397-R411 HydrophobicContact CG-CB 4.07Å
412	K	84.3	Confident	80.9	Confident	85 Å²	85	69.5 Å²	69.5	37%	0.37	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.9	-178.1	69.6	-179.2	-177.6	-176.5	0	110.7	V382 E383 F410 D597	V382-K412 CarbonylContact O-C 3.49Å; V382-K412 WeakPolarHBondContact O-CA 3.41Å; E383-K412 HydrophobicContact CB-CB 4.18Å; E383-K412 HydrophobicContact CG-CB 4.22Å; F410-K412 HydrophobicContact CD1-CG 4.49Å; K412-D597 IonicContact NZ-OD1 3.28Å; K412-D597 PolarHBondContact NZ-OD1 2.99Å
413	C	84.8	Confident	81.6	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.007	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.4	164.3	-72.7	0	0	0	0	108.6	K381 V382 C401 L416 V422	K381-C413 VanDerWaalsContact CA-O 3.31Å; K381-C413 WeakPolarHBondContact CA-O 3.38Å; V382-C413 PolarHBondContact N-O 3.47Å; V382-C413 PolarHBondContact O-N 3.13Å; C401-C413 HydrophobicContact CB-CB 3.85Å; C401-C413 WeakPolarHBondContact CB-SG 3.33Å; C401-C413 WeakPolarHBondContact SG-CA 3.43Å; C401-C413 WeakPolarHBondContact SG-CB 3.46Å; C401-C413 CovalentContact SG-SG 2.04Å; C401-C413 PolarHBondContact SG-SG 3.01Å; C413-L416 HydrophobicContact CB-CD1 4.02Å; C413-L416 HydrophobicContact CB-CD2 4.22Å; C413-L416 HydrophobicContact CB-CG 4.35Å; C413-V422 HydrophobicContact CB-CB 4.46Å; C413-V422 HydrophobicContact CB-CG1 3.95Å
414	A	83.4	Confident	82.7	Confident	52 Å²	52	60.9 Å²	60.9	43%	0.43	34%	0.343	S	S	.	.			trans	-126.2	170.8	-179.1	0	0	0	0	0	111	S380 K381 L416	S380-A414 CarbonylContact O-C 3.49Å; S380-A414 VanDerWaalsContact O-C 3.3Å; S380-A414 WeakPolarHBondContact O-CA 3.43Å; K381-A414 HydrophobicContact CG-CB 4.18Å; A414-L416 PolarHBondContact O-N 3.44Å
415	D	81.5	Confident	83.5	Confident	94 Å²	94	61.4 Å²	61.4	50%	0.503	33%	0.333	S	S	.	.	S	Bend	trans	58	29.6	-178.7	-62.4	-28.2	0	0	0	113.5	S380 Q402 K663	S380-D415 PolarHBondContact O-N 2.96Å; Q402-D415 PolarHBondContact NE2-O 2.91Å; D415-K663 IonicContact OD1-NZ 3.51Å; D415-K663 IonicContact OD2-NZ 2.67Å; D415-K663 PolarHBondContact OD2-NZ 2.79Å
416	L	83.4	Confident	84.1	Confident	13 Å²	13	54.5 Å²	54.5	7%	0.068	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-71.8	141.7	178.7	-60.7	176.3	0	0	0	112.4	S380 V382 Q402 C413 A414 E420 V422	S380-L416 WeakPolarHBondContact CA-O 3.34Å; S380-L416 WeakPolarHBondContact O-CB 3.43Å; S380-L416 PolarHBondContact O-N 3.46Å; V382-L416 HydrophobicContact CB-CD1 3.9Å; V382-L416 HydrophobicContact CG2-CD1 3.58Å; Q402-L416 HydrophobicContact CG-CD2 4.14Å; C413-L416 HydrophobicContact CB-CD1 4.02Å; C413-L416 HydrophobicContact CB-CD2 4.22Å; C413-L416 HydrophobicContact CB-CG 4.35Å; A414-L416 PolarHBondContact O-N 3.44Å; L416-E420 WeakPolarHBondContact CA-OE2 3.33Å; L416-V422 HydrophobicContact CD1-CG1 3.93Å; L416-V422 HydrophobicContact CD2-CG1 3.53Å; L416-V422 HydrophobicContact CG-CG1 4.4Å
417	K	82.9	Confident	84.4	Confident	146 Å²	146	51.4 Å²	51.4	64%	0.635	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-92.7	152.7	169.4	-60.3	177.5	-177.6	171.8	0	110.2	G419 E420	K417-G419 PolarHBondContact O-N 3.48Å; K417-E420 HydrophobicContact CB-CG 4.09Å; K417-E420 PolarHBondContact N-OE2 3.46Å; K417-E420 WeakPolarHBondContact O-CB 3.4Å; K417-E420 WeakPolarHBondContact O-CG 3.3Å; K417-E420 PolarHBondContact O-N 3.44Å
418	I	77.9	Confident	85.1	Confident	76 Å²	76	48.2 Å²	48.2	39%	0.39	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	131.6	175.4	-64.9	174.6	0	0	0	109.4	E134 R379	E134-I418 HydrophobicContact CB-CG2 4.43Å; E134-I418 HydrophobicContact CG-CG2 3.93Å; R379-I418 VanDerWaalsContact NH2-CG2 3.34Å
419	G	79.9	Confident	85.6	Confident	11 Å²	11	46.2 Å²	46.2	11%	0.113	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-10.4	-180	0	0	0	0	0	114.9	R131 Q132 K417	R131-G419 PolarHBondContact NE-O 2.94Å; R131-G419 PolarHBondContact NH2-O 3.11Å; Q132-G419 WeakPolarHBondContact O-CA 3.19Å; Q132-G419 PolarHBondContact O-N 3.2Å; K417-G419 PolarHBondContact O-N 3.48Å
420	E	85.8	Confident	86.3	Confident	58 Å²	58	43.7 Å²	43.7	27%	0.271	22%	0.224	S	C	.	.			trans	-75.6	150.8	179.2	-68	-179.4	164.7	0	0	113.1	Q132 Q402 L416 K417	Q132-E420 PolarHBondContact N-O 2.82Å; Q402-E420 PolarHBondContact NE2-OE1 2.87Å; Q402-E420 PolarHBondContact NE2-OE2 2.82Å; L416-E420 WeakPolarHBondContact CA-OE2 3.33Å; K417-E420 HydrophobicContact CB-CG 4.09Å; K417-E420 PolarHBondContact N-OE2 3.46Å; K417-E420 WeakPolarHBondContact O-CB 3.4Å; K417-E420 WeakPolarHBondContact O-CG 3.3Å; K417-E420 PolarHBondContact O-N 3.44Å
421	T	90	Very high	86.4	Confident	61 Å²	61	46.3 Å²	46.3	37%	0.374	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.8	176.6	-54.4	0	0	0	0	108.9	L94 Q129 V130 R131	L94-T421 HydrophobicContact CD1-CG2 3.81Å; Q129-T421 HydrophobicContact CB-CG2 4.17Å; V130-T421 WeakPolarHBondContact O-CA 3.42Å; R131-T421 HydrophobicContact CB-CG2 4.32Å; R131-T421 WeakPolarHBondContact CD-OG1 3.47Å; R131-T421 WeakPolarHBondContact CG-OG1 3.32Å
422	V	92.9	Very high	86	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	152.9	173.2	-64.4	0	0	0	0	109.8	Q129 V130 V382 C413 L416 F424	Q129-V422 WeakPolarHBondContact CA-O 3.45Å; V130-V422 HydrophobicContact CB-CG2 4.16Å; V130-V422 PolarHBondContact N-O 3.15Å; V130-V422 PolarHBondContact O-N 3.2Å; V382-V422 HydrophobicContact CB-CG2 4.17Å; V382-V422 HydrophobicContact CG1-CG2 4.05Å; V382-V422 HydrophobicContact CG2-CG2 4.44Å; C413-V422 HydrophobicContact CB-CB 4.46Å; C413-V422 HydrophobicContact CB-CG1 3.95Å; L416-V422 HydrophobicContact CD1-CG1 3.93Å; L416-V422 HydrophobicContact CD2-CG1 3.53Å; L416-V422 HydrophobicContact CG-CG1 4.4Å; V422-F424 HydrophobicContact CB-CE2 4.45Å; V422-F424 HydrophobicContact CG2-CD2 4.49Å; V422-F424 HydrophobicContact CG2-CE2 3.61Å; V422-F424 HydrophobicContact CG2-CZ 4.1Å
423	S	94.4	Very high	85.8	Confident	30 Å²	30	40.4 Å²	40.4	21%	0.21	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	146.6	176.9	63.2	0	0	0	0	112	L128 T400	L128-S423 CarbonylContact O-C 2.84Å; L128-S423 VanDerWaalsContact O-CA 3.27Å; L128-S423 WeakPolarHBondContact O-CA 3.39Å; T400-S423 WeakPolarHBondContact CB-OG 3.26Å; T400-S423 PolarHBondContact N-O 2.94Å; T400-S423 PolarHBondContact O-N 2.91Å; T400-S423 VanDerWaalsContact O-N 3.12Å
424	F	93.9	Very high	85.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	121	177	-61.2	-88.3	0	0	0	108.7	L128 V130 V382 L384 T398 A399 V422	L128-F424 HydrophobicContact CB-CB 4.41Å; L128-F424 PolarHBondContact N-O 3.1Å; L128-F424 PolarHBondContact O-N 2.83Å; V130-F424 HydrophobicContact CG2-CD2 4.24Å; V130-F424 HydrophobicContact CG2-CE2 4.12Å; V382-F424 HydrophobicContact CG1-CE2 3.96Å; V382-F424 HydrophobicContact CG1-CZ 4.13Å; L384-F424 HydrophobicContact CD1-CB 3.75Å; L384-F424 HydrophobicContact CD1-CD1 3.87Å; L384-F424 HydrophobicContact CD1-CD2 3.65Å; L384-F424 HydrophobicContact CD1-CE1 4.37Å; L384-F424 HydrophobicContact CD1-CE2 4.16Å; L384-F424 HydrophobicContact CD1-CG 3.48Å; L384-F424 VanDerWaalsContact CD1-CG 3.48Å; L384-F424 HydrophobicContact CD1-CZ 4.49Å; L384-F424 HydrophobicContact CD2-CD2 4.39Å; L384-F424 HydrophobicContact CD2-CE2 4.32Å; L384-F424 HydrophobicContact CG-CD1 4.41Å; L384-F424 HydrophobicContact CG-CD2 4.08Å; L384-F424 HydrophobicContact CG-CE1 4.43Å; L384-F424 HydrophobicContact CG-CE2 4.07Å; L384-F424 HydrophobicContact CG-CG 4.24Å; L384-F424 HydrophobicContact CG-CZ 4.25Å; T398-F424 CarbonylContact O-C 2.81Å; T398-F424 WeakPolarHBondContact O-CA 3.45Å; A399-F424 HydrophobicContact CB-CD1 3.69Å; A399-F424 HydrophobicContact CB-CE1 3.57Å; V422-F424 HydrophobicContact CB-CE2 4.45Å; V422-F424 HydrophobicContact CG2-CD2 4.49Å; V422-F424 HydrophobicContact CG2-CE2 3.61Å; V422-F424 HydrophobicContact CG2-CZ 4.1Å
425	D	93.5	Very high	85.1	Confident	65 Å²	65	43.7 Å²	43.7	35%	0.348	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	118.3	170.5	-63.9	-35.8	0	0	0	108.4	S127 T398	S127-D425 WeakPolarHBondContact CB-OD1 3.15Å; S127-D425 PolarHBondContact OG-OD1 3.33Å; T398-D425 PolarHBondContact N-O 2.93Å; T398-D425 PolarHBondContact O-N 2.98Å
426	V	92.9	Very high	84.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	115.7	-178.1	-172.1	0	0	0	0	107.6	A125 F126 L395 S396 F397 V428 I444	A125-V426 CarbonylContact C-O 3.47Å; A125-V426 VanDerWaalsContact CA-O 3.23Å; A125-V426 WeakPolarHBondContact CA-O 3.06Å; F126-V426 HydrophobicContact CD2-CB 4.22Å; F126-V426 HydrophobicContact CD2-CG2 4.48Å; F126-V426 HydrophobicContact CE1-CB 4.1Å; F126-V426 HydrophobicContact CE1-CG1 4.14Å; F126-V426 HydrophobicContact CE2-CB 3.72Å; F126-V426 HydrophobicContact CE2-CG1 4.32Å; F126-V426 HydrophobicContact CE2-CG2 3.83Å; F126-V426 HydrophobicContact CZ-CB 3.66Å; F126-V426 HydrophobicContact CZ-CG1 3.78Å; F126-V426 HydrophobicContact CZ-CG2 4.14Å; F126-V426 PolarHBondContact N-O 3.22Å; F126-V426 PolarHBondContact O-N 2.94Å; L395-V426 HydrophobicContact CD2-CG1 4.2Å; S396-V426 WeakPolarHBondContact O-CA 3.26Å; F397-V426 HydrophobicContact CD1-CG1 4.28Å; F397-V426 HydrophobicContact CD1-CG2 3.82Å; F397-V426 HydrophobicContact CE1-CB 4.45Å; F397-V426 HydrophobicContact CE1-CG1 3.89Å; F397-V426 HydrophobicContact CE1-CG2 3.79Å; F397-V426 HydrophobicContact CZ-CG1 4.27Å; V426-V428 HydrophobicContact CG1-CG2 4.25Å; V426-I444 HydrophobicContact CG1-CD1 4.12Å; V426-I444 HydrophobicContact CG2-CD1 4.22Å
427	S	89.9	Confident	83.3	Confident	17 Å²	17	52.4 Å²	52.4	12%	0.119	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.8	172.3	-175.1	0	0	0	0	110.9	Q123 T124 L395 S396	Q123-S427 VanDerWaalsContact CD-OG 3.31Å; Q123-S427 WeakPolarHBondContact CG-OG 3.28Å; Q123-S427 PolarHBondContact NE2-OG 3.32Å; T124-S427 CarbonylContact O-C 3.49Å; T124-S427 VanDerWaalsContact O-CA 3.26Å; T124-S427 WeakPolarHBondContact O-CA 3.22Å; T124-S427 PolarHBondContact O-OG 2.94Å; L395-S427 CarbonylContact C-O 3.59Å; L395-S427 WeakPolarHBondContact CA-O 3.39Å; S396-S427 PolarHBondContact N-O 3.37Å; S396-S427 PolarHBondContact O-N 3.31Å; S396-S427 WeakPolarHBondContact OG-CB 3.33Å
428	V	91.1	Very high	82.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.5	-172.5	-168.7	0	0	0	0	109.6	L116 L118 T124 F126 I393 N394 L395 V426	L116-V428 HydrophobicContact CD1-CB 4.15Å; L116-V428 HydrophobicContact CD1-CG1 3.89Å; L116-V428 HydrophobicContact CD1-CG2 3.96Å; L118-V428 HydrophobicContact CD1-CG1 3.73Å; L118-V428 HydrophobicContact CD2-CG1 4.49Å; T124-V428 HydrophobicContact CG2-CB 4.42Å; T124-V428 PolarHBondContact N-O 2.99Å; T124-V428 PolarHBondContact O-N 2.86Å; F126-V428 HydrophobicContact CD1-CG2 4.13Å; F126-V428 HydrophobicContact CE1-CG2 3.54Å; F126-V428 HydrophobicContact CZ-CG2 4.49Å; I393-V428 HydrophobicContact CG2-CG1 3.58Å; N394-V428 WeakPolarHBondContact O-CA 3.43Å; L395-V428 HydrophobicContact CD2-CB 4.11Å; L395-V428 HydrophobicContact CD2-CG1 3.86Å; L395-V428 HydrophobicContact CD2-CG2 3.56Å; V426-V428 HydrophobicContact CG1-CG2 4.25Å
429	E	87.5	Confident	81.7	Confident	46 Å²	46	52.1 Å²	52.1	22%	0.215	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	132.9	176.3	-177.3	-170.7	172.7	0	0	109.2	Q123 N394	Q123-E429 HydrophobicContact CB-CB 4.47Å; N394-E429 HydrophobicContact CB-CB 4.29Å; N394-E429 PolarHBondContact N-O 2.98Å; N394-E429 PolarHBondContact O-N 2.88Å
430	A	85.8	Confident	81.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.2	171.2	0	0	0	0	0	109.7	L118 P120 G121 D392 Y459	L118-A430 HydrophobicContact CB-CB 3.87Å; L118-A430 HydrophobicContact CD1-CB 4.09Å; P120-A430 CarbonylContact C-O 3.07Å; P120-A430 VanDerWaalsContact CA-O 3.31Å; P120-A430 WeakPolarHBondContact CA-O 3.32Å; G121-A430 PolarHBondContact N-O 3.13Å; D392-A430 CarbonylContact O-C 3.47Å; A430-Y459 HydrophobicContact CB-CD1 3.88Å; A430-Y459 HydrophobicContact CB-CE1 3.74Å
431	R	74.7	Confident	82	Confident	94 Å²	94	55.1 Å²	55.1	36%	0.355	31%	0.313	S	S	.	.			trans	-78.6	-39	177.9	-62.4	-178.4	179	-172.5	-1.3	112.1	D392 N394 A578	D392-R431 PolarHBondContact O-N 3.12Å; N394-R431 VanDerWaalsContact CG-NE 3.3Å; N394-R431 PolarHBondContact ND2-NE 3.2Å; N394-R431 PolarHBondContact OD1-NE 2.66Å; N394-R431 PolarHBondContact OD1-NH2 3.05Å; R431-A578 HydrophobicContact CG-CB 4.48Å
432	S	76.1	Confident	82.1	Confident	39 Å²	39	52.2 Å²	52.2	27%	0.273	30%	0.295	S	S	.	.	S	Bend	trans	-147.2	-178.6	-170.2	91.1	0	0	0	0	111.2	D392	D392-S432 VanDerWaalsContact CG-OG 3.29Å; D392-S432 PolarHBondContact OD1-OG 2.78Å
433	C	79.9	Confident	82	Confident	40 Å²	40	52.8 Å²	52.8	27%	0.27	30%	0.299	S	S	.	.			trans	-107.7	106.2	174.1	-82.5	0	0	0	0	110.2	P120 C461	P120-C433 WeakPolarHBondContact CG-SG 3.01Å; C433-C461 VanDerWaalsContact CA-SG 3.52Å; C433-C461 HydrophobicContact CB-CB 3.75Å; C433-C461 WeakPolarHBondContact CB-SG 3.43Å; C433-C461 VanDerWaalsContact SG-CA 3.57Å; C433-C461 WeakPolarHBondContact SG-CB 3.41Å; C433-C461 CovalentContact SG-SG 2Å; C433-C461 PolarHBondContact SG-SG 2.91Å
434	P	80.3	Confident	82	Confident	20 Å²	20	51.4 Å²	51.4	13%	0.13	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-69.6	162.4	178	26.8	-32.1	0	0	0	112	Y459	P434-Y459 HydrophobicContact CG-CD1 4.2Å; P434-Y459 HydrophobicContact CG-CD2 3.43Å; P434-Y459 VanDerWaalsContact CG-CD2 3.43Å; P434-Y459 HydrophobicContact CG-CE1 4.17Å; P434-Y459 HydrophobicContact CG-CE2 3.4Å; P434-Y459 VanDerWaalsContact CG-CE2 3.4Å; P434-Y459 HydrophobicContact CG-CG 3.84Å
435	P	72.6	Confident	81.7	Confident	102 Å²	102	53.2 Å²	53.2	66%	0.662	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-57.7	145.1	179.5	-22.7	32.6	0	0	0	113.1	G437 T438	P435-G437 PolarHBondContact O-N 2.97Å; P435-T438 PolarHBondContact O-N 2.94Å; P435-T438 PolarHBondContact O-OG1 3.05Å
436	R	65	Low	81.5	Confident	209 Å²	209	50.1 Å²	50.1	79%	0.789	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	134.8	-178.2	-69.9	-174.9	174.3	166.2	2.5	112.1	D462	R436-D462 IonicContact CZ-OD1 2.82Å; R436-D462 IonicContact CZ-OD2 3.19Å; R436-D462 IonicContact NE-OD1 3.09Å; R436-D462 IonicContact NE-OD2 3.8Å; R436-D462 PolarHBondContact NE-OD2 3.09Å; R436-D462 VanDerWaalsContact NH2-CG 3.32Å; R436-D462 IonicContact NH2-OD1 3.94Å; R436-D462 PolarHBondContact NH2-OD1 2.95Å; R436-D462 IonicContact NH2-OD2 3.49Å; R436-D462 PolarHBondContact NH2-OD2 3.15Å
437	G	61.7	Low	80.9	Confident	82 Å²	82	52.5 Å²	52.5	85%	0.845	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.8	7	178	0	0	0	0	0	115.1	P435 D439	P435-G437 PolarHBondContact O-N 2.97Å; G437-D439 PolarHBondContact O-N 3.21Å
438	T	63.8	Low	80.2	Confident	59 Å²	59	52.2 Å²	52.2	36%	0.362	30%	0.295	S	S	.	.			trans	-91.4	88.2	173.6	48.4	0	0	0	0	110.5	P435 Q440	P435-T438 PolarHBondContact O-N 2.94Å; P435-T438 PolarHBondContact O-OG1 3.05Å; T438-Q440 PolarHBondContact O-N 2.87Å; T438-Q440 VanDerWaalsContact O-N 3.15Å
439	D	63	Low	79.7	Confident	156 Å²	156	52.6 Å²	52.6	83%	0.834	30%	0.296	S	S	*	.			trans	-69.3	109.1	164.4	-79.5	-17.2	0	0	0	107.8	G437	G437-D439 PolarHBondContact O-N 3.21Å
440	Q	81.8	Confident	79.3	Confident	40 Å²	40	54 Å²	54	19%	0.187	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.8	-179.7	-68	-172.7	-9.2	0	0	109.6	P390 T438 V457 Y459	P390-Q440 HydrophobicContact CG-CB 3.99Å; P390-Q440 HydrophobicContact CG-CG 4.48Å; T438-Q440 PolarHBondContact O-N 2.87Å; T438-Q440 VanDerWaalsContact O-N 3.15Å; Q440-V457 PolarHBondContact O-N 3.22Å; Q440-Y459 HydrophobicContact CB-CE2 4.4Å; Q440-Y459 HydrophobicContact CG-CE2 4.45Å; Q440-Y459 PolarHBondContact OE1-OH 3.47Å
441	T	90.3	Very high	79.4	Confident	92 Å²	92	55.3 Å²	55.3	56%	0.564	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.2	173.4	55.5	0	0	0	0	108.9	V455 A456	T441-V455 VanDerWaalsContact CA-O 3.3Å; T441-V455 WeakPolarHBondContact CA-O 3.22Å; T441-A456 HydrophobicContact CG2-CB 4.3Å
442	F	92.3	Very high	80.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	160.9	170.8	71.9	-91.4	0	0	0	110.4	V386 D388 I393 L395 I444 V455 V457	V386-F442 HydrophobicContact CG1-CD2 3.85Å; V386-F442 HydrophobicContact CG1-CE2 4.43Å; D388-F442 VanDerWaalsContact O-CB 3.27Å; D388-F442 WeakPolarHBondContact O-CB 3.46Å; I393-F442 HydrophobicContact CD1-CD1 4.27Å; I393-F442 HydrophobicContact CD1-CE1 4.05Å; L395-F442 HydrophobicContact CD1-CD2 4.42Å; L395-F442 HydrophobicContact CD1-CE2 3.82Å; L395-F442 HydrophobicContact CD1-CZ 4.25Å; L395-F442 HydrophobicContact CD2-CE2 4.27Å; L395-F442 HydrophobicContact CD2-CZ 3.92Å; F442-I444 HydrophobicContact CD2-CG1 4.21Å; F442-I444 HydrophobicContact CE2-CD1 3.99Å; F442-I444 HydrophobicContact CE2-CG1 3.85Å; F442-V455 HydrophobicContact CD1-CB 3.99Å; F442-V455 HydrophobicContact CD1-CG1 4.13Å; F442-V455 HydrophobicContact CD2-CB 4.18Å; F442-V455 HydrophobicContact CD2-CG2 4.3Å; F442-V455 HydrophobicContact CE1-CB 3.69Å; F442-V455 HydrophobicContact CE1-CG1 3.4Å; F442-V455 HydrophobicContact CE1-CG2 4.44Å; F442-V455 HydrophobicContact CE2-CB 3.89Å; F442-V455 HydrophobicContact CE2-CG1 4.21Å; F442-V455 HydrophobicContact CE2-CG2 3.8Å; F442-V455 HydrophobicContact CG-CB 4.24Å; F442-V455 HydrophobicContact CZ-CB 3.63Å; F442-V455 HydrophobicContact CZ-CG1 3.45Å; F442-V455 VanDerWaalsContact CZ-CG1 3.45Å; F442-V455 HydrophobicContact CZ-CG2 3.89Å; F442-V455 PolarHBondContact N-O 2.8Å; F442-V455 PolarHBondContact O-N 3.26Å; F442-V457 HydrophobicContact CD1-CG2 3.88Å; F442-V457 HydrophobicContact CE1-CG2 3.6Å
443	T	92.4	Very high	81.1	Confident	18 Å²	18	54.7 Å²	54.7	11%	0.11	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.3	-173.9	-56.4	0	0	0	0	110.4	V386 S387 R452 L453	V386-T443 CarbonylContact C-O 3.57Å; V386-T443 WeakPolarHBondContact CA-O 2.98Å; S387-T443 PolarHBondContact N-O 3.24Å; S387-T443 PolarHBondContact O-N 2.87Å; T443-R452 HydrophobicContact CG2-CB 3.59Å; T443-R452 HydrophobicContact CG2-CG 3.95Å; T443-L453 WeakPolarHBondContact CA-O 3.33Å
444	I	92.9	Very high	81.9	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.6	167.7	-55.6	-179.6	0	0	0	108	F126 L128 L384 T385 V386 F397 V426 F442 L453	F126-I444 HydrophobicContact CE2-CD1 4.2Å; F126-I444 HydrophobicContact CZ-CD1 3.8Å; L128-I444 HydrophobicContact CD2-CG2 4.11Å; L384-I444 HydrophobicContact CB-CG2 4.3Å; L384-I444 HydrophobicContact CD1-CG2 4.13Å; L384-I444 HydrophobicContact CD2-CG2 4.32Å; T385-I444 WeakPolarHBondContact O-CA 3.14Å; V386-I444 HydrophobicContact CG2-CG1 4.45Å; F397-I444 HydrophobicContact CE1-CD1 4.41Å; V426-I444 HydrophobicContact CG1-CD1 4.12Å; V426-I444 HydrophobicContact CG2-CD1 4.22Å; F442-I444 HydrophobicContact CD2-CG1 4.21Å; F442-I444 HydrophobicContact CE2-CD1 3.99Å; F442-I444 HydrophobicContact CE2-CG1 3.85Å; I444-L453 HydrophobicContact CB-CB 4.39Å; I444-L453 PolarHBondContact N-O 3.25Å; I444-L453 PolarHBondContact O-N 2.82Å
445	K	89.1	Confident	82.6	Confident	38 Å²	38	56 Å²	56	17%	0.165	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	139.7	179.5	70.7	175.5	-175.7	164.8	0	112	T385 R452	T385-K445 PolarHBondContact N-O 2.9Å; T385-K445 PolarHBondContact O-N 2.76Å; T385-K445 WeakPolarHBondContact OG1-CG 3.35Å; T385-K445 PolarHBondContact OG1-O 2.87Å; K445-R452 HydrophobicContact CB-CB 4.13Å
446	P	88.1	Confident	83.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	142.8	166	-15.8	29.4	0	0	0	110.9	I109 V130 V382 E383 L384 G448 F449	I109-P446 HydrophobicContact CD1-CG 4.19Å; V130-P446 HydrophobicContact CB-CG 4.49Å; V130-P446 HydrophobicContact CG1-CB 4.21Å; V130-P446 HydrophobicContact CG1-CG 3.72Å; V130-P446 HydrophobicContact CG2-CG 3.87Å; V382-P446 HydrophobicContact CG1-CB 4.44Å; E383-P446 CarbonylContact O-C 3.53Å; E383-P446 VanDerWaalsContact O-CA 3.28Å; E383-P446 WeakPolarHBondContact O-CA 3.44Å; L384-P446 HydrophobicContact CD2-CB 4.31Å; L384-P446 HydrophobicContact CD2-CG 3.99Å; P446-G448 PolarHBondContact O-N 3.11Å; P446-F449 HydrophobicContact CB-CB 4Å; P446-F449 HydrophobicContact CB-CD1 4.41Å; P446-F449 HydrophobicContact CB-CD2 3.76Å; P446-F449 HydrophobicContact CB-CE2 4.37Å; P446-F449 HydrophobicContact CB-CG 3.81Å; P446-F449 HydrophobicContact CG-CB 4.25Å; P446-F449 HydrophobicContact CG-CG 4.24Å; P446-F449 PolarHBondContact O-N 2.71Å
447	V	81	Confident	84.9	Confident	51 Å²	51	42.8 Å²	42.8	31%	0.309	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	122.3	179.2	177.1	0	0	0	0	110.4	F332 E383 T385 F449	F332-V447 HydrophobicContact CE1-CG1 4.26Å; F332-V447 HydrophobicContact CZ-CG1 4.49Å; E383-V447 HydrophobicContact CB-CG2 4.19Å; E383-V447 HydrophobicContact CG-CG2 4.38Å; E383-V447 PolarHBondContact O-N 2.99Å; T385-V447 HydrophobicContact CG2-CG2 3.5Å; V447-F449 VanDerWaalsContact C-N 3.32Å; V447-F449 WeakPolarHBondContact O-CD2 3.48Å
448	G	74.9	Confident	86.2	Confident	11 Å²	11	43.4 Å²	43.4	11%	0.113	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	11.7	177.6	0	0	0	0	0	115.8	P446	P446-G448 PolarHBondContact O-N 3.11Å
449	F	79.7	Confident	87.3	Confident	7 Å²	7	41.8 Å²	41.8	3%	0.031	22%	0.215	C	C	.	.			trans	-98.9	145.6	171.9	-73.9	-124.3	0	0	0	109.2	Q108 V130 Q132 Y270 P446 V447	Q108-F449 HydrophobicContact CB-CD1 3.7Å; Q108-F449 HydrophobicContact CB-CE1 3.9Å; Q108-F449 HydrophobicContact CG-CD1 4.24Å; Q108-F449 HydrophobicContact CG-CE1 4.37Å; V130-F449 HydrophobicContact CG1-CE1 4.28Å; Q132-F449 HydrophobicContact CG-CZ 4.17Å; Y270-F449 HydrophobicContact CE1-CE2 4.43Å; Y270-F449 WeakPolarHBondContact OH-CZ 3Å; P446-F449 HydrophobicContact CB-CB 4Å; P446-F449 HydrophobicContact CB-CD1 4.41Å; P446-F449 HydrophobicContact CB-CD2 3.76Å; P446-F449 HydrophobicContact CB-CE2 4.37Å; P446-F449 HydrophobicContact CB-CG 3.81Å; P446-F449 HydrophobicContact CG-CB 4.25Å; P446-F449 HydrophobicContact CG-CG 4.24Å; P446-F449 PolarHBondContact O-N 2.71Å; V447-F449 VanDerWaalsContact C-N 3.32Å; V447-F449 WeakPolarHBondContact O-CD2 3.48Å
450	K	81.1	Confident	88.5	Confident	76 Å²	76	37 Å²	37	33%	0.33	19%	0.188	S	C	.	.	S	Bend	trans	-69.8	-44.2	170.9	177.1	-161.2	171.6	-162.7	0	110.9	K267 E268	K267-K450 WeakPolarHBondContact O-CD 3.41Å; E268-K450 HydrophobicContact CG-CD 3.57Å; E268-K450 IonicContact OE1-NZ 2.76Å; E268-K450 PolarHBondContact OE1-NZ 2.84Å
451	D	87	Confident	88.5	Confident	27 Å²	27	36.3 Å²	36.3	14%	0.144	19%	0.187	C	C	.	.			trans	-68.3	142.4	-173.2	-69.1	-4.6	0	0	0	111.6	V107 Q108 I109	V107-D451 WeakPolarHBondContact CA-OD2 3.36Å; Q108-D451 PolarHBondContact N-OD2 3.31Å; I109-D451 HydrophobicContact CB-CB 4.16Å; I109-D451 HydrophobicContact CG2-CB 3.6Å
452	R	91.5	Very high	88.3	Confident	120 Å²	120	35.8 Å²	35.8	45%	0.453	18%	0.181	S	C	.	.			trans	-142.4	155.9	-173.7	68.6	-169.8	67.2	-167.9	3.1	110.7	T443 K445 E454	T443-R452 HydrophobicContact CG2-CB 3.59Å; T443-R452 HydrophobicContact CG2-CG 3.95Å; K445-R452 HydrophobicContact CB-CB 4.13Å; R452-E454 HydrophobicContact CG-CG 4.41Å
453	L	95.5	Very high	88	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.7	166.3	168.8	60.7	0	0	0	108.6	I109 P111 Q112 I114 F126 L128 T443 I444 V455	I109-L453 HydrophobicContact CD1-CB 4.14Å; P111-L453 HydrophobicContact CG-CD1 4.22Å; P111-L453 WeakPolarHBondContact O-CD1 3.39Å; Q112-L453 WeakPolarHBondContact O-CA 3.47Å; I114-L453 HydrophobicContact CD1-CD1 4.45Å; I114-L453 HydrophobicContact CD1-CD2 4.2Å; I114-L453 HydrophobicContact CG1-CD1 4.08Å; I114-L453 HydrophobicContact CG2-CD1 4.06Å; F126-L453 HydrophobicContact CD2-CD2 4.16Å; F126-L453 HydrophobicContact CE2-CD2 3.41Å; F126-L453 VanDerWaalsContact CE2-CD2 3.41Å; F126-L453 HydrophobicContact CZ-CD2 4.03Å; L128-L453 HydrophobicContact CD1-CB 4.01Å; L128-L453 HydrophobicContact CD1-CD2 3.74Å; L128-L453 HydrophobicContact CD1-CG 4.45Å; T443-L453 WeakPolarHBondContact CA-O 3.33Å; I444-L453 HydrophobicContact CB-CB 4.39Å; I444-L453 PolarHBondContact N-O 3.25Å; I444-L453 PolarHBondContact O-N 2.82Å; L453-V455 HydrophobicContact CD2-CG2 4.08Å; L453-V455 HydrophobicContact CG-CG2 3.87Å
454	E	95.5	Very high	87.8	Confident	89 Å²	89	38.7 Å²	38.7	42%	0.416	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.8	170	-68.5	179.3	-177	0	0	110.4	Q112 R113 I114 R452	Q112-E454 PolarHBondContact O-N 3.03Å; R113-E454 WeakPolarHBondContact CA-O 3.47Å; R113-E454 HydrophobicContact CG-CB 4.15Å; I114-E454 PolarHBondContact N-O 2.8Å; R452-E454 HydrophobicContact CG-CG 4.41Å
455	V	95.3	Very high	87.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110	-179	-173.5	0	0	0	0	109.1	I114 L116 F126 T441 F442 L453 V457	I114-V455 HydrophobicContact CD1-CB 4.46Å; I114-V455 HydrophobicContact CD1-CG1 3.99Å; I114-V455 HydrophobicContact CD1-CG2 3.89Å; I114-V455 HydrophobicContact CG1-CB 4.15Å; I114-V455 HydrophobicContact CG1-CG1 3.9Å; I114-V455 HydrophobicContact CG1-CG2 3.88Å; L116-V455 HydrophobicContact CD1-CG1 3.41Å; L116-V455 VanDerWaalsContact CD1-CG1 3.41Å; L116-V455 HydrophobicContact CG-CG1 3.72Å; F126-V455 HydrophobicContact CZ-CG2 4.3Å; T441-V455 VanDerWaalsContact CA-O 3.3Å; T441-V455 WeakPolarHBondContact CA-O 3.22Å; F442-V455 HydrophobicContact CD1-CB 3.99Å; F442-V455 HydrophobicContact CD1-CG1 4.13Å; F442-V455 HydrophobicContact CD2-CB 4.18Å; F442-V455 HydrophobicContact CD2-CG2 4.3Å; F442-V455 HydrophobicContact CE1-CB 3.69Å; F442-V455 HydrophobicContact CE1-CG1 3.4Å; F442-V455 HydrophobicContact CE1-CG2 4.44Å; F442-V455 HydrophobicContact CE2-CB 3.89Å; F442-V455 HydrophobicContact CE2-CG1 4.21Å; F442-V455 HydrophobicContact CE2-CG2 3.8Å; F442-V455 HydrophobicContact CG-CB 4.24Å; F442-V455 HydrophobicContact CZ-CB 3.63Å; F442-V455 HydrophobicContact CZ-CG1 3.45Å; F442-V455 VanDerWaalsContact CZ-CG1 3.45Å; F442-V455 HydrophobicContact CZ-CG2 3.89Å; F442-V455 PolarHBondContact N-O 2.8Å; F442-V455 PolarHBondContact O-N 3.26Å; L453-V455 HydrophobicContact CD2-CG2 4.08Å; L453-V455 HydrophobicContact CG-CG2 3.87Å; V455-V457 HydrophobicContact CG1-CG2 4.2Å
456	A	93.8	Very high	87.5	Confident	25 Å²	25	38.8 Å²	38.8	21%	0.207	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.8	173.5	0	0	0	0	0	110.3	I114 S115 L116 T441	I114-A456 PolarHBondContact O-N 2.85Å; S115-A456 CarbonylContact C-O 3.56Å; S115-A456 VanDerWaalsContact CA-O 3.29Å; S115-A456 WeakPolarHBondContact CA-O 3.42Å; L116-A456 PolarHBondContact N-O 3.35Å; T441-A456 HydrophobicContact CG2-CB 4.3Å
457	V	91.5	Very high	87.3	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.3	-174.9	-173.5	0	0	0	0	110.7	L116 L118 I393 Q440 F442 V455 Y459	L116-V457 HydrophobicContact CD1-CG2 4.4Å; L118-V457 HydrophobicContact CD1-CG1 3.69Å; L118-V457 HydrophobicContact CG-CG1 4.18Å; I393-V457 HydrophobicContact CD1-CB 4.17Å; I393-V457 HydrophobicContact CD1-CG1 3.89Å; I393-V457 HydrophobicContact CD1-CG2 3.68Å; Q440-V457 PolarHBondContact O-N 3.22Å; F442-V457 HydrophobicContact CD1-CG2 3.88Å; F442-V457 HydrophobicContact CE1-CG2 3.6Å; V455-V457 HydrophobicContact CG1-CG2 4.2Å; V457-Y459 HydrophobicContact CG1-CD2 4.34Å; V457-Y459 HydrophobicContact CG1-CE1 4.33Å; V457-Y459 HydrophobicContact CG1-CE2 3.89Å
458	N	89.8	Confident	87.5	Confident	95 Å²	95	52 Å²	52	51%	0.508	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.1	173.8	-178.4	14.4	0	0	0	110	L116 S117 L118	L116-N458 PolarHBondContact O-N 3.23Å; S117-N458 CarbonylContact C-O 3.57Å; S117-N458 VanDerWaalsContact CA-O 3.24Å; S117-N458 WeakPolarHBondContact CA-O 3.48Å; L118-N458 PolarHBondContact N-O 2.79Å
459	Y	87.5	Confident	88	Confident	25 Å²	25	53.3 Å²	53.3	10%	0.098	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	121	-177	-62.1	-93.4	0	0	0	111.3	I393 A430 P434 Q440 V457 C461	I393-Y459 WeakPolarHBondContact CD1-OH 3.43Å; I393-Y459 HydrophobicContact CG1-CE1 4.49Å; I393-Y459 VanDerWaalsContact CG1-OH 3.22Å; I393-Y459 WeakPolarHBondContact CG1-OH 3.37Å; A430-Y459 HydrophobicContact CB-CD1 3.88Å; A430-Y459 HydrophobicContact CB-CE1 3.74Å; P434-Y459 HydrophobicContact CG-CD1 4.2Å; P434-Y459 HydrophobicContact CG-CD2 3.43Å; P434-Y459 VanDerWaalsContact CG-CD2 3.43Å; P434-Y459 HydrophobicContact CG-CE1 4.17Å; P434-Y459 HydrophobicContact CG-CE2 3.4Å; P434-Y459 VanDerWaalsContact CG-CE2 3.4Å; P434-Y459 HydrophobicContact CG-CG 3.84Å; Q440-Y459 HydrophobicContact CB-CE2 4.4Å; Q440-Y459 HydrophobicContact CG-CE2 4.45Å; Q440-Y459 PolarHBondContact OE1-OH 3.47Å; V457-Y459 HydrophobicContact CG1-CD2 4.34Å; V457-Y459 HydrophobicContact CG1-CE1 4.33Å; V457-Y459 HydrophobicContact CG1-CE2 3.89Å; Y459-C461 PolarHBondContact O-N 2.96Å
460	Q	87.3	Confident	88.4	Confident	56 Å²	56	58 Å²	58	26%	0.262	30%	0.295	S	S	.	.			trans	-88.2	76.5	177	-64.4	-169.2	-8.5	0	0	110.7	P82 R83 S117 L118	P82-Q460 HydrophobicContact CB-CB 4.48Å; P82-Q460 VanDerWaalsContact CB-OE1 3.22Å; R83-Q460 PolarHBondContact O-OE1 3.11Å; S117-Q460 WeakPolarHBondContact OG-CG 3.49Å; S117-Q460 PolarHBondContact OG-NE2 2.91Å; L118-Q460 PolarHBondContact O-N 3.47Å
461	C	82.9	Confident	88.7	Confident	26 Å²	26	59.5 Å²	59.5	18%	0.176	31%	0.31	C	S	.	.			trans	-97.3	-34.5	-177.1	-59.3	0	0	0	0	113.5	C433 Y459	C433-C461 VanDerWaalsContact CA-SG 3.52Å; C433-C461 HydrophobicContact CB-CB 3.75Å; C433-C461 WeakPolarHBondContact CB-SG 3.43Å; C433-C461 VanDerWaalsContact SG-CA 3.57Å; C433-C461 WeakPolarHBondContact SG-CB 3.41Å; C433-C461 CovalentContact SG-SG 2Å; C433-C461 PolarHBondContact SG-SG 2.91Å; Y459-C461 PolarHBondContact O-N 2.96Å
462	D	84.5	Confident	88.8	Confident	80 Å²	80	62.4 Å²	62.4	43%	0.428	33%	0.325	S	S	.	.	S	Bend	trans	-86.8	142.9	-177.8	-67.2	-42.9	0	0	0	110.8	R436	R436-D462 IonicContact CZ-OD1 2.82Å; R436-D462 IonicContact CZ-OD2 3.19Å; R436-D462 IonicContact NE-OD1 3.09Å; R436-D462 IonicContact NE-OD2 3.8Å; R436-D462 PolarHBondContact NE-OD2 3.09Å; R436-D462 VanDerWaalsContact NH2-CG 3.32Å; R436-D462 IonicContact NH2-OD1 3.94Å; R436-D462 PolarHBondContact NH2-OD1 2.95Å; R436-D462 IonicContact NH2-OD2 3.49Å; R436-D462 PolarHBondContact NH2-OD2 3.15Å
463	C	87.8	Confident	88.6	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.007	31%	0.306	C	S	.	.			trans	-77.3	148.3	171.2	-65.4	0	0	0	0	111.9	C35 L39 E80 C465 S466	C35-C463 HydrophobicContact CB-CB 3.84Å; C35-C463 WeakPolarHBondContact CB-SG 3.45Å; C35-C463 WeakPolarHBondContact SG-CB 3.48Å; C35-C463 CovalentContact SG-SG 2.02Å; C35-C463 PolarHBondContact SG-SG 2.97Å; L39-C463 WeakPolarHBondContact CD1-SG 3.39Å; E80-C463 HydrophobicContact CG-CB 4.17Å; C463-C465 VanDerWaalsContact C-N 3.28Å; C463-C465 VanDerWaalsContact CB-SG 3.59Å; C463-C465 PolarHBondContact O-N 3.26Å; C463-S466 WeakPolarHBondContact O-CB 3.3Å; C463-S466 PolarHBondContact O-N 3.47Å; C463-S466 VanDerWaalsContact O-N 3.11Å
464	S	88.1	Confident	88.3	Confident	78 Å²	78	61.5 Å²	61.5	55%	0.545	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-59.9	-42	178.7	-29.7	0	0	0	0	111.2	E80 S466 R467	E80-S464 WeakPolarHBondContact OE1-CB 3.05Å; E80-S464 PolarHBondContact OE1-N 2.69Å; E80-S464 PolarHBondContact OE1-OG 2.9Å; E80-S464 WeakPolarHBondContact OE2-CB 3.31Å; E80-S464 PolarHBondContact OE2-N 3.15Å; E80-S464 VanDerWaalsContact OE2-N 3.1Å; E80-S464 PolarHBondContact OE2-OG 3.14Å; S464-S466 PolarHBondContact O-N 3.39Å; S464-R467 WeakPolarHBondContact O-CB 3.4Å; S464-R467 PolarHBondContact O-N 3.3Å
465	C	88.1	Confident	87.8	Confident	15 Å²	15	59.7 Å²	59.7	10%	0.101	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-60	-24.3	177	55.5	0	0	0	0	114.4	A49 E80 C463 R467 T468 C484	A49-C465 HydrophobicContact CB-CB 4.01Å; E80-C465 WeakPolarHBondContact OE1-CB 3.38Å; E80-C465 PolarHBondContact OE1-N 2.61Å; E80-C465 PolarHBondContact OE1-SG 3.44Å; C463-C465 VanDerWaalsContact C-N 3.28Å; C463-C465 VanDerWaalsContact CB-SG 3.59Å; C463-C465 PolarHBondContact O-N 3.26Å; C465-R467 PolarHBondContact O-N 2.03Å; C465-T468 PolarHBondContact O-N 3.45Å; C465-T468 VanDerWaalsContact O-N 3.11Å; C465-T468 PolarHBondContact O-OG1 2.81Å; C465-C484 HydrophobicContact CB-CB 3.98Å; C465-C484 WeakPolarHBondContact CB-SG 3.25Å; C465-C484 WeakPolarHBondContact SG-CB 3.24Å; C465-C484 CovalentContact SG-SG 2.02Å; C465-C484 PolarHBondContact SG-SG 3.49Å
466	S	86.4	Confident	87.3	Confident	26 Å²	26	59.7 Å²	59.7	18%	0.182	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-68.8	-21.5	179.8	-55.5	0	0	0	0	112.9	E36 C463 S464 T468 A469 N483 C484	E36-S466 WeakPolarHBondContact OE1-CB 3.3Å; E36-S466 PolarHBondContact OE1-OG 3.44Å; C463-S466 WeakPolarHBondContact O-CB 3.3Å; C463-S466 PolarHBondContact O-N 3.47Å; C463-S466 VanDerWaalsContact O-N 3.11Å; S464-S466 PolarHBondContact O-N 3.39Å; S466-T468 PolarHBondContact O-N 2.91Å; S466-A469 WeakPolarHBondContact O-CB 3.01Å; S466-A469 PolarHBondContact O-N 3.47Å; S466-N483 VanDerWaalsContact CA-OD1 3.29Å; S466-N483 WeakPolarHBondContact CA-OD1 3.5Å; S466-C484 PolarHBondContact N-SG 3.03Å; S466-C484 PolarHBondContact OG-SG 3.49Å
467	R	84.6	Confident	87	Confident	225 Å²	225	62.4 Å²	62.4	85%	0.849	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-70	-20.6	173.9	-60.7	-177.9	-179.2	-176.8	0.2	113.4	S464 C465	S464-R467 WeakPolarHBondContact O-CB 3.4Å; S464-R467 PolarHBondContact O-N 3.3Å; C465-R467 PolarHBondContact O-N 2.03Å
468	T	84.5	Confident	86.8	Confident	104 Å²	104	65.3 Å²	65.3	64%	0.638	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-104.5	17.1	-179.8	50.8	0	0	0	0	112.8	C465 S466 Q470	C465-T468 PolarHBondContact O-N 3.45Å; C465-T468 VanDerWaalsContact O-N 3.11Å; C465-T468 PolarHBondContact O-OG1 2.81Å; S466-T468 PolarHBondContact O-N 2.91Å; T468-Q470 PolarHBondContact O-N 3.07Å
469	A	86.4	Confident	86.7	Confident	38 Å²	38	63 Å²	63	31%	0.314	35%	0.349	S	S	.	.			trans	-57.4	136.6	178.1	0	0	0	0	0	111.2	S466 M481 Y482 N483	S466-A469 WeakPolarHBondContact O-CB 3.01Å; S466-A469 PolarHBondContact O-N 3.47Å; A469-M481 HydrophobicContact CB-CG 4.31Å; A469-M481 HydrophobicContact CB-SD 4.07Å; A469-Y482 WeakPolarHBondContact CA-O 3.26Å; A469-N483 HydrophobicContact CB-CB 4.3Å
470	Q	87.9	Confident	86.7	Confident	106 Å²	106	61.9 Å²	61.9	50%	0.495	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	110.8	-178.2	-66.9	180	-4.6	0	0	109.6	T468 S473 M481 Y482	T468-Q470 PolarHBondContact O-N 3.07Å; Q470-S473 PolarHBondContact OE1-OG 2.73Å; Q470-M481 CarbonylContact O-C 3.56Å; Q470-M481 WeakPolarHBondContact O-CA 3.44Å; Q470-Y482 PolarHBondContact N-O 3.48Å; Q470-Y482 PolarHBondContact O-N 2.97Å
471	V	87.9	Confident	86.8	Confident	107 Å²	107	61.9 Å²	61.9	65%	0.648	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	140.4	170.9	-171.9	0	0	0	0	108.8	S473 M481	V471-S473 VanDerWaalsContact C-N 3.29Å; V471-S473 PolarHBondContact O-N 2.83Å; V471-M481 HydrophobicContact CG2-CG 4.45Å; V471-M481 HydrophobicContact CG2-SD 4.48Å
472	N	87.3	Confident	87.1	Confident	87 Å²	87	62.4 Å²	62.4	47%	0.465	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	43.7	-176.8	-57.3	-15	0	0	0	112.5	G480	N472-G480 VanDerWaalsContact CA-O 3.3Å; N472-G480 WeakPolarHBondContact CA-O 3.47Å; N472-G480 PolarHBondContact N-O 3.32Å
473	S	88.5	Confident	87.3	Confident	5 Å²	5	59.1 Å²	59.1	4%	0.035	33%	0.328	C	S	.	.			trans	-69.2	137.7	180	-173.8	0	0	0	0	110.8	Q470 V471 L475 C476 S478 G480 Y482	Q470-S473 PolarHBondContact OE1-OG 2.73Å; V471-S473 VanDerWaalsContact C-N 3.29Å; V471-S473 PolarHBondContact O-N 2.83Å; S473-L475 PolarHBondContact O-N 3.24Å; S473-L475 PolarHBondContact OG-N 2.04Å; S473-C476 CarbonylContact O-C 3.46Å; S473-C476 WeakPolarHBondContact O-CA 3.34Å; S473-C476 PolarHBondContact O-N 2.92Å; S473-S478 WeakPolarHBondContact O-CA 3.39Å; S473-S478 PolarHBondContact O-N 3.42Å; S473-G480 PolarHBondContact N-O 3.47Å; S473-Y482 VanDerWaalsContact CB-CB 3.5Å
474	S	88.4	Confident	87.3	Confident	97 Å²	97	59.4 Å²	59.4	68%	0.678	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.7	172.9	55.7	0	0	0	0	112.9	C476 N477	S474-C476 PolarHBondContact O-N 2.91Å; S474-N477 PolarHBondContact O-N 3.09Å
475	L	84.5	Confident	87.2	Confident	50 Å²	50	56 Å²	56	26%	0.262	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-68.4	-19.9	173	-64.8	173.8	0	0	0	113	S473 Y482 H497	S473-L475 PolarHBondContact O-N 3.24Å; S473-L475 PolarHBondContact OG-N 2.04Å; L475-Y482 HydrophobicContact CB-CD2 4.15Å; L475-Y482 HydrophobicContact CD1-CD1 4.11Å; L475-Y482 HydrophobicContact CD1-CD2 4.01Å; L475-Y482 HydrophobicContact CD1-CE1 4Å; L475-Y482 HydrophobicContact CD1-CE2 3.91Å; L475-Y482 HydrophobicContact CD1-CG 4.1Å; L475-H497 PolarHBondContact O-ND1 3.12Å
476	C	86.3	Confident	87	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-114.5	35	177.7	-50.3	0	0	0	0	110.8	S473 S474 S478 I479 C487 H497	S473-C476 CarbonylContact O-C 3.46Å; S473-C476 WeakPolarHBondContact O-CA 3.34Å; S473-C476 PolarHBondContact O-N 2.92Å; S474-C476 PolarHBondContact O-N 2.91Å; C476-S478 PolarHBondContact O-N 3.46Å; C476-I479 CarbonylContact O-C 3.57Å; C476-I479 PolarHBondContact O-N 3.31Å; C476-C487 WeakPolarHBondContact CA-SG 3.37Å; C476-C487 HydrophobicContact CB-CB 3.78Å; C476-C487 WeakPolarHBondContact CB-SG 3.19Å; C476-C487 VanDerWaalsContact SG-CA 3.53Å; C476-C487 WeakPolarHBondContact SG-CB 3.21Å; C476-C487 CovalentContact SG-SG 2.03Å; C476-C487 PolarHBondContact SG-SG 2.88Å; C476-H497 CarbonylContact C-O 3.56Å; C476-H497 VanDerWaalsContact CA-O 3.28Å; C476-H497 WeakPolarHBondContact CA-O 2.98Å
477	N	85.9	Confident	87	Confident	82 Å²	82	56.9 Å²	56.9	44%	0.439	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	21.5	-176.2	-69.7	-45.1	0	0	0	115.2	S474 I479 H497 C498 E499	S474-N477 PolarHBondContact O-N 3.09Å; N477-I479 PolarHBondContact O-N 2.88Å; N477-H497 PolarHBondContact N-O 2.99Å; N477-H497 PolarHBondContact ND2-O 3.28Å; N477-C498 PolarHBondContact ND2-O 3.05Å; N477-E499 VanDerWaalsContact ND2-CA 3.28Å; N477-E499 WeakPolarHBondContact ND2-CA 3.14Å; N477-E499 PolarHBondContact ND2-N 3.37Å
478	S	88.3	Confident	87.1	Confident	68 Å²	68	51.8 Å²	51.8	48%	0.476	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	13.7	-171.9	-47.2	0	0	0	0	114.5	S473 C476	S473-S478 WeakPolarHBondContact O-CA 3.39Å; S473-S478 PolarHBondContact O-N 3.42Å; C476-S478 PolarHBondContact O-N 3.46Å
479	I	87.1	Confident	87.1	Confident	46 Å²	46	48.7 Å²	48.7	24%	0.236	27%	0.274	C	S	.	.	S	Bend	trans	-122.7	56.3	-178.9	-52.1	170.4	0	0	0	108.4	C476 N477 E490 Y493 C498	C476-I479 CarbonylContact O-C 3.57Å; C476-I479 PolarHBondContact O-N 3.31Å; N477-I479 PolarHBondContact O-N 2.88Å; I479-E490 HydrophobicContact CG2-CB 4.17Å; I479-E490 HydrophobicContact CG2-CG 4.42Å; I479-E490 PolarHBondContact O-N 3.03Å; I479-Y493 HydrophobicContact CD1-CD1 4.22Å; I479-Y493 HydrophobicContact CD1-CE1 3.69Å; I479-Y493 HydrophobicContact CG2-CD1 3.95Å; I479-Y493 HydrophobicContact CG2-CD2 3.35Å; I479-Y493 HydrophobicContact CG2-CE1 4.07Å; I479-Y493 HydrophobicContact CG2-CE2 3.49Å; I479-Y493 VanDerWaalsContact CG2-CE2 3.49Å; I479-Y493 HydrophobicContact CG2-CG 3.59Å; I479-C498 WeakPolarHBondContact O-CB 3.33Å
480	G	87.3	Confident	87.1	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.8	171.2	-176.4	0	0	0	0	0	113.5	N472 S473 R488	N472-G480 VanDerWaalsContact CA-O 3.3Å; N472-G480 WeakPolarHBondContact CA-O 3.47Å; N472-G480 PolarHBondContact N-O 3.32Å; S473-G480 PolarHBondContact N-O 3.47Å; G480-R488 CarbonylContact C-O 3.33Å; G480-R488 VanDerWaalsContact CA-O 3.28Å; G480-R488 WeakPolarHBondContact CA-O 3.27Å
481	M	89.8	Confident	86.9	Confident	55 Å²	55	52.5 Å²	52.5	27%	0.271	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.6	178.3	-179.2	-179.7	64.9	0	0	110.3	A469 Q470 V471 N483 R488	A469-M481 HydrophobicContact CB-CG 4.31Å; A469-M481 HydrophobicContact CB-SD 4.07Å; Q470-M481 CarbonylContact O-C 3.56Å; Q470-M481 WeakPolarHBondContact O-CA 3.44Å; V471-M481 HydrophobicContact CG2-CG 4.45Å; V471-M481 HydrophobicContact CG2-SD 4.48Å; M481-N483 HydrophobicContact CE-CB 4.29Å; M481-R488 HydrophobicContact CE-CB 4.33Å; M481-R488 PolarHBondContact N-O 2.86Å; M481-R488 PolarHBondContact O-N 2.78Å
482	Y	88.8	Confident	86.4	Confident	38 Å²	38	48.5 Å²	48.5	15%	0.149	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	118.9	169.6	-177.3	-104.3	0	0	0	109.5	A469 Q470 S473 L475 G485	A469-Y482 WeakPolarHBondContact CA-O 3.26Å; Q470-Y482 PolarHBondContact N-O 3.48Å; Q470-Y482 PolarHBondContact O-N 2.97Å; S473-Y482 VanDerWaalsContact CB-CB 3.5Å; L475-Y482 HydrophobicContact CB-CD2 4.15Å; L475-Y482 HydrophobicContact CD1-CD1 4.11Å; L475-Y482 HydrophobicContact CD1-CD2 4.01Å; L475-Y482 HydrophobicContact CD1-CE1 4Å; L475-Y482 HydrophobicContact CD1-CE2 3.91Å; L475-Y482 HydrophobicContact CD1-CG 4.1Å; Y482-G485 WeakPolarHBondContact OH-CA 3.44Å
483	N	89.4	Confident	86.2	Confident	11 Å²	11	47.8 Å²	47.8	6%	0.059	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.7	179.7	-172.2	22.7	0	0	0	111	S466 A469 M481 G485 T486	S466-N483 VanDerWaalsContact CA-OD1 3.29Å; S466-N483 WeakPolarHBondContact CA-OD1 3.5Å; A469-N483 HydrophobicContact CB-CB 4.3Å; M481-N483 HydrophobicContact CE-CB 4.29Å; N483-G485 VanDerWaalsContact C-N 3.26Å; N483-G485 PolarHBondContact O-N 3.41Å; N483-G485 VanDerWaalsContact O-N 3.07Å; N483-T486 PolarHBondContact N-O 3.33Å; N483-T486 VanDerWaalsContact O-CG2 3.28Å; N483-T486 WeakPolarHBondContact O-CG2 3.33Å; N483-T486 PolarHBondContact O-N 2.84Å; N483-T486 VanDerWaalsContact O-O 3.06Å
484	C	88.1	Confident	85.5	Confident	7 Å²	7	49.2 Å²	49.2	5%	0.047	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	38.8	172.5	-65.8	0	0	0	0	115.8	C35 W47 A49 C465 S466	C35-C484 HydrophobicContact CB-CB 3.95Å; W47-C484 PolarHBondContact NE1-O 2.81Å; A49-C484 WeakPolarHBondContact CA-O 3.4Å; A49-C484 HydrophobicContact CB-CB 4.43Å; C465-C484 HydrophobicContact CB-CB 3.98Å; C465-C484 WeakPolarHBondContact CB-SG 3.25Å; C465-C484 WeakPolarHBondContact SG-CB 3.24Å; C465-C484 CovalentContact SG-SG 2.02Å; C465-C484 PolarHBondContact SG-SG 3.49Å; S466-C484 PolarHBondContact N-SG 3.03Å; S466-C484 PolarHBondContact OG-SG 3.49Å
485	G	85.4	Confident	84.7	Confident	6 Å²	6	45 Å²	45	6%	0.062	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	3.7	179.3	0	0	0	0	0	115.3	R62 Y482 N483	R62-G485 PolarHBondContact NE-O 3.12Å; R62-G485 PolarHBondContact NH2-O 2.99Å; R62-G485 VanDerWaalsContact NH2-O 3.13Å; Y482-G485 WeakPolarHBondContact OH-CA 3.44Å; N483-G485 VanDerWaalsContact C-N 3.26Å; N483-G485 PolarHBondContact O-N 3.41Å; N483-G485 VanDerWaalsContact O-N 3.07Å
486	T	84.9	Confident	84.2	Confident	43 Å²	43	45.8 Å²	45.8	26%	0.264	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	157.3	176.4	-164.7	0	0	0	0	111.9	N483	N483-T486 PolarHBondContact N-O 3.33Å; N483-T486 VanDerWaalsContact O-CG2 3.28Å; N483-T486 WeakPolarHBondContact O-CG2 3.33Å; N483-T486 PolarHBondContact O-N 2.84Å; N483-T486 VanDerWaalsContact O-O 3.06Å
487	C	85.6	Confident	83.9	Confident	16 Å²	16	49.5 Å²	49.5	11%	0.108	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.6	173.2	-73.6	0	0	0	0	110.3	C476 A496	C476-C487 WeakPolarHBondContact CA-SG 3.37Å; C476-C487 HydrophobicContact CB-CB 3.78Å; C476-C487 WeakPolarHBondContact CB-SG 3.19Å; C476-C487 VanDerWaalsContact SG-CA 3.53Å; C476-C487 WeakPolarHBondContact SG-CB 3.21Å; C476-C487 CovalentContact SG-SG 2.03Å; C476-C487 PolarHBondContact SG-SG 2.88Å; C487-A496 WeakPolarHBondContact CB-O 3.41Å
488	R	86.4	Confident	83.7	Confident	118 Å²	118	45.7 Å²	45.7	45%	0.445	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	101.4	165.1	-71.6	-168.9	170.8	-177.5	-1.9	108.2	S34 G480 M481	S34-R488 VanDerWaalsContact CB-NH2 3.33Å; G480-R488 CarbonylContact C-O 3.33Å; G480-R488 VanDerWaalsContact CA-O 3.28Å; G480-R488 WeakPolarHBondContact CA-O 3.27Å; M481-R488 HydrophobicContact CE-CB 4.33Å; M481-R488 PolarHBondContact N-O 2.86Å; M481-R488 PolarHBondContact O-N 2.78Å
489	C	85.1	Confident	83.3	Confident	39 Å²	39	47.3 Å²	47.3	26%	0.264	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	153	-175.9	-53.2	0	0	0	0	112.2	Y493 C498	C489-Y493 WeakPolarHBondContact CB-O 3.01Å; C489-C498 WeakPolarHBondContact CA-SG 3.46Å; C489-C498 HydrophobicContact CB-CB 3.72Å; C489-C498 WeakPolarHBondContact CB-SG 3.49Å; C489-C498 WeakPolarHBondContact SG-CA 3.01Å; C489-C498 WeakPolarHBondContact SG-CB 3.34Å; C489-C498 CovalentContact SG-SG 2.03Å; C489-C498 PolarHBondContact SG-SG 2.91Å
490	E	86.5	Confident	82.8	Confident	93 Å²	93	46.2 Å²	46.2	44%	0.435	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-66.4	155.7	169.8	-66.8	-169.9	159.5	0	0	110.9	I479 G492 Y493	I479-E490 HydrophobicContact CG2-CB 4.17Å; I479-E490 HydrophobicContact CG2-CG 4.42Å; I479-E490 PolarHBondContact O-N 3.03Å; E490-G492 PolarHBondContact O-N 3.07Å; E490-Y493 PolarHBondContact O-N 3.08Å; E490-Y493 VanDerWaalsContact O-N 3.07Å
491	P	83	Confident	82.4	Confident	132 Å²	132	50.8 Å²	50.8	86%	0.857	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	130.5	176.8	-25.6	34.5	0	0	0	111.7
492	G	78.8	Confident	81.4	Confident	23 Å²	23	53.2 Å²	53.2	24%	0.237	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	0.4	-176	0	0	0	0	0	115.6	E490 Q501 E502	E490-G492 PolarHBondContact O-N 3.07Å; G492-Q501 CarbonylContact O-C 3.5Å; G492-Q501 WeakPolarHBondContact O-CA 3.5Å; G492-E502 WeakPolarHBondContact CA-OE2 3.27Å; G492-E502 WeakPolarHBondContact O-CB 3.29Å; G492-E502 PolarHBondContact O-N 2.97Å
493	Y	81.7	Confident	80.3	Confident	72 Å²	72	54.7 Å²	54.7	28%	0.282	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.4	175.8	-66.7	-94.4	0	0	0	112.6	I479 C489 E490 C500 Q501	I479-Y493 HydrophobicContact CD1-CD1 4.22Å; I479-Y493 HydrophobicContact CD1-CE1 3.69Å; I479-Y493 HydrophobicContact CG2-CD1 3.95Å; I479-Y493 HydrophobicContact CG2-CD2 3.35Å; I479-Y493 HydrophobicContact CG2-CE1 4.07Å; I479-Y493 HydrophobicContact CG2-CE2 3.49Å; I479-Y493 VanDerWaalsContact CG2-CE2 3.49Å; I479-Y493 HydrophobicContact CG2-CG 3.59Å; C489-Y493 WeakPolarHBondContact CB-O 3.01Å; E490-Y493 PolarHBondContact O-N 3.08Å; E490-Y493 VanDerWaalsContact O-N 3.07Å; Y493-C500 CarbonylContact C-O 3.07Å; Y493-C500 WeakPolarHBondContact CA-O 3.32Å; Y493-Q501 HydrophobicContact CD1-CB 4.42Å; Y493-Q501 HydrophobicContact CE1-CB 4.23Å; Y493-Q501 HydrophobicContact CE1-CG 4.33Å
494	L	73.4	Confident	79.1	Confident	34 Å²	34	59.2 Å²	59.2	18%	0.178	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	168.4	-171.5	-56.5	168.3	0	0	0	111.1	C498 E499 C500 C530 L534	L494-C498 CarbonylContact O-C 3.53Å; L494-C498 WeakPolarHBondContact O-CA 3.45Å; L494-E499 PolarHBondContact O-N 3.17Å; L494-C500 HydrophobicContact CB-CB 4.34Å; L494-C500 PolarHBondContact N-O 2.98Å; L494-C500 WeakPolarHBondContact O-CB 3.41Å; L494-C500 PolarHBondContact O-N 2.98Å; L494-C530 HydrophobicContact CB-CB 4.26Å; L494-L534 HydrophobicContact CD1-CD1 3.71Å; L494-L534 HydrophobicContact CD2-CD1 3.94Å; L494-L534 HydrophobicContact CG-CD1 4.36Å
495	G	71.9	Confident	77.5	Confident	10 Å²	10	63.2 Å²	63.2	10%	0.103	37%	0.367	C	S	.	.	S	Bend	trans	103.3	169	-179.3	0	0	0	0	0	113.5	H497 C498 E499	G495-H497 PolarHBondContact O-N 3.37Å; G495-C498 PolarHBondContact O-N 3.05Å; G495-E499 WeakPolarHBondContact CA-OE2 3.42Å
496	A	73.6	Confident	75.9	Confident	66 Å²	66	66.9 Å²	66.9	55%	0.545	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.7	-175.9	0	0	0	0	0	112.9	C487 E499	C487-A496 WeakPolarHBondContact CB-O 3.41Å; A496-E499 PolarHBondContact N-OE2 3.25Å
497	H	80.1	Confident	74.4	Confident	78 Å²	78	69.2 Å²	69.2	36%	0.361	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	15.6	-179.4	-65.6	-70	0	0	0	112.4	L475 C476 N477 G495 E499	L475-H497 PolarHBondContact O-ND1 3.12Å; C476-H497 CarbonylContact C-O 3.56Å; C476-H497 VanDerWaalsContact CA-O 3.28Å; C476-H497 WeakPolarHBondContact CA-O 2.98Å; N477-H497 PolarHBondContact N-O 2.99Å; N477-H497 PolarHBondContact ND2-O 3.28Å; G495-H497 PolarHBondContact O-N 3.37Å; H497-E499 VanDerWaalsContact C-N 3.26Å; H497-E499 VanDerWaalsContact CA-OE2 3.26Å; H497-E499 WeakPolarHBondContact CA-OE2 3.46Å; H497-E499 WeakPolarHBondContact CB-OE2 3.07Å; H497-E499 PolarHBondContact N-OE2 3.31Å; H497-E499 PolarHBondContact O-N 3.23Å
498	C	82.8	Confident	73.1	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.014	42%	0.424	C	S	.	.	S	Bend	trans	59.5	36.7	-176.2	-44.2	0	0	0	0	112.7	N477 I479 C489 L494 G495	N477-C498 PolarHBondContact ND2-O 3.05Å; I479-C498 WeakPolarHBondContact O-CB 3.33Å; C489-C498 WeakPolarHBondContact CA-SG 3.46Å; C489-C498 HydrophobicContact CB-CB 3.72Å; C489-C498 WeakPolarHBondContact CB-SG 3.49Å; C489-C498 WeakPolarHBondContact SG-CA 3.01Å; C489-C498 WeakPolarHBondContact SG-CB 3.34Å; C489-C498 CovalentContact SG-SG 2.03Å; C489-C498 PolarHBondContact SG-SG 2.91Å; L494-C498 CarbonylContact O-C 3.53Å; L494-C498 WeakPolarHBondContact O-CA 3.45Å; G495-C498 PolarHBondContact O-N 3.05Å
499	E	80.3	Confident	72	Confident	102 Å²	102	74 Å²	74	48%	0.477	43%	0.431	S	S	.	.			trans	-81.1	-13.2	-175.9	65.2	-90.8	-147.1	0	0	114.5	N477 L494 G495 A496 H497	N477-E499 VanDerWaalsContact ND2-CA 3.28Å; N477-E499 WeakPolarHBondContact ND2-CA 3.14Å; N477-E499 PolarHBondContact ND2-N 3.37Å; L494-E499 PolarHBondContact O-N 3.17Å; G495-E499 WeakPolarHBondContact CA-OE2 3.42Å; A496-E499 PolarHBondContact N-OE2 3.25Å; H497-E499 VanDerWaalsContact C-N 3.26Å; H497-E499 VanDerWaalsContact CA-OE2 3.26Å; H497-E499 WeakPolarHBondContact CA-OE2 3.46Å; H497-E499 WeakPolarHBondContact CB-OE2 3.07Å; H497-E499 PolarHBondContact N-OE2 3.31Å; H497-E499 PolarHBondContact O-N 3.23Å
500	C	76	Confident	71	Confident	23 Å²	23	76.9 Å²	76.9	16%	0.155	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.4	-175.7	-71.1	0	0	0	0	112	Y493 L494 C530	Y493-C500 CarbonylContact C-O 3.07Å; Y493-C500 WeakPolarHBondContact CA-O 3.32Å; L494-C500 HydrophobicContact CB-CB 4.34Å; L494-C500 PolarHBondContact N-O 2.98Å; L494-C500 WeakPolarHBondContact O-CB 3.41Å; L494-C500 PolarHBondContact O-N 2.98Å; C500-C530 HydrophobicContact CB-CB 3.33Å; C500-C530 WeakPolarHBondContact CB-SG 3.21Å; C500-C530 WeakPolarHBondContact SG-CB 3.29Å; C500-C530 CovalentContact SG-SG 2.02Å; C500-C530 PolarHBondContact SG-SG 3.03Å
501	Q	79.1	Confident	70.1	Confident	98 Å²	98	76.7 Å²	76.7	46%	0.458	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	141.7	169.2	-169.3	174.2	-2.6	0	0	111.2	G492 Y493 G503 E504	G492-Q501 CarbonylContact O-C 3.5Å; G492-Q501 WeakPolarHBondContact O-CA 3.5Å; Y493-Q501 HydrophobicContact CD1-CB 4.42Å; Y493-Q501 HydrophobicContact CE1-CB 4.23Å; Y493-Q501 HydrophobicContact CE1-CG 4.33Å; Q501-G503 PolarHBondContact O-N 3.09Å; Q501-E504 HydrophobicContact CB-CG 4.26Å; Q501-E504 PolarHBondContact O-N 2.94Å; Q501-E504 VanDerWaalsContact O-N 3.17Å
502	E	69.4	Low	69.5	Low	106 Å²	106	72.7 Å²	72.7	50%	0.495	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	121.1	177	-168.2	175.5	-174.5	0	0	110.6	G492 L534	G492-E502 WeakPolarHBondContact CA-OE2 3.27Å; G492-E502 WeakPolarHBondContact O-CB 3.29Å; G492-E502 PolarHBondContact O-N 2.97Å; E502-L534 HydrophobicContact CG-CD1 4.07Å
503	G	63.9	Low	69.5	Low	70 Å²	70	71.6 Å²	71.6	72%	0.722	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-0.8	-178.1	0	0	0	0	0	116.1	Q501 A505	Q501-G503 PolarHBondContact O-N 3.09Å; G503-A505 PolarHBondContact O-N 3.19Å
504	E	65.3	Low	69.4	Low	105 Å²	105	72.8 Å²	72.8	49%	0.491	42%	0.423	S	S	.	.			trans	-75.5	117	173.5	-85.9	-166.9	141.5	0	0	112.6	Q501 S506	Q501-E504 HydrophobicContact CB-CG 4.26Å; Q501-E504 PolarHBondContact O-N 2.94Å; Q501-E504 VanDerWaalsContact O-N 3.17Å; E504-S506 VanDerWaalsContact C-N 3.27Å; E504-S506 PolarHBondContact O-N 2.03Å; E504-S506 VanDerWaalsContact O-N 3.13Å
505	A	54.3	Low	69.6	Low	92 Å²	92	75.8 Å²	75.8	76%	0.76	44%	0.436	S	S	*	.			trans	-84.4	40.7	-178.6	0	0	0	0	0	114	G503 S507	G503-A505 PolarHBondContact O-N 3.19Å; A505-S507 PolarHBondContact O-N 2.97Å
506	S	51	Low	69.9	Low	82 Å²	82	77.6 Å²	77.6	57%	0.573	45%	0.45	S	S	*	.	S	Bend	trans	-89.8	104.5	178.5	55.5	0	0	0	0	111.3	E504 M508	E504-S506 VanDerWaalsContact C-N 3.27Å; E504-S506 PolarHBondContact O-N 2.03Å; E504-S506 VanDerWaalsContact O-N 3.13Å; S506-M508 PolarHBondContact O-N 3.46Å
507	S	54.8	Low	70	Confident	93 Å²	93	83.8 Å²	83.8	65%	0.65	47%	0.468	S	S	*	.	S	Bend	trans	45	61.2	176	63.5	0	0	0	0	115.5	A505 Y509	A505-S507 PolarHBondContact O-N 2.97Å; S507-Y509 PolarHBondContact O-N 2.84Å
508	M	57.3	Low	69.9	Low	80 Å²	80	83.8 Å²	83.8	39%	0.394	49%	0.489	S	S	.	.			trans	-67.4	113.6	173.2	-69	171.7	63.5	0	0	111	S506 L510 C528	S506-M508 PolarHBondContact O-N 3.46Å; M508-L510 HydrophobicContact CE-CD2 4.48Å; M508-L510 PolarHBondContact O-N 2.93Å; M508-C528 HydrophobicContact CE-CB 4.29Å; M508-C528 WeakPolarHBondContact CE-O 3.4Å
509	Y	63.8	Low	70	Confident	155 Å²	155	88.8 Å²	88.8	61%	0.608	51%	0.51	S	S	*	.			trans	-83.4	90.1	164.7	-67.9	-85.7	0	0	0	107.8	S507 S511 A512 N531	S507-Y509 PolarHBondContact O-N 2.84Å; Y509-S511 PolarHBondContact O-N 2.99Å; Y509-A512 VanDerWaalsContact O-CB 3.29Å; Y509-A512 WeakPolarHBondContact O-CB 3.38Å; Y509-A512 PolarHBondContact O-N 2.98Å; Y509-N531 PolarHBondContact N-OD1 3.2Å
510	L	64.6	Low	70.2	Confident	98 Å²	98	90.4 Å²	90.4	51%	0.513	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-21.1	177.2	-78.2	158.7	0	0	0	113.7	M508 A512 V521	M508-L510 HydrophobicContact CE-CD2 4.48Å; M508-L510 PolarHBondContact O-N 2.93Å; L510-A512 VanDerWaalsContact C-N 3.31Å; L510-V521 HydrophobicContact CD2-CG1 4.39Å; L510-V521 HydrophobicContact CD2-CG2 4.28Å
511	S	67.4	Low	70.7	Confident	89 Å²	89	91.1 Å²	91.1	62%	0.622	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-28.7	172.1	52	0	0	0	0	113.5	Y509 C513 R514	Y509-S511 PolarHBondContact O-N 2.99Å; S511-C513 VanDerWaalsContact C-N 3.3Å; S511-C513 PolarHBondContact O-N 2.83Å; S511-R514 PolarHBondContact O-N 3.34Å
512	A	70.4	Confident	70.9	Confident	48 Å²	48	86.5 Å²	86.5	40%	0.397	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.1	-179.6	0	0	0	0	0	113.2	Y509 L510 N531 F547	Y509-A512 VanDerWaalsContact O-CB 3.29Å; Y509-A512 WeakPolarHBondContact O-CB 3.38Å; Y509-A512 PolarHBondContact O-N 2.98Å; L510-A512 VanDerWaalsContact C-N 3.31Å; A512-N531 HydrophobicContact CB-CB 3.82Å; A512-F547 WeakPolarHBondContact O-CE1 3.39Å
513	C	77.3	Confident	71.8	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	19.5	177.1	-67	0	0	0	0	112.9	S511 V521 C522 C528 Q532 F547	S511-C513 VanDerWaalsContact C-N 3.3Å; S511-C513 PolarHBondContact O-N 2.83Å; C513-V521 HydrophobicContact CB-CG1 3.82Å; C513-C522 PolarHBondContact O-N 2.83Å; C513-C528 HydrophobicContact CB-CB 3.45Å; C513-C528 VanDerWaalsContact CB-CB 3.45Å; C513-C528 WeakPolarHBondContact CB-SG 3.41Å; C513-C528 WeakPolarHBondContact SG-CB 3.28Å; C513-C528 CovalentContact SG-SG 2.03Å; C513-C528 PolarHBondContact SG-SG 2.89Å; C513-Q532 VanDerWaalsContact SG-C 3.6Å; C513-Q532 PolarHBondContact SG-N 3.28Å; C513-Q532 VanDerWaalsContact SG-N 3.44Å; C513-Q532 PolarHBondContact SG-O 3.18Å; C513-F547 VanDerWaalsContact C-CD1 3.42Å
514	R	80.9	Confident	72.9	Confident	97 Å²	97	81.9 Å²	81.9	37%	0.366	48%	0.475	S	S	.	.			trans	-126.9	123.5	-178.6	-172.6	-175.8	-69.9	-172.8	-7.8	109.4	S511 A516 K519	S511-R514 PolarHBondContact O-N 3.34Å; R514-A516 WeakPolarHBondContact CD-O 3.44Å; R514-A516 WeakPolarHBondContact CG-O 3.26Å; R514-A516 PolarHBondContact O-N 2.94Å; R514-K519 VanDerWaalsContact CD-O 3.26Å; R514-K519 WeakPolarHBondContact CD-O 3.37Å; R514-K519 WeakPolarHBondContact CG-O 3.11Å; R514-K519 PolarHBondContact NE-O 2.65Å; R514-K519 VanDerWaalsContact NE-O 3.14Å
515	E	76.6	Confident	74.1	Confident	98 Å²	98	80.4 Å²	80.4	46%	0.458	47%	0.465	S	S	.	.	S	Bend	trans	-58.8	-43.7	-179.7	-171	-160.8	161.6	0	0	112.4	K519 F547	E515-K519 IonicContact OE1-NZ 2.7Å; E515-K519 PolarHBondContact OE1-NZ 2.74Å; E515-K519 VanDerWaalsContact OE2-CD 3.27Å; E515-K519 WeakPolarHBondContact OE2-CD 3.44Å; E515-K519 WeakPolarHBondContact OE2-CE 3.42Å; E515-K519 IonicContact OE2-NZ 2.71Å; E515-K519 PolarHBondContact OE2-NZ 2.91Å; E515-F547 HydrophobicContact CB-CD2 3.9Å; E515-F547 HydrophobicContact CB-CE2 4.19Å; E515-F547 HydrophobicContact CB-CG 4.15Å; E515-F547 HydrophobicContact CG-CD2 4.18Å; E515-F547 HydrophobicContact CG-CE2 4.36Å
516	A	79.9	Confident	75.6	Confident	48 Å²	48	76.4 Å²	76.4	40%	0.397	43%	0.433	S	S	.	.	S	Bend	trans	-153.8	155.5	178.2	0	0	0	0	0	111.6	R514 G518 K519	R514-A516 WeakPolarHBondContact CD-O 3.44Å; R514-A516 WeakPolarHBondContact CG-O 3.26Å; R514-A516 PolarHBondContact O-N 2.94Å; A516-G518 PolarHBondContact O-N 3Å; A516-K519 PolarHBondContact O-N 2.87Å; A516-K519 VanDerWaalsContact O-N 3.07Å
517	E	75.6	Confident	77.2	Confident	195 Å²	195	78.8 Å²	78.8	91%	0.911	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	127.5	175.1	-71.4	-167.4	159.9	0	0	111.3
518	G	78.1	Confident	78.4	Confident	78 Å²	78	74.7 Å²	74.7	80%	0.804	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.4	-15.7	-176.5	0	0	0	0	0	115.4	A516	A516-G518 PolarHBondContact O-N 3Å
519	K	83.2	Confident	79.2	Confident	107 Å²	107	71.4 Å²	71.4	47%	0.465	39%	0.392	S	S	.	.	S	Bend	trans	-81.9	157.1	171.1	-69.3	-150.5	-176.2	176.8	0	112.4	R514 E515 A516	R514-K519 VanDerWaalsContact CD-O 3.26Å; R514-K519 WeakPolarHBondContact CD-O 3.37Å; R514-K519 WeakPolarHBondContact CG-O 3.11Å; R514-K519 PolarHBondContact NE-O 2.65Å; R514-K519 VanDerWaalsContact NE-O 3.14Å; E515-K519 IonicContact OE1-NZ 2.7Å; E515-K519 PolarHBondContact OE1-NZ 2.74Å; E515-K519 VanDerWaalsContact OE2-CD 3.27Å; E515-K519 WeakPolarHBondContact OE2-CD 3.44Å; E515-K519 WeakPolarHBondContact OE2-CE 3.42Å; E515-K519 IonicContact OE2-NZ 2.71Å; E515-K519 PolarHBondContact OE2-NZ 2.91Å; A516-K519 PolarHBondContact O-N 2.87Å; A516-K519 VanDerWaalsContact O-N 3.07Å
520	Q	86.2	Confident	79.6	Confident	136 Å²	136	65.2 Å²	65.2	64%	0.636	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-67.5	147.9	177	-69.7	-174.2	-24.7	0	0	111	C522 S523	Q520-C522 PolarHBondContact O-N 2.81Å; Q520-S523 PolarHBondContact O-N 2.77Å
521	V	84.8	Confident	80	Confident	39 Å²	39	63.5 Å²	63.5	24%	0.236	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-64.4	131.3	172.9	178.2	0	0	0	0	108	L510 C513 S523 G524 C528	L510-V521 HydrophobicContact CD2-CG1 4.39Å; L510-V521 HydrophobicContact CD2-CG2 4.28Å; C513-V521 HydrophobicContact CB-CG1 3.82Å; V521-S523 PolarHBondContact O-N 2.92Å; V521-S523 VanDerWaalsContact O-N 3.09Å; V521-G524 PolarHBondContact O-N 2.9Å; V521-C528 HydrophobicContact CG1-CB 3.63Å
522	C	83.8	Confident	80.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	49.3	35.7	-176.6	-52	0	0	0	0	113.9	C513 Q520 G524 R525 C533 F547	C513-C522 PolarHBondContact O-N 2.83Å; Q520-C522 PolarHBondContact O-N 2.81Å; C522-G524 PolarHBondContact O-N 2.88Å; C522-R525 PolarHBondContact O-N 3.38Å; C522-C533 WeakPolarHBondContact CA-SG 3.48Å; C522-C533 HydrophobicContact CB-CB 3.64Å; C522-C533 WeakPolarHBondContact CB-SG 3.3Å; C522-C533 WeakPolarHBondContact SG-CA 3.35Å; C522-C533 WeakPolarHBondContact SG-CB 3.33Å; C522-C533 CovalentContact SG-SG 2.03Å; C522-C533 PolarHBondContact SG-SG 2.79Å; C522-F547 CarbonylContact C-O 3.41Å; C522-F547 WeakPolarHBondContact CA-O 3.11Å
523	S	87.8	Confident	80.5	Confident	35 Å²	35	62.4 Å²	62.4	25%	0.245	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	53.4	19.7	-179	-52.2	0	0	0	0	114.4	Q520 V521 R525 F547	Q520-S523 PolarHBondContact O-N 2.77Å; V521-S523 PolarHBondContact O-N 2.92Å; V521-S523 VanDerWaalsContact O-N 3.09Å; S523-R525 PolarHBondContact O-N 2.85Å; S523-F547 VanDerWaalsContact CB-O 3.3Å; S523-F547 WeakPolarHBondContact CB-O 3.45Å; S523-F547 PolarHBondContact N-O 2.99Å; S523-F547 PolarHBondContact OG-O 3.32Å
524	G	88.3	Confident	80.5	Confident	44 Å²	44	65 Å²	65	45%	0.454	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	68.3	7.2	-173.6	0	0	0	0	0	114.9	V521 C522	V521-G524 PolarHBondContact O-N 2.9Å; C522-G524 PolarHBondContact O-N 2.88Å
525	R	89.4	Confident	80.6	Confident	74 Å²	74	61.9 Å²	61.9	28%	0.279	35%	0.347	S	S	.	.	S	Bend	trans	-114.9	22.8	-177.7	-61.7	-170.8	-63.3	-167.7	-3.4	112.6	C522 S523 C535 Y536 I543 C548 E549 D551	C522-R525 PolarHBondContact O-N 3.38Å; S523-R525 PolarHBondContact O-N 2.85Å; R525-C535 WeakPolarHBondContact O-CA 3Å; R525-Y536 PolarHBondContact O-N 2.66Å; R525-I543 HydrophobicContact CB-CD1 4.41Å; R525-I543 HydrophobicContact CB-CG2 4.11Å; R525-C548 HydrophobicContact CB-CB 4.22Å; R525-C548 PolarHBondContact NE-O 2.72Å; R525-C548 PolarHBondContact NH2-O 2.9Å; R525-E549 PolarHBondContact NH2-O 3.31Å; R525-D551 IonicContact CZ-OD2 2.71Å; R525-D551 IonicContact NH1-OD2 3.9Å; R525-D551 PolarHBondContact NH1-OD2 2.69Å
526	G	86.1	Confident	81.1	Confident	9 Å²	9	63.4 Å²	63.4	9%	0.093	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	176.4	178.2	0	0	0	0	0	112.7	L534	G526-L534 CarbonylContact C-O 3.43Å; G526-L534 WeakPolarHBondContact CA-O 2.97Å
527	E	85.7	Confident	81.3	Confident	131 Å²	131	70.7 Å²	70.7	61%	0.612	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	140.3	176	-172.4	165.2	-171.1	0	0	110.4	L534	E527-L534 PolarHBondContact N-O 2.84Å; E527-L534 PolarHBondContact O-N 3.41Å
528	C	78.9	Confident	81.7	Confident	8 Å²	8	63.2 Å²	63.2	5%	0.054	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	118.5	175.7	176	0	0	0	0	109	M508 C513 V521 Q532	M508-C528 HydrophobicContact CE-CB 4.29Å; M508-C528 WeakPolarHBondContact CE-O 3.4Å; C513-C528 HydrophobicContact CB-CB 3.45Å; C513-C528 VanDerWaalsContact CB-CB 3.45Å; C513-C528 WeakPolarHBondContact CB-SG 3.41Å; C513-C528 WeakPolarHBondContact SG-CB 3.28Å; C513-C528 CovalentContact SG-SG 2.03Å; C513-C528 PolarHBondContact SG-SG 2.89Å; V521-C528 HydrophobicContact CG1-CB 3.63Å; C528-Q532 CarbonylContact C-O 3.3Å; C528-Q532 WeakPolarHBondContact CA-O 2.69Å
529	S	73.6	Confident	82.1	Confident	11 Å²	11	68.7 Å²	68.7	8%	0.077	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.7	177.3	-175.8	0	0	0	0	109	N531 Q532	S529-N531 VanDerWaalsContact C-N 3.3Å; S529-N531 PolarHBondContact O-N 3.21Å; S529-Q532 PolarHBondContact N-O 2.66Å; S529-Q532 PolarHBondContact O-N 2.7Å
530	C	72.6	Confident	82	Confident	24 Å²	24	71.6 Å²	71.6	16%	0.162	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	43.2	-176.3	-175.5	0	0	0	0	114.1	L494 C500 Q532	L494-C530 HydrophobicContact CB-CB 4.26Å; C500-C530 HydrophobicContact CB-CB 3.33Å; C500-C530 WeakPolarHBondContact CB-SG 3.21Å; C500-C530 WeakPolarHBondContact SG-CB 3.29Å; C500-C530 CovalentContact SG-SG 2.02Å; C500-C530 PolarHBondContact SG-SG 3.03Å; C530-Q532 PolarHBondContact O-N 3.47Å; C530-Q532 VanDerWaalsContact O-N 3.09Å
531	N	73.1	Confident	81.9	Confident	63 Å²	63	66.3 Å²	66.3	34%	0.337	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	19.5	-177.8	-54.5	-45.5	0	0	0	114.6	Y509 A512 S529	Y509-N531 PolarHBondContact N-OD1 3.2Å; A512-N531 HydrophobicContact CB-CB 3.82Å; S529-N531 VanDerWaalsContact C-N 3.3Å; S529-N531 PolarHBondContact O-N 3.21Å
532	Q	71.4	Confident	81.8	Confident	92 Å²	92	71.7 Å²	71.7	43%	0.43	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	154.2	174.3	-66.2	-177.7	-12	0	0	110	C513 C528 S529 C530	C513-Q532 VanDerWaalsContact SG-C 3.6Å; C513-Q532 PolarHBondContact SG-N 3.28Å; C513-Q532 VanDerWaalsContact SG-N 3.44Å; C513-Q532 PolarHBondContact SG-O 3.18Å; C528-Q532 CarbonylContact C-O 3.3Å; C528-Q532 WeakPolarHBondContact CA-O 2.69Å; S529-Q532 PolarHBondContact N-O 2.66Å; S529-Q532 PolarHBondContact O-N 2.7Å; C530-Q532 PolarHBondContact O-N 3.47Å; C530-Q532 VanDerWaalsContact O-N 3.09Å
533	C	76.8	Confident	81.6	Confident	22 Å²	22	73 Å²	73	15%	0.149	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.1	177.4	-73.3	0	0	0	0	112	C522 S546	C522-C533 WeakPolarHBondContact CA-SG 3.48Å; C522-C533 HydrophobicContact CB-CB 3.64Å; C522-C533 WeakPolarHBondContact CB-SG 3.3Å; C522-C533 WeakPolarHBondContact SG-CA 3.35Å; C522-C533 WeakPolarHBondContact SG-CB 3.33Å; C522-C533 CovalentContact SG-SG 2.03Å; C522-C533 PolarHBondContact SG-SG 2.79Å; C533-S546 WeakPolarHBondContact CB-O 3.5Å
534	L	78.5	Confident	81	Confident	54 Å²	54	74.5 Å²	74.5	28%	0.283	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	107.1	176.3	-145.1	147.1	0	0	0	108.1	L494 E502 G526 E527	L494-L534 HydrophobicContact CD1-CD1 3.71Å; L494-L534 HydrophobicContact CD2-CD1 3.94Å; L494-L534 HydrophobicContact CG-CD1 4.36Å; E502-L534 HydrophobicContact CG-CD1 4.07Å; G526-L534 CarbonylContact C-O 3.43Å; G526-L534 WeakPolarHBondContact CA-O 2.97Å; E527-L534 PolarHBondContact N-O 2.84Å; E527-L534 PolarHBondContact O-N 3.41Å
535	C	82.5	Confident	80.2	Confident	32 Å²	32	73.4 Å²	73.4	22%	0.216	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	143.5	-170.2	-49.9	0	0	0	0	111.8	R525 I543 C548	R525-C535 WeakPolarHBondContact O-CA 3Å; C535-I543 HydrophobicContact CB-CB 4.13Å; C535-I543 HydrophobicContact CB-CG2 3.93Å; C535-I543 WeakPolarHBondContact CB-O 3Å; C535-C548 WeakPolarHBondContact CA-SG 3.4Å; C535-C548 HydrophobicContact CB-CB 3.82Å; C535-C548 WeakPolarHBondContact CB-SG 3.34Å; C535-C548 PolarHBondContact N-SG 3.22Å; C535-C548 VanDerWaalsContact N-SG 3.43Å; C535-C548 WeakPolarHBondContact SG-CA 3.49Å; C535-C548 WeakPolarHBondContact SG-CB 3.36Å; C535-C548 CovalentContact SG-SG 2.04Å; C535-C548 PolarHBondContact SG-SG 3.49Å
536	Y	86.3	Confident	79.3	Confident	130 Å²	130	74 Å²	74	51%	0.51	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-68.4	147	177.4	-61.9	-43.8	0	0	0	111.7	R525	R525-Y536 PolarHBondContact O-N 2.66Å
537	E	84.5	Confident	79.1	Confident	200 Å²	200	75.8 Å²	75.8	94%	0.935	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-68.8	146.2	170	-62.6	-171.7	160.7	0	0	110.8
538	S	84.8	Confident	79	Confident	39 Å²	39	69.6 Å²	69.6	27%	0.273	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-133.2	140.3	-179.3	169.3	0	0	0	0	109.9	F540 G541	S538-F540 PolarHBondContact O-N 2.81Å; S538-F540 PolarHBondContact OG-N 3.37Å; S538-F540 VanDerWaalsContact OG-N 3.17Å; S538-G541 WeakPolarHBondContact CB-O 3.36Å; S538-G541 VanDerWaalsContact O-O 3.11Å
539	E	86.7	Confident	79.2	Confident	193 Å²	193	72.3 Å²	72.3	90%	0.902	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.5	174.4	-62.2	-173.1	161.6	0	0	112.6
540	F	81.1	Confident	79.6	Confident	167 Å²	167	72.4 Å²	72.4	73%	0.732	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-14.6	-176.3	-58.8	-76.1	0	0	0	113.7	S538 F553	S538-F540 PolarHBondContact O-N 2.81Å; S538-F540 PolarHBondContact OG-N 3.37Å; S538-F540 VanDerWaalsContact OG-N 3.17Å; F540-F553 HydrophobicContact CB-CB 4.4Å; F540-F553 HydrophobicContact CB-CD1 4.13Å; F540-F553 HydrophobicContact CB-CD2 3.95Å; F540-F553 HydrophobicContact CB-CE1 4.39Å; F540-F553 HydrophobicContact CB-CE2 4.23Å; F540-F553 HydrophobicContact CB-CG 3.9Å; F540-F553 HydrophobicContact CB-CZ 4.44Å; F540-F553 WeakPolarHBondContact O-CB 3.39Å
541	G	83.6	Confident	80.2	Confident	26 Å²	26	71.8 Å²	71.8	27%	0.268	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	151.2	-154.6	-178.4	0	0	0	0	0	111.7	S538 D552	S538-G541 WeakPolarHBondContact CB-O 3.36Å; S538-G541 VanDerWaalsContact O-O 3.11Å; G541-D552 WeakPolarHBondContact CA-OD1 3.47Å
542	K	81.8	Confident	80.7	Confident	151 Å²	151	71.4 Å²	71.4	66%	0.657	36%	0.359	S	S	*	.			trans	-102.7	134.7	-175.2	-65.8	179.3	-178	175.8	0	111.9	D551 D552	K542-D551 VanDerWaalsContact O-CA 3.28Å; K542-D551 WeakPolarHBondContact O-CA 3.28Å; K542-D552 PolarHBondContact N-OD1 3.19Å; K542-D552 PolarHBondContact N-OD2 3.07Å; K542-D552 PolarHBondContact O-N 3.41Å
543	I	81	Confident	81.5	Confident	29 Å²	29	69.1 Å²	69.1	15%	0.149	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.6	167.5	-57.2	173.7	0	0	0	107.4	R525 C535 C548 C550 D551 F553	R525-I543 HydrophobicContact CB-CD1 4.41Å; R525-I543 HydrophobicContact CB-CG2 4.11Å; C535-I543 HydrophobicContact CB-CB 4.13Å; C535-I543 HydrophobicContact CB-CG2 3.93Å; C535-I543 WeakPolarHBondContact CB-O 3Å; I543-C548 HydrophobicContact CG2-CB 4.02Å; I543-C550 WeakPolarHBondContact CA-O 3.23Å; I543-C550 WeakPolarHBondContact CG2-O 3.48Å; I543-D551 HydrophobicContact CG1-CB 4.44Å; I543-F553 HydrophobicContact CG1-CE1 4.1Å; I543-F553 HydrophobicContact CG1-CZ 4.08Å
544	Y	74.6	Confident	82.1	Confident	65 Å²	65	71.4 Å²	71.4	26%	0.255	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	-178.3	-174.7	66.1	-88.4	0	0	0	111.6	C548 E549 C550 D552 H570 C571	Y544-C548 CarbonylContact O-C 3.59Å; Y544-C548 WeakPolarHBondContact O-CA 3.25Å; Y544-E549 PolarHBondContact O-N 2.9Å; Y544-C550 HydrophobicContact CD1-CB 4.39Å; Y544-C550 HydrophobicContact CD2-CB 3.83Å; Y544-C550 HydrophobicContact CE1-CB 4.14Å; Y544-C550 HydrophobicContact CE2-CB 3.51Å; Y544-C550 HydrophobicContact CG-CB 4.26Å; Y544-C550 PolarHBondContact N-O 3.31Å; Y544-C550 WeakPolarHBondContact O-CA 3.26Å; Y544-C550 WeakPolarHBondContact O-CB 2.97Å; Y544-C550 PolarHBondContact O-N 3.4Å; Y544-C550 VanDerWaalsContact O-O 3.09Å; Y544-D552 HydrophobicContact CE1-CB 4.34Å; Y544-H570 WeakPolarHBondContact OH-CA 3.43Å; Y544-C571 PolarHBondContact OH-N 3.39Å
545	G	71	Confident	82.7	Confident	21 Å²	21	69.2 Å²	69.2	22%	0.216	35%	0.353	C	S	.	.	S	Bend	trans	107.7	159	-175.4	0	0	0	0	0	111.7	F547 C548 E549	G545-F547 PolarHBondContact O-N 2.99Å; G545-F547 VanDerWaalsContact O-N 3.13Å; G545-C548 PolarHBondContact O-N 2.7Å; G545-E549 WeakPolarHBondContact CA-OE2 3.42Å
546	S	71	Confident	83	Confident	86 Å²	86	70 Å²	70	60%	0.601	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.9	-176.5	-63.1	0	0	0	0	112.9	C533 E549	C533-S546 WeakPolarHBondContact CB-O 3.5Å; S546-E549 PolarHBondContact N-OE2 2.91Å
547	F	81.5	Confident	83.2	Confident	48 Å²	48	71 Å²	71	21%	0.211	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	21.6	177.8	-51.6	-71.3	0	0	0	112.3	A512 C513 E515 C522 S523 G545 E549	A512-F547 WeakPolarHBondContact O-CE1 3.39Å; C513-F547 VanDerWaalsContact C-CD1 3.42Å; E515-F547 HydrophobicContact CB-CD2 3.9Å; E515-F547 HydrophobicContact CB-CE2 4.19Å; E515-F547 HydrophobicContact CB-CG 4.15Å; E515-F547 HydrophobicContact CG-CD2 4.18Å; E515-F547 HydrophobicContact CG-CE2 4.36Å; C522-F547 CarbonylContact C-O 3.41Å; C522-F547 WeakPolarHBondContact CA-O 3.11Å; S523-F547 VanDerWaalsContact CB-O 3.3Å; S523-F547 WeakPolarHBondContact CB-O 3.45Å; S523-F547 PolarHBondContact N-O 2.99Å; S523-F547 PolarHBondContact OG-O 3.32Å; G545-F547 PolarHBondContact O-N 2.99Å; G545-F547 VanDerWaalsContact O-N 3.13Å; F547-E549 WeakPolarHBondContact CA-OE2 3.4Å; F547-E549 WeakPolarHBondContact CB-OE2 3.29Å; F547-E549 PolarHBondContact N-OE2 3.1Å; F547-E549 PolarHBondContact O-N 3.34Å
548	C	83.3	Confident	83.4	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	52.3	35.3	-175.9	-52.6	0	0	0	0	113.7	R525 C535 I543 Y544 G545	R525-C548 HydrophobicContact CB-CB 4.22Å; R525-C548 PolarHBondContact NE-O 2.72Å; R525-C548 PolarHBondContact NH2-O 2.9Å; C535-C548 WeakPolarHBondContact CA-SG 3.4Å; C535-C548 HydrophobicContact CB-CB 3.82Å; C535-C548 WeakPolarHBondContact CB-SG 3.34Å; C535-C548 PolarHBondContact N-SG 3.22Å; C535-C548 VanDerWaalsContact N-SG 3.43Å; C535-C548 WeakPolarHBondContact SG-CA 3.49Å; C535-C548 WeakPolarHBondContact SG-CB 3.36Å; C535-C548 CovalentContact SG-SG 2.04Å; C535-C548 PolarHBondContact SG-SG 3.49Å; I543-C548 HydrophobicContact CG2-CB 4.02Å; Y544-C548 CarbonylContact O-C 3.59Å; Y544-C548 WeakPolarHBondContact O-CA 3.25Å; G545-C548 PolarHBondContact O-N 2.7Å
549	E	82.6	Confident	83.4	Confident	65 Å²	65	71.9 Å²	71.9	30%	0.304	36%	0.361	S	S	.	.			trans	-86.9	-11.8	-176.1	73.2	-80.8	-162	0	0	113.1	R525 Y544 G545 S546 F547	R525-E549 PolarHBondContact NH2-O 3.31Å; Y544-E549 PolarHBondContact O-N 2.9Å; G545-E549 WeakPolarHBondContact CA-OE2 3.42Å; S546-E549 PolarHBondContact N-OE2 2.91Å; F547-E549 WeakPolarHBondContact CA-OE2 3.4Å; F547-E549 WeakPolarHBondContact CB-OE2 3.29Å; F547-E549 PolarHBondContact N-OE2 3.1Å; F547-E549 PolarHBondContact O-N 3.34Å
550	C	83.8	Confident	83.4	Confident	14 Å²	14	65.1 Å²	65.1	10%	0.095	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	156.2	-178.4	-64.3	0	0	0	0	113.2	I543 Y544 C571	I543-C550 WeakPolarHBondContact CA-O 3.23Å; I543-C550 WeakPolarHBondContact CG2-O 3.48Å; Y544-C550 HydrophobicContact CD1-CB 4.39Å; Y544-C550 HydrophobicContact CD2-CB 3.83Å; Y544-C550 HydrophobicContact CE1-CB 4.14Å; Y544-C550 HydrophobicContact CE2-CB 3.51Å; Y544-C550 HydrophobicContact CG-CB 4.26Å; Y544-C550 PolarHBondContact N-O 3.31Å; Y544-C550 WeakPolarHBondContact O-CA 3.26Å; Y544-C550 WeakPolarHBondContact O-CB 2.97Å; Y544-C550 PolarHBondContact O-N 3.4Å; Y544-C550 VanDerWaalsContact O-O 3.09Å; C550-C571 WeakPolarHBondContact CA-SG 3.27Å; C550-C571 HydrophobicContact CB-CB 3.56Å; C550-C571 WeakPolarHBondContact CB-SG 3.3Å; C550-C571 WeakPolarHBondContact SG-CB 3.34Å; C550-C571 CovalentContact SG-SG 2.04Å; C550-C571 PolarHBondContact SG-SG 2.98Å
551	D	84.6	Confident	83.7	Confident	10 Å²	10	60.9 Å²	60.9	5%	0.053	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	164.2	170.8	61.2	81.8	0	0	0	110.4	R525 K542 I543 F553 S554 C571	R525-D551 IonicContact CZ-OD2 2.71Å; R525-D551 IonicContact NH1-OD2 3.9Å; R525-D551 PolarHBondContact NH1-OD2 2.69Å; K542-D551 VanDerWaalsContact O-CA 3.28Å; K542-D551 WeakPolarHBondContact O-CA 3.28Å; I543-D551 HydrophobicContact CG1-CB 4.44Å; D551-F553 HydrophobicContact CB-CD1 4.07Å; D551-F553 HydrophobicContact CB-CE1 3.68Å; D551-F553 HydrophobicContact CB-CE2 4.23Å; D551-F553 HydrophobicContact CB-CZ 3.76Å; D551-F553 PolarHBondContact OD1-N 2.78Å; D551-S554 VanDerWaalsContact CG-OG 3.24Å; D551-S554 WeakPolarHBondContact OD1-CA 3.49Å; D551-S554 WeakPolarHBondContact OD1-CB 3.38Å; D551-S554 PolarHBondContact OD1-N 2.9Å; D551-S554 PolarHBondContact OD1-OG 3.33Å; D551-S554 PolarHBondContact OD2-OG 2.88Å; D551-C571 PolarHBondContact O-N 3.16Å
552	D	82.7	Confident	84.1	Confident	56 Å²	56	61.7 Å²	61.7	30%	0.299	33%	0.329	S	S	.	.	S	Bend	trans	-104.7	14.3	-178.1	65.4	0.1	0	0	0	113.6	G541 K542 Y544 L562 C569	G541-D552 WeakPolarHBondContact CA-OD1 3.47Å; K542-D552 PolarHBondContact N-OD1 3.19Å; K542-D552 PolarHBondContact N-OD2 3.07Å; K542-D552 PolarHBondContact O-N 3.41Å; Y544-D552 HydrophobicContact CE1-CB 4.34Å; D552-L562 WeakPolarHBondContact O-CD2 3.31Å; D552-C569 WeakPolarHBondContact CA-O 2.99Å; D552-C569 WeakPolarHBondContact O-CB 3.4Å
553	F	88.9	Confident	84.4	Confident	43 Å²	43	54.5 Å²	54.5	19%	0.189	30%	0.297	C	S	.	.	S	Bend	trans	-130.3	-10.1	-173.6	53.9	-101.4	0	0	0	115.6	F540 I543 D551	F540-F553 HydrophobicContact CB-CB 4.4Å; F540-F553 HydrophobicContact CB-CD1 4.13Å; F540-F553 HydrophobicContact CB-CD2 3.95Å; F540-F553 HydrophobicContact CB-CE1 4.39Å; F540-F553 HydrophobicContact CB-CE2 4.23Å; F540-F553 HydrophobicContact CB-CG 3.9Å; F540-F553 HydrophobicContact CB-CZ 4.44Å; F540-F553 WeakPolarHBondContact O-CB 3.39Å; I543-F553 HydrophobicContact CG1-CE1 4.1Å; I543-F553 HydrophobicContact CG1-CZ 4.08Å; D551-F553 HydrophobicContact CB-CD1 4.07Å; D551-F553 HydrophobicContact CB-CE1 3.68Å; D551-F553 HydrophobicContact CB-CE2 4.23Å; D551-F553 HydrophobicContact CB-CZ 3.76Å; D551-F553 PolarHBondContact OD1-N 2.78Å
554	S	90.1	Very high	84.8	Confident	70 Å²	70	54 Å²	54	49%	0.49	30%	0.297	S	S	.	.			trans	-92.1	11.2	-176.1	-54	0	0	0	0	115.2	D551	D551-S554 VanDerWaalsContact CG-OG 3.24Å; D551-S554 WeakPolarHBondContact OD1-CA 3.49Å; D551-S554 WeakPolarHBondContact OD1-CB 3.38Å; D551-S554 PolarHBondContact OD1-N 2.9Å; D551-S554 PolarHBondContact OD1-OG 3.33Å; D551-S554 PolarHBondContact OD2-OG 2.88Å
555	C	90.4	Very high	85.3	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.061	31%	0.307	C	S	.	.	S	Bend	trans	-77.1	170.9	179.5	-58.5	0	0	0	0	114	L562 C569 G572 E573 C574	C555-L562 HydrophobicContact CB-CD1 3.91Å; C555-L562 VanDerWaalsContact O-CD1 3.24Å; C555-L562 WeakPolarHBondContact O-CD1 3.35Å; C555-C569 HydrophobicContact CB-CB 3.65Å; C555-C569 WeakPolarHBondContact CB-SG 3.37Å; C555-C569 PolarHBondContact N-SG 2.97Å; C555-C569 WeakPolarHBondContact SG-CA 3.35Å; C555-C569 WeakPolarHBondContact SG-CB 3.49Å; C555-C569 CovalentContact SG-SG 2.02Å; C555-C569 PolarHBondContact SG-SG 3.33Å; C555-G572 VanDerWaalsContact SG-CA 3.59Å; C555-E573 PolarHBondContact SG-N 3Å; C555-E573 VanDerWaalsContact SG-N 3.4Å; C555-E573 PolarHBondContact SG-O 3.38Å; C555-E573 VanDerWaalsContact SG-O 3.34Å; C555-C574 VanDerWaalsContact CB-SG 3.56Å
556	A	89.8	Confident	85.8	Confident	47 Å²	47	55.5 Å²	55.5	39%	0.388	31%	0.313	S	S	.	.			trans	-61	143.2	179.9	0	0	0	0	0	112.8	C563 N584	A556-C563 PolarHBondContact O-N 3.41Å; A556-N584 HydrophobicContact CB-CB 4Å
557	R	90.6	Very high	86.2	Confident	151 Å²	151	52 Å²	52	57%	0.57	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	140	176.7	-67.6	177.8	179.2	-110.8	0.3	110.8	G560 V561 L562	R557-G560 PolarHBondContact NH1-O 3.4Å; R557-G560 VanDerWaalsContact NH1-O 3.09Å; R557-V561 VanDerWaalsContact CA-O 3.26Å; R557-V561 WeakPolarHBondContact CA-O 3.34Å; R557-L562 HydrophobicContact CG-CB 4.48Å; R557-L562 HydrophobicContact CG-CD1 4.05Å
558	H	87.2	Confident	86.2	Confident	68 Å²	68	55 Å²	55	32%	0.315	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.3	170.5	-178.6	-108	0	0	0	108.8	G560 V561 S564	H558-G560 PolarHBondContact O-N 2.73Å; H558-G560 VanDerWaalsContact O-N 3.12Å; H558-V561 PolarHBondContact N-O 3.46Å; H558-V561 PolarHBondContact O-N 3Å; H558-V561 VanDerWaalsContact O-N 3.07Å; H558-S564 VanDerWaalsContact CB-OG 3.29Å; H558-S564 WeakPolarHBondContact CB-OG 3.47Å
559	K	86.2	Confident	86.1	Confident	191 Å²	191	55.5 Å²	55.5	83%	0.83	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	34.4	-173.1	-60.8	179.8	176.4	179.5	0	113.5	V561	K559-V561 VanDerWaalsContact C-N 3.33Å; K559-V561 PolarHBondContact O-N 2.88Å
560	G	85.2	Confident	85.9	Confident	51 Å²	51	55.8 Å²	55.8	53%	0.526	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	-12.2	178.6	0	0	0	0	0	115.9	R557 H558	R557-G560 PolarHBondContact NH1-O 3.4Å; R557-G560 VanDerWaalsContact NH1-O 3.09Å; H558-G560 PolarHBondContact O-N 2.73Å; H558-G560 VanDerWaalsContact O-N 3.12Å
561	V	88.8	Confident	85.8	Confident	78 Å²	78	58 Å²	58	47%	0.473	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.9	-178.7	-170.6	0	0	0	0	110.4	R557 H558 K559 C563 S564 G565	R557-V561 VanDerWaalsContact CA-O 3.26Å; R557-V561 WeakPolarHBondContact CA-O 3.34Å; H558-V561 PolarHBondContact N-O 3.46Å; H558-V561 PolarHBondContact O-N 3Å; H558-V561 VanDerWaalsContact O-N 3.07Å; K559-V561 VanDerWaalsContact C-N 3.33Å; K559-V561 PolarHBondContact O-N 2.88Å; V561-C563 PolarHBondContact O-N 3.5Å; V561-S564 PolarHBondContact O-N 3.3Å; V561-G565 VanDerWaalsContact CG1-N 3.35Å
562	L	90.1	Very high	85.6	Confident	42 Å²	42	59.4 Å²	59.4	22%	0.22	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	128.1	176	-167.6	70.8	0	0	0	109.8	D552 C555 R557 S564 G565 C569	D552-L562 WeakPolarHBondContact O-CD2 3.31Å; C555-L562 HydrophobicContact CB-CD1 3.91Å; C555-L562 VanDerWaalsContact O-CD1 3.24Å; C555-L562 WeakPolarHBondContact O-CD1 3.35Å; R557-L562 HydrophobicContact CG-CB 4.48Å; R557-L562 HydrophobicContact CG-CD1 4.05Å; L562-S564 PolarHBondContact O-N 3.32Å; L562-G565 PolarHBondContact O-N 3.27Å; L562-C569 HydrophobicContact CD2-CB 3.73Å; L562-C569 HydrophobicContact CG-CB 4.24Å
563	C	88.4	Confident	85.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	50.1	32	-177.3	-54	0	0	0	0	114	A556 V561 G565 H566 G567 C574 N584	A556-C563 PolarHBondContact O-N 3.41Å; V561-C563 PolarHBondContact O-N 3.5Å; C563-G565 PolarHBondContact O-N 2.02Å; C563-H566 PolarHBondContact O-N 2.92Å; C563-G567 WeakPolarHBondContact CB-O 3.38Å; C563-G567 PolarHBondContact O-N 3.31Å; C563-C574 WeakPolarHBondContact CA-SG 3.49Å; C563-C574 HydrophobicContact CB-CB 3.68Å; C563-C574 WeakPolarHBondContact CB-SG 3.48Å; C563-C574 WeakPolarHBondContact SG-CA 3.49Å; C563-C574 WeakPolarHBondContact SG-CB 3.42Å; C563-C574 CovalentContact SG-SG 2.04Å; C563-C574 PolarHBondContact SG-SG 3.07Å; C563-N584 CarbonylContact C-O 3.51Å; C563-N584 WeakPolarHBondContact CA-O 3.39Å
564	S	89.7	Confident	85.4	Confident	19 Å²	19	61.1 Å²	61.1	13%	0.133	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	56.3	12.7	-175.6	-51.2	0	0	0	0	115.2	H558 V561 L562 H566 N584 N586	H558-S564 VanDerWaalsContact CB-OG 3.29Å; H558-S564 WeakPolarHBondContact CB-OG 3.47Å; V561-S564 PolarHBondContact O-N 3.3Å; L562-S564 PolarHBondContact O-N 3.32Å; S564-H566 PolarHBondContact O-CD2 3.34Å; S564-H566 PolarHBondContact O-N 2.62Å; S564-N584 WeakPolarHBondContact CB-O 3.45Å; S564-N584 PolarHBondContact N-O 2.78Å; S564-N584 PolarHBondContact OG-O 2.71Å; S564-N586 WeakPolarHBondContact OG-CB 3.22Å
565	G	84.8	Confident	85	Confident	46 Å²	46	62.8 Å²	62.8	47%	0.474	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	70.6	13.3	-170.1	0	0	0	0	0	113.5	V561 L562 C563	V561-G565 VanDerWaalsContact CG1-N 3.35Å; L562-G565 PolarHBondContact O-N 3.27Å; C563-G565 PolarHBondContact O-N 2.02Å
566	H	82	Confident	84.2	Confident	72 Å²	72	64.3 Å²	64.3	33%	0.333	36%	0.359	S	S	.	.	S	Bend	trans	-124.5	25.8	-176.2	-60.1	-40.4	0	0	0	111.9	C563 S564 C576 H577 F580 C585	C563-H566 PolarHBondContact O-N 2.92Å; S564-H566 PolarHBondContact O-CD2 3.34Å; S564-H566 PolarHBondContact O-N 2.62Å; H566-C576 WeakPolarHBondContact O-CA 3.04Å; H566-H577 VanDerWaalsContact CA-CD2 3.44Å; H566-H577 WeakPolarHBondContact CA-CD2 3.27Å; H566-H577 PolarHBondContact O-CD2 2.86Å; H566-H577 PolarHBondContact O-N 3.3Å; H566-F580 HydrophobicContact CB-CB 4.19Å; H566-F580 HydrophobicContact CB-CD1 3.85Å; H566-F580 HydrophobicContact CB-CD2 3.86Å; H566-F580 HydrophobicContact CB-CE1 4.16Å; H566-F580 HydrophobicContact CB-CE2 4.18Å; H566-F580 HydrophobicContact CB-CG 3.69Å; H566-F580 HydrophobicContact CB-CZ 4.32Å; H566-F580 AromaticContact CD2-CD1 3.69Å; H566-F580 AromaticContact CD2-CE1 3.33Å; H566-F580 WeakPolarHBondContact CD2-CE1 3.39Å; H566-F580 AromaticContact CD2-CZ 3.75Å; H566-F580 AromaticContact CE1-CZ 3.86Å; H566-F580 AromaticContact CG-CD1 3.84Å; H566-F580 AromaticContact CG-CE1 3.64Å; H566-F580 AromaticContact CG-CE2 3.97Å; H566-F580 AromaticContact CG-CZ 3.71Å; H566-F580 AromaticContact ND1-CZ 3.78Å; H566-F580 AromaticContact NE2-CE1 3.7Å; H566-F580 AromaticContact NE2-CZ 3.86Å; H566-C585 HydrophobicContact CB-CB 4.11Å; H566-C585 WeakPolarHBondContact CB-O 3.49Å; H566-C585 WeakPolarHBondContact O-CB 3.42Å
567	G	79.6	Confident	83.3	Confident	13 Å²	13	65.3 Å²	65.3	13%	0.134	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	160.8	176	0	0	0	0	0	111.6	C563 K575 H577	C563-G567 WeakPolarHBondContact CB-O 3.38Å; C563-G567 PolarHBondContact O-N 3.31Å; G567-K575 CarbonylContact C-O 3.27Å; G567-K575 WeakPolarHBondContact CA-O 3.4Å; G567-H577 PolarHBondContact N-CD2 2.76Å; G567-H577 VanDerWaalsContact N-CD2 3.32Å; G567-H577 PolarHBondContact N-NE2 2.99Å
568	E	80.9	Confident	81.7	Confident	110 Å²	110	59.9 Å²	59.9	51%	0.514	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.3	172.3	-60.5	-171.5	169.5	0	0	110	H570 K575	E568-H570 WeakPolarHBondContact CB-NE2 3.22Å; E568-H570 PolarHBondContact O-N 3.03Å; E568-H570 IonicContact OE2-CE1 2.79Å; E568-H570 IonicContact OE2-NE2 3.16Å; E568-H570 PolarHBondContact OE2-NE2 3.1Å; E568-K575 PolarHBondContact N-O 2.93Å; E568-K575 PolarHBondContact O-N 3.16Å
569	C	82.6	Confident	80.4	Confident	10 Å²	10	57.6 Å²	57.6	7%	0.068	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	119.4	175.3	177.7	0	0	0	0	110	D552 C555 L562	D552-C569 WeakPolarHBondContact CA-O 2.99Å; D552-C569 WeakPolarHBondContact O-CB 3.4Å; C555-C569 HydrophobicContact CB-CB 3.65Å; C555-C569 WeakPolarHBondContact CB-SG 3.37Å; C555-C569 PolarHBondContact N-SG 2.97Å; C555-C569 WeakPolarHBondContact SG-CA 3.35Å; C555-C569 WeakPolarHBondContact SG-CB 3.49Å; C555-C569 CovalentContact SG-SG 2.02Å; C555-C569 PolarHBondContact SG-SG 3.33Å; L562-C569 HydrophobicContact CD2-CB 3.73Å; L562-C569 HydrophobicContact CG-CB 4.24Å
570	H	78.8	Confident	79.8	Confident	72 Å²	72	50.4 Å²	50.4	33%	0.333	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	107	175.9	-70.3	-85.4	0	0	0	109.7	Y544 E568 G572 E573 K575	Y544-H570 WeakPolarHBondContact OH-CA 3.43Å; E568-H570 WeakPolarHBondContact CB-NE2 3.22Å; E568-H570 PolarHBondContact O-N 3.03Å; E568-H570 IonicContact OE2-CE1 2.79Å; E568-H570 IonicContact OE2-NE2 3.16Å; E568-H570 PolarHBondContact OE2-NE2 3.1Å; H570-G572 VanDerWaalsContact C-N 3.33Å; H570-G572 PolarHBondContact O-N 3.28Å; H570-E573 PolarHBondContact N-O 2.88Å; H570-E573 PolarHBondContact O-N 2.88Å; H570-E573 VanDerWaalsContact O-N 3.1Å; H570-K575 HydrophobicContact CB-CG 3.89Å
571	C	80.6	Confident	79.4	Confident	59 Å²	59	51.4 Å²	51.4	40%	0.399	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	42	172.7	-150.6	0	0	0	0	113.9	Y544 C550 D551 E573	Y544-C571 PolarHBondContact OH-N 3.39Å; C550-C571 WeakPolarHBondContact CA-SG 3.27Å; C550-C571 HydrophobicContact CB-CB 3.56Å; C550-C571 WeakPolarHBondContact CB-SG 3.3Å; C550-C571 WeakPolarHBondContact SG-CB 3.34Å; C550-C571 CovalentContact SG-SG 2.04Å; C550-C571 PolarHBondContact SG-SG 2.98Å; D551-C571 PolarHBondContact O-N 3.16Å; C571-E573 VanDerWaalsContact C-N 3.33Å; C571-E573 PolarHBondContact O-N 3.35Å
572	G	80.8	Confident	79.1	Confident	40 Å²	40	49.6 Å²	49.6	41%	0.412	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-4.2	179.8	0	0	0	0	0	115.3	C555 H570	C555-G572 VanDerWaalsContact SG-CA 3.59Å; H570-G572 VanDerWaalsContact C-N 3.33Å; H570-G572 PolarHBondContact O-N 3.28Å
573	E	83.8	Confident	78.9	Confident	119 Å²	119	54.8 Å²	54.8	56%	0.556	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	135	173.2	-67.8	-175.4	174.2	0	0	112	C555 H570 C571 K575	C555-E573 PolarHBondContact SG-N 3Å; C555-E573 VanDerWaalsContact SG-N 3.4Å; C555-E573 PolarHBondContact SG-O 3.38Å; C555-E573 VanDerWaalsContact SG-O 3.34Å; H570-E573 PolarHBondContact N-O 2.88Å; H570-E573 PolarHBondContact O-N 2.88Å; H570-E573 VanDerWaalsContact O-N 3.1Å; C571-E573 VanDerWaalsContact C-N 3.33Å; C571-E573 PolarHBondContact O-N 3.35Å; E573-K575 PolarHBondContact O-N 3.37Å; E573-K575 IonicContact OE2-NZ 2.89Å; E573-K575 PolarHBondContact OE2-NZ 2.83Å
574	C	82.8	Confident	78.9	Confident	17 Å²	17	56.3 Å²	56.3	12%	0.115	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	112	170	-71.6	0	0	0	0	110.2	C555 C563 C576 D583 C585	C555-C574 VanDerWaalsContact CB-SG 3.56Å; C563-C574 WeakPolarHBondContact CA-SG 3.49Å; C563-C574 HydrophobicContact CB-CB 3.68Å; C563-C574 WeakPolarHBondContact CB-SG 3.48Å; C563-C574 WeakPolarHBondContact SG-CA 3.49Å; C563-C574 WeakPolarHBondContact SG-CB 3.42Å; C563-C574 CovalentContact SG-SG 2.04Å; C563-C574 PolarHBondContact SG-SG 3.07Å; C574-C576 PolarHBondContact O-N 2.87Å; C574-D583 WeakPolarHBondContact CB-O 3.37Å; C574-C585 VanDerWaalsContact CB-SG 3.54Å
575	K	81.4	Confident	78.7	Confident	104 Å²	104	55.4 Å²	55.4	45%	0.452	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	96.1	167.7	-57.5	-55.3	-176.2	-166.3	0	107.9	G567 E568 H570 E573	G567-K575 CarbonylContact C-O 3.27Å; G567-K575 WeakPolarHBondContact CA-O 3.4Å; E568-K575 PolarHBondContact N-O 2.93Å; E568-K575 PolarHBondContact O-N 3.16Å; H570-K575 HydrophobicContact CB-CG 3.89Å; E573-K575 PolarHBondContact O-N 3.37Å; E573-K575 IonicContact OE2-NZ 2.89Å; E573-K575 PolarHBondContact OE2-NZ 2.83Å
576	C	74.4	Confident	78.9	Confident	42 Å²	42	56.8 Å²	56.8	28%	0.284	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	138.2	-177.5	-54.4	0	0	0	0	111.6	H566 C574 F580 G582 C585	H566-C576 WeakPolarHBondContact O-CA 3.04Å; C574-C576 PolarHBondContact O-N 2.87Å; C576-F580 HydrophobicContact CB-CB 4.2Å; C576-F580 WeakPolarHBondContact CB-O 3.28Å; C576-G582 PolarHBondContact SG-O 3.02Å; C576-C585 WeakPolarHBondContact CA-SG 3.3Å; C576-C585 HydrophobicContact CB-CB 3.66Å; C576-C585 WeakPolarHBondContact CB-SG 3.49Å; C576-C585 PolarHBondContact N-SG 2.78Å; C576-C585 WeakPolarHBondContact SG-CA 3.23Å; C576-C585 WeakPolarHBondContact SG-CB 3.29Å; C576-C585 CovalentContact SG-SG 2.03Å; C576-C585 PolarHBondContact SG-SG 3.37Å
577	H	70.9	Confident	78.9	Confident	68 Å²	68	54.3 Å²	54.3	32%	0.315	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-60.8	148.6	167.6	-56.3	-38.2	0	0	0	109.1	H566 G567 G579 F580	H566-H577 VanDerWaalsContact CA-CD2 3.44Å; H566-H577 WeakPolarHBondContact CA-CD2 3.27Å; H566-H577 PolarHBondContact O-CD2 2.86Å; H566-H577 PolarHBondContact O-N 3.3Å; G567-H577 PolarHBondContact N-CD2 2.76Å; G567-H577 VanDerWaalsContact N-CD2 3.32Å; G567-H577 PolarHBondContact N-NE2 2.99Å; H577-G579 PolarHBondContact O-N 3.4Å; H577-F580 PolarHBondContact O-N 2.98Å
578	A	57.2	Low	78.9	Confident	36 Å²	36	55 Å²	55	30%	0.298	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	128.9	178.2	0	0	0	0	0	110.7	N394 R431	N394-A578 PolarHBondContact ND2-O 2.92Å; R431-A578 HydrophobicContact CG-CB 4.48Å
579	G	59.9	Low	78.3	Confident	21 Å²	21	53.2 Å²	53.2	22%	0.216	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	104	-6	-171.6	0	0	0	0	0	114.2	H577 S588 T589	H577-G579 PolarHBondContact O-N 3.4Å; G579-S588 CarbonylContact O-C 3.48Å; G579-S588 WeakPolarHBondContact O-CA 3.46Å; G579-T589 VanDerWaalsContact CA-OG1 3.22Å; G579-T589 WeakPolarHBondContact CA-OG1 3.21Å; G579-T589 PolarHBondContact O-N 2.65Å; G579-T589 PolarHBondContact O-OG1 2.7Å
580	F	73.5	Confident	77.7	Confident	40 Å²	40	58 Å²	58	18%	0.175	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.3	179.2	-65.6	-92	0	0	0	112	H566 C576 H577 C585 C587	H566-F580 HydrophobicContact CB-CB 4.19Å; H566-F580 HydrophobicContact CB-CD1 3.85Å; H566-F580 HydrophobicContact CB-CD2 3.86Å; H566-F580 HydrophobicContact CB-CE1 4.16Å; H566-F580 HydrophobicContact CB-CE2 4.18Å; H566-F580 HydrophobicContact CB-CG 3.69Å; H566-F580 HydrophobicContact CB-CZ 4.32Å; H566-F580 AromaticContact CD2-CD1 3.69Å; H566-F580 AromaticContact CD2-CE1 3.33Å; H566-F580 WeakPolarHBondContact CD2-CE1 3.39Å; H566-F580 AromaticContact CD2-CZ 3.75Å; H566-F580 AromaticContact CE1-CZ 3.86Å; H566-F580 AromaticContact CG-CD1 3.84Å; H566-F580 AromaticContact CG-CE1 3.64Å; H566-F580 AromaticContact CG-CE2 3.97Å; H566-F580 AromaticContact CG-CZ 3.71Å; H566-F580 AromaticContact ND1-CZ 3.78Å; H566-F580 AromaticContact NE2-CE1 3.7Å; H566-F580 AromaticContact NE2-CZ 3.86Å; C576-F580 HydrophobicContact CB-CB 4.2Å; C576-F580 WeakPolarHBondContact CB-O 3.28Å; H577-F580 PolarHBondContact O-N 2.98Å; F580-C585 HydrophobicContact CB-CB 4.27Å; F580-C585 WeakPolarHBondContact CD1-O 3.41Å; F580-C587 CarbonylContact C-O 3.56Å; F580-C587 VanDerWaalsContact CA-O 3.25Å; F580-C587 WeakPolarHBondContact CA-O 3.36Å
581	V	77.1	Confident	77.5	Confident	71 Å²	71	57.3 Å²	57.3	43%	0.43	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	170.6	-179.4	-68.2	0	0	0	0	111.3	C587 T589	V581-C587 HydrophobicContact CG2-CB 3.94Å; V581-C587 PolarHBondContact N-O 3.25Å; V581-C587 WeakPolarHBondContact O-CB 3.31Å; V581-C587 PolarHBondContact O-N 2.92Å; V581-T589 HydrophobicContact CB-CG2 4.21Å; V581-T589 HydrophobicContact CG1-CG2 3.43Å; V581-T589 VanDerWaalsContact CG1-CG2 3.43Å; V581-T589 HydrophobicContact CG2-CG2 3.84Å
582	G	81.5	Confident	76.8	Confident	41 Å²	41	57 Å²	57	42%	0.423	34%	0.336	S	S	.	.	S	Bend	trans	93.6	160.8	-178.1	0	0	0	0	0	112.6	C576 N584 C585	C576-G582 PolarHBondContact SG-O 3.02Å; G582-N584 PolarHBondContact O-N 2.9Å; G582-C585 PolarHBondContact O-N 2.72Å
583	D	85.4	Confident	76.4	Confident	151 Å²	151	61.1 Å²	61.1	81%	0.807	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.7	-170.2	-55.2	-26.5	0	0	0	114.2	C574	C574-D583 WeakPolarHBondContact CB-O 3.37Å
584	N	89	Confident	76.2	Confident	31 Å²	31	55.5 Å²	55.5	17%	0.166	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	10.4	177.7	64.9	4.5	0	0	0	113.1	A556 C563 S564 G582 N586	A556-N584 HydrophobicContact CB-CB 4Å; C563-N584 CarbonylContact C-O 3.51Å; C563-N584 WeakPolarHBondContact CA-O 3.39Å; S564-N584 WeakPolarHBondContact CB-O 3.45Å; S564-N584 PolarHBondContact N-O 2.78Å; S564-N584 PolarHBondContact OG-O 2.71Å; G582-N584 PolarHBondContact O-N 2.9Å; N584-N586 PolarHBondContact O-N 3.27Å; N584-N586 VanDerWaalsContact OD1-CB 3.31Å; N584-N586 WeakPolarHBondContact OD1-CB 3.21Å; N584-N586 PolarHBondContact OD1-N 2.84Å; N584-N586 PolarHBondContact OD1-OD1 2.76Å; N584-N586 VanDerWaalsContact OD1-OD1 3.07Å
585	C	85.3	Confident	75.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.329	C	S	.	.	S	Bend	trans	55.9	29.6	179.8	-46.3	0	0	0	0	115.2	H566 C574 C576 F580 G582	H566-C585 HydrophobicContact CB-CB 4.11Å; H566-C585 WeakPolarHBondContact CB-O 3.49Å; H566-C585 WeakPolarHBondContact O-CB 3.42Å; C574-C585 VanDerWaalsContact CB-SG 3.54Å; C576-C585 WeakPolarHBondContact CA-SG 3.3Å; C576-C585 HydrophobicContact CB-CB 3.66Å; C576-C585 WeakPolarHBondContact CB-SG 3.49Å; C576-C585 PolarHBondContact N-SG 2.78Å; C576-C585 WeakPolarHBondContact SG-CA 3.23Å; C576-C585 WeakPolarHBondContact SG-CB 3.29Å; C576-C585 CovalentContact SG-SG 2.03Å; C576-C585 PolarHBondContact SG-SG 3.37Å; F580-C585 HydrophobicContact CB-CB 4.27Å; F580-C585 WeakPolarHBondContact CD1-O 3.41Å; G582-C585 PolarHBondContact O-N 2.72Å
586	N	89.8	Confident	75.4	Confident	76 Å²	76	53.1 Å²	53.1	41%	0.406	31%	0.311	S	S	.	.			trans	-83.4	-13.2	-179.5	73.4	-13.3	0	0	0	114	S564 N584	S564-N586 WeakPolarHBondContact OG-CB 3.22Å; N584-N586 PolarHBondContact O-N 3.27Å; N584-N586 VanDerWaalsContact OD1-CB 3.31Å; N584-N586 WeakPolarHBondContact OD1-CB 3.21Å; N584-N586 PolarHBondContact OD1-N 2.84Å; N584-N586 PolarHBondContact OD1-OD1 2.76Å; N584-N586 VanDerWaalsContact OD1-OD1 3.07Å
587	C	82.7	Confident	74.6	Confident	19 Å²	19	57.8 Å²	57.8	13%	0.128	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.4	-168.9	-176.2	0	0	0	0	109.9	F580 V581 C610	F580-C587 CarbonylContact C-O 3.56Å; F580-C587 VanDerWaalsContact CA-O 3.25Å; F580-C587 WeakPolarHBondContact CA-O 3.36Å; V581-C587 HydrophobicContact CG2-CB 3.94Å; V581-C587 PolarHBondContact N-O 3.25Å; V581-C587 WeakPolarHBondContact O-CB 3.31Å; V581-C587 PolarHBondContact O-N 2.92Å; C587-C610 HydrophobicContact CB-CB 3.94Å; C587-C610 WeakPolarHBondContact CB-SG 3.36Å; C587-C610 WeakPolarHBondContact SG-CA 3.47Å; C587-C610 WeakPolarHBondContact SG-CB 3.42Å; C587-C610 CovalentContact SG-SG 2.03Å; C587-C610 PolarHBondContact SG-SG 2.83Å
588	S	78.1	Confident	74	Confident	29 Å²	29	61 Å²	61	20%	0.203	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	138.4	175.1	178.6	0	0	0	0	111.1	G579 E590 C610	G579-S588 CarbonylContact O-C 3.48Å; G579-S588 WeakPolarHBondContact O-CA 3.46Å; S588-E590 VanDerWaalsContact C-N 3.29Å; S588-E590 VanDerWaalsContact OG-CB 3.28Å; S588-E590 WeakPolarHBondContact OG-CB 3.42Å; S588-E590 PolarHBondContact OG-N 3.39Å; S588-C610 CarbonylContact O-C 3.35Å; S588-C610 VanDerWaalsContact O-CA 3.25Å; S588-C610 WeakPolarHBondContact O-CA 3.5Å
589	T	69.1	Low	74.2	Confident	71 Å²	71	60.5 Å²	60.5	44%	0.436	35%	0.351	S	S	.	.			trans	-87.5	-0.8	170.5	64.6	0	0	0	0	112.4	G579 V581 T591	G579-T589 VanDerWaalsContact CA-OG1 3.22Å; G579-T589 WeakPolarHBondContact CA-OG1 3.21Å; G579-T589 PolarHBondContact O-N 2.65Å; G579-T589 PolarHBondContact O-OG1 2.7Å; V581-T589 HydrophobicContact CB-CG2 4.21Å; V581-T589 HydrophobicContact CG1-CG2 3.43Å; V581-T589 VanDerWaalsContact CG1-CG2 3.43Å; V581-T589 HydrophobicContact CG2-CG2 3.84Å; T589-T591 PolarHBondContact O-N 3.28Å
590	E	70.1	Confident	74.7	Confident	111 Å²	111	65.6 Å²	65.6	52%	0.519	37%	0.367	S	S	.	.			trans	-68.6	122.3	178.4	-165.3	-177.7	175.4	0	0	110.4	S588 S592 G611	S588-E590 VanDerWaalsContact C-N 3.29Å; S588-E590 VanDerWaalsContact OG-CB 3.28Å; S588-E590 WeakPolarHBondContact OG-CB 3.42Å; S588-E590 PolarHBondContact OG-N 3.39Å; E590-S592 VanDerWaalsContact CD-OG 3.26Å; E590-S592 WeakPolarHBondContact CG-OG 3.22Å; E590-S592 PolarHBondContact OE1-OG 2.7Å; E590-G611 WeakPolarHBondContact O-CA 3.46Å
591	T	73.3	Confident	74.9	Confident	58 Å²	58	67.3 Å²	67.3	36%	0.356	38%	0.377	S	S	.	.			trans	-104.6	0.1	-179.6	56.7	0	0	0	0	113.3	T589 L593 C594 F595 M601	T589-T591 PolarHBondContact O-N 3.28Å; T591-L593 VanDerWaalsContact C-N 3.29Å; T591-L593 PolarHBondContact O-N 2.04Å; T591-C594 WeakPolarHBondContact O-CB 3.29Å; T591-C594 PolarHBondContact O-N 2.89Å; T591-F595 WeakPolarHBondContact O-CD2 3.39Å; T591-M601 HydrophobicContact CG2-CE 4.01Å
592	S	67.9	Low	75.1	Confident	52 Å²	52	64 Å²	64	36%	0.364	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-54.5	-44.4	-174.6	61.1	0	0	0	0	112	E590 C594 F595	E590-S592 VanDerWaalsContact CD-OG 3.26Å; E590-S592 WeakPolarHBondContact CG-OG 3.22Å; E590-S592 PolarHBondContact OE1-OG 2.7Å; S592-C594 PolarHBondContact O-N 3.19Å; S592-F595 PolarHBondContact O-N 3.23Å
593	L	71.8	Confident	75.1	Confident	127 Å²	127	63 Å²	63	67%	0.665	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-70.9	-15.2	179.1	-61.5	174	0	0	0	113.9	T591	T591-L593 VanDerWaalsContact C-N 3.29Å; T591-L593 PolarHBondContact O-N 2.04Å
594	C	80.1	Confident	75	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-90.9	-7.3	179.3	-69.8	0	0	0	0	113.3	T591 S592 M601 C602 C608 R612	T591-C594 WeakPolarHBondContact O-CB 3.29Å; T591-C594 PolarHBondContact O-N 2.89Å; S592-C594 PolarHBondContact O-N 3.19Å; C594-M601 HydrophobicContact CB-CG 4.39Å; C594-C602 PolarHBondContact O-N 3.33Å; C594-C608 HydrophobicContact CB-CB 3.5Å; C594-C608 WeakPolarHBondContact CB-SG 3.36Å; C594-C608 WeakPolarHBondContact SG-CB 3.16Å; C594-C608 CovalentContact SG-SG 2.04Å; C594-C608 PolarHBondContact SG-SG 3.41Å; C594-R612 VanDerWaalsContact SG-C 3.56Å; C594-R612 PolarHBondContact SG-N 3.42Å
595	F	75.4	Confident	74.8	Confident	63 Å²	63	60.1 Å²	60.1	28%	0.276	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-84.5	124.1	177	-77.1	-81.6	0	0	0	110.4	T591 S592 M601	T591-F595 WeakPolarHBondContact O-CD2 3.39Å; S592-F595 PolarHBondContact O-N 3.23Å; F595-M601 HydrophobicContact CE1-CB 4.37Å; F595-M601 HydrophobicContact CE1-CE 4.43Å; F595-M601 HydrophobicContact CE2-CE 4.07Å; F595-M601 HydrophobicContact CZ-CE 3.8Å
596	S	71.6	Confident	74.9	Confident	8 Å²	8	61 Å²	61	6%	0.056	35%	0.347	C	S	.	.			trans	-73.4	167	171.7	67.5	0	0	0	0	111	D598 G599 K600 S603	S596-D598 PolarHBondContact O-N 2.75Å; S596-D598 VanDerWaalsContact O-N 3.12Å; S596-G599 WeakPolarHBondContact O-CA 2.97Å; S596-G599 PolarHBondContact O-N 2.85Å; S596-K600 PolarHBondContact N-O 2.95Å; S596-K600 PolarHBondContact OG-O 3.04Å; S596-K600 VanDerWaalsContact OG-O 3.07Å; S596-S603 VanDerWaalsContact CB-OG 3.24Å; S596-S603 WeakPolarHBondContact CB-OG 3.47Å; S596-S603 PolarHBondContact OG-OG 3.17Å
597	D	58.1	Low	74.9	Confident	140 Å²	140	59.9 Å²	59.9	75%	0.749	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.2	177.9	-81.9	-41.1	0	0	0	113.7	K412 G599	K412-D597 IonicContact NZ-OD1 3.28Å; K412-D597 PolarHBondContact NZ-OD1 2.99Å; D597-G599 PolarHBondContact O-N 2.78Å
598	D	57.9	Low	75	Confident	135 Å²	135	60.4 Å²	60.4	72%	0.722	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	0.1	173.3	-56.1	-35.2	0	0	0	114.2	S596 K600	S596-D598 PolarHBondContact O-N 2.75Å; S596-D598 VanDerWaalsContact O-N 3.12Å; D598-K600 VanDerWaalsContact C-N 3.26Å; D598-K600 PolarHBondContact O-N 2.89Å
599	G	60.3	Low	75.4	Confident	26 Å²	26	62.3 Å²	62.3	27%	0.268	36%	0.359	S	S	.	.	S	Bend	trans	71	14.1	-179.7	0	0	0	0	0	116	S596 D597	S596-G599 WeakPolarHBondContact O-CA 2.97Å; S596-G599 PolarHBondContact O-N 2.85Å; D597-G599 PolarHBondContact O-N 2.78Å
600	K	70.3	Confident	76	Confident	129 Å²	129	61.8 Å²	61.8	56%	0.561	36%	0.357	S	S	*	.			trans	-93.5	139.2	172.9	-66.9	-179.4	-177.9	174.1	0	109.8	S596 D598 C602 S603	S596-K600 PolarHBondContact N-O 2.95Å; S596-K600 PolarHBondContact OG-O 3.04Å; S596-K600 VanDerWaalsContact OG-O 3.07Å; D598-K600 VanDerWaalsContact C-N 3.26Å; D598-K600 PolarHBondContact O-N 2.89Å; K600-C602 PolarHBondContact O-N 3.24Å; K600-S603 PolarHBondContact O-N 2.78Å
601	M	77.4	Confident	76.4	Confident	76 Å²	76	56.9 Å²	56.9	37%	0.374	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-66.4	122.1	173.1	-173.5	170.5	-72.9	0	0	109.2	T591 C594 F595 S603 G604 C608	T591-M601 HydrophobicContact CG2-CE 4.01Å; C594-M601 HydrophobicContact CB-CG 4.39Å; F595-M601 HydrophobicContact CE1-CB 4.37Å; F595-M601 HydrophobicContact CE1-CE 4.43Å; F595-M601 HydrophobicContact CE2-CE 4.07Å; F595-M601 HydrophobicContact CZ-CE 3.8Å; M601-S603 PolarHBondContact O-N 3.29Å; M601-G604 PolarHBondContact O-N 3.38Å; M601-C608 HydrophobicContact CG-CB 4Å; M601-C608 HydrophobicContact SD-CB 3.74Å
602	C	83.3	Confident	77	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	49.3	41	-177.2	-53	0	0	0	0	113.3	C594 K600 G604 R605 C613 T624	C594-C602 PolarHBondContact O-N 3.33Å; K600-C602 PolarHBondContact O-N 3.24Å; C602-G604 PolarHBondContact O-N 2.88Å; C602-R605 PolarHBondContact O-N 2.92Å; C602-C613 WeakPolarHBondContact CA-SG 3.03Å; C602-C613 HydrophobicContact CB-CB 3.66Å; C602-C613 WeakPolarHBondContact CB-SG 3.39Å; C602-C613 WeakPolarHBondContact SG-CA 3.34Å; C602-C613 WeakPolarHBondContact SG-CB 3.25Å; C602-C613 CovalentContact SG-SG 2.03Å; C602-C613 PolarHBondContact SG-SG 2.98Å; C602-T624 CarbonylContact C-O 3.53Å; C602-T624 WeakPolarHBondContact CA-O 2.88Å
603	S	81.3	Confident	78	Confident	20 Å²	20	62 Å²	62	14%	0.14	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	53.1	16.5	-175.7	-64.2	0	0	0	0	114.5	S596 K600 M601 R605 T624 E626	S596-S603 VanDerWaalsContact CB-OG 3.24Å; S596-S603 WeakPolarHBondContact CB-OG 3.47Å; S596-S603 PolarHBondContact OG-OG 3.17Å; K600-S603 PolarHBondContact O-N 2.78Å; M601-S603 PolarHBondContact O-N 3.29Å; S603-R605 PolarHBondContact O-N 3.39Å; S603-T624 WeakPolarHBondContact CB-O 3.31Å; S603-T624 PolarHBondContact N-O 2.03Å; S603-T624 VanDerWaalsContact N-O 3.15Å; S603-T624 PolarHBondContact OG-O 2.94Å; S603-E626 WeakPolarHBondContact OG-CA 3.44Å
604	G	81.9	Confident	78.9	Confident	62 Å²	62	61.9 Å²	61.9	64%	0.639	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	73.5	7.2	-172	0	0	0	0	0	114.9	M601 C602	M601-G604 PolarHBondContact O-N 3.38Å; C602-G604 PolarHBondContact O-N 2.88Å
605	R	85.3	Confident	79.4	Confident	60 Å²	60	64 Å²	64	23%	0.226	36%	0.355	C	S	.	.	S	Bend	trans	-109.2	10.4	-174.3	-49.6	-169.8	-173.1	-100.7	8.5	113.5	C602 S603 T616 E617 A620 C625 C631	C602-R605 PolarHBondContact O-N 2.92Å; S603-R605 PolarHBondContact O-N 3.39Å; R605-T616 PolarHBondContact O-N 2.79Å; R605-T616 PolarHBondContact O-OG1 3.06Å; R605-E617 HydrophobicContact CB-CB 3.97Å; R605-E617 WeakPolarHBondContact CB-OE2 3.3Å; R605-E617 WeakPolarHBondContact CD-OE2 3.22Å; R605-E617 WeakPolarHBondContact CG-OE2 3.18Å; R605-E617 IonicContact CZ-OE2 3.67Å; R605-E617 IonicContact NE-OE2 2.84Å; R605-E617 IonicContact NH1-OE1 3.08Å; R605-E617 IonicContact NH1-OE2 2.7Å; R605-E617 PolarHBondContact NH1-OE2 3.07Å; R605-E617 PolarHBondContact O-N 3.21Å; R605-E617 VanDerWaalsContact O-N 3.12Å; R605-A620 HydrophobicContact CB-CB 4.17Å; R605-C625 HydrophobicContact CB-CB 4Å; R605-C625 VanDerWaalsContact CD-O 3.31Å; R605-C625 WeakPolarHBondContact CD-O 3.47Å; R605-C631 PolarHBondContact NH1-SG 3.01Å
606	G	88.2	Confident	80	Confident	19 Å²	19	65.9 Å²	65.9	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	-177.1	-174.7	0	0	0	0	0	113.1	Q614	G606-Q614 CarbonylContact C-O 3.52Å; G606-Q614 WeakPolarHBondContact CA-O 3.45Å
607	S	89.3	Confident	80.5	Confident	52 Å²	52	68.4 Å²	68.4	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.9	176.2	54	0	0	0	0	110.7	V609 Q614	S607-V609 PolarHBondContact O-N 2.95Å; S607-Q614 PolarHBondContact N-O 2.89Å; S607-Q614 PolarHBondContact O-N 2.73Å
608	C	84	Confident	81.5	Confident	30 Å²	30	67.1 Å²	67.1	20%	0.203	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.5	174.3	-173.4	0	0	0	0	109.9	C594 M601 R612	C594-C608 HydrophobicContact CB-CB 3.5Å; C594-C608 WeakPolarHBondContact CB-SG 3.36Å; C594-C608 WeakPolarHBondContact SG-CB 3.16Å; C594-C608 CovalentContact SG-SG 2.04Å; C594-C608 PolarHBondContact SG-SG 3.41Å; M601-C608 HydrophobicContact CG-CB 4Å; M601-C608 HydrophobicContact SD-CB 3.74Å; C608-R612 WeakPolarHBondContact CA-O 3.48Å
609	V	87.7	Confident	82.2	Confident	69 Å²	69	62.5 Å²	62.5	42%	0.418	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119	177.7	-176.2	0	0	0	0	107.9	S607 G611 R612 Q614	S607-V609 PolarHBondContact O-N 2.95Å; V609-G611 VanDerWaalsContact C-N 3.29Å; V609-G611 PolarHBondContact O-N 2.86Å; V609-R612 PolarHBondContact N-O 3.05Å; V609-R612 PolarHBondContact O-N 3.37Å; V609-R612 VanDerWaalsContact O-N 3.12Å; V609-Q614 HydrophobicContact CG2-CB 4.44Å
610	C	81.9	Confident	83.2	Confident	60 Å²	60	61.9 Å²	61.9	41%	0.405	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	38.1	-179	-50.5	0	0	0	0	114.6	C587 S588 R612	C587-C610 HydrophobicContact CB-CB 3.94Å; C587-C610 WeakPolarHBondContact CB-SG 3.36Å; C587-C610 WeakPolarHBondContact SG-CA 3.47Å; C587-C610 WeakPolarHBondContact SG-CB 3.42Å; C587-C610 CovalentContact SG-SG 2.03Å; C587-C610 PolarHBondContact SG-SG 2.83Å; S588-C610 CarbonylContact O-C 3.35Å; S588-C610 VanDerWaalsContact O-CA 3.25Å; S588-C610 WeakPolarHBondContact O-CA 3.5Å; C610-R612 VanDerWaalsContact C-N 3.34Å; C610-R612 PolarHBondContact O-N 3.29Å
611	G	77.6	Confident	83.7	Confident	9 Å²	9	61 Å²	61	9%	0.093	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	14.5	-178.7	0	0	0	0	0	115.5	E590 V609	E590-G611 WeakPolarHBondContact O-CA 3.46Å; V609-G611 VanDerWaalsContact C-N 3.29Å; V609-G611 PolarHBondContact O-N 2.86Å
612	R	86.7	Confident	83.7	Confident	196 Å²	196	58.9 Å²	58.9	74%	0.74	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.1	172.8	-67.9	-176.8	-179.5	175.9	-1.5	111.6	C594 C608 V609 C610	C594-R612 VanDerWaalsContact SG-C 3.56Å; C594-R612 PolarHBondContact SG-N 3.42Å; C608-R612 WeakPolarHBondContact CA-O 3.48Å; V609-R612 PolarHBondContact N-O 3.05Å; V609-R612 PolarHBondContact O-N 3.37Å; V609-R612 VanDerWaalsContact O-N 3.12Å; C610-R612 VanDerWaalsContact C-N 3.34Å; C610-R612 PolarHBondContact O-N 3.29Å
613	C	87.8	Confident	83.5	Confident	22 Å²	22	66.6 Å²	66.6	15%	0.149	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	125.5	176.9	-73.5	0	0	0	0	111.9	C602 E623	C602-C613 WeakPolarHBondContact CA-SG 3.03Å; C602-C613 HydrophobicContact CB-CB 3.66Å; C602-C613 WeakPolarHBondContact CB-SG 3.39Å; C602-C613 WeakPolarHBondContact SG-CA 3.34Å; C602-C613 WeakPolarHBondContact SG-CB 3.25Å; C602-C613 CovalentContact SG-SG 2.03Å; C602-C613 PolarHBondContact SG-SG 2.98Å; C613-E623 WeakPolarHBondContact CB-O 3.34Å
614	Q	91.8	Very high	83.8	Confident	123 Å²	123	66.6 Å²	66.6	58%	0.575	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	104.3	167.2	-169.7	169.2	19.1	0	0	108.2	G606 S607 V609 T616	G606-Q614 CarbonylContact C-O 3.52Å; G606-Q614 WeakPolarHBondContact CA-O 3.45Å; S607-Q614 PolarHBondContact N-O 2.89Å; S607-Q614 PolarHBondContact O-N 2.73Å; V609-Q614 HydrophobicContact CG2-CB 4.44Å; Q614-T616 PolarHBondContact O-N 3.3Å
615	C	89.4	Confident	83.9	Confident	44 Å²	44	63.6 Å²	63.6	30%	0.297	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	122.3	-177.9	-48.5	0	0	0	0	110.2	A620 C625	C615-A620 HydrophobicContact CB-CB 4.34Å; C615-C625 WeakPolarHBondContact CA-SG 3.42Å; C615-C625 HydrophobicContact CB-CB 3.9Å; C615-C625 WeakPolarHBondContact CB-SG 3.18Å; C615-C625 VanDerWaalsContact SG-CA 3.51Å; C615-C625 WeakPolarHBondContact SG-CB 3.2Å; C615-C625 CovalentContact SG-SG 2.04Å; C615-C625 PolarHBondContact SG-SG 3.35Å
616	T	88.1	Confident	83.5	Confident	103 Å²	103	64.4 Å²	64.4	63%	0.632	36%	0.364	S	S	*	.			trans	-96.5	-22.4	178.9	52.8	0	0	0	0	111.6	R605 Q614	R605-T616 PolarHBondContact O-N 2.79Å; R605-T616 PolarHBondContact O-OG1 3.06Å; Q614-T616 PolarHBondContact O-N 3.3Å
617	E	83	Confident	82.9	Confident	62 Å²	62	68.9 Å²	68.9	29%	0.29	38%	0.378	S	S	.	.	S	Bend	trans	-79	128.3	179.5	-160.8	171.1	-168	0	0	111.7	R605 G619 A620 C631	R605-E617 HydrophobicContact CB-CB 3.97Å; R605-E617 WeakPolarHBondContact CB-OE2 3.3Å; R605-E617 WeakPolarHBondContact CD-OE2 3.22Å; R605-E617 WeakPolarHBondContact CG-OE2 3.18Å; R605-E617 IonicContact CZ-OE2 3.67Å; R605-E617 IonicContact NE-OE2 2.84Å; R605-E617 IonicContact NH1-OE1 3.08Å; R605-E617 IonicContact NH1-OE2 2.7Å; R605-E617 PolarHBondContact NH1-OE2 3.07Å; R605-E617 PolarHBondContact O-N 3.21Å; R605-E617 VanDerWaalsContact O-N 3.12Å; E617-G619 PolarHBondContact O-N 3.12Å; E617-A620 HydrophobicContact CB-CB 4.01Å; E617-A620 WeakPolarHBondContact O-CB 2.88Å; E617-A620 PolarHBondContact O-N 2.8Å; E617-A620 VanDerWaalsContact O-N 3.12Å; E617-C631 PolarHBondContact OE1-SG 2.91Å
618	P	78.9	Confident	82.1	Confident	112 Å²	112	67.1 Å²	67.1	73%	0.727	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	121.2	-177.1	-19.7	30.4	0	0	0	112.7	A620	P618-A620 VanDerWaalsContact C-N 3.34Å
619	G	72.8	Confident	81.2	Confident	39 Å²	39	69.9 Å²	69.9	40%	0.402	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	1.2	-179	0	0	0	0	0	114.6	E617 F621	E617-G619 PolarHBondContact O-N 3.12Å; G619-F621 WeakPolarHBondContact O-CD1 3.26Å
620	A	79.9	Confident	80.1	Confident	13 Å²	13	71.5 Å²	71.5	11%	0.107	39%	0.393	C	S	.	.			trans	-81	134.8	166.5	0	0	0	0	0	110.8	R605 C615 E617 P618 K627 C628	R605-A620 HydrophobicContact CB-CB 4.17Å; C615-A620 HydrophobicContact CB-CB 4.34Å; E617-A620 HydrophobicContact CB-CB 4.01Å; E617-A620 WeakPolarHBondContact O-CB 2.88Å; E617-A620 PolarHBondContact O-N 2.8Å; E617-A620 VanDerWaalsContact O-N 3.12Å; P618-A620 VanDerWaalsContact C-N 3.34Å; A620-K627 CarbonylContact C-O 3.57Å; A620-K627 VanDerWaalsContact CA-O 3.29Å; A620-K627 WeakPolarHBondContact CA-O 3.45Å; A620-C628 HydrophobicContact CB-CB 3.98Å
621	F	81.2	Confident	79.3	Confident	111 Å²	111	69.2 Å²	69.2	49%	0.487	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-151.1	173.9	178.3	65.4	-86.6	0	0	0	110.9	G619 C625 E626 K627 P629	G619-F621 WeakPolarHBondContact O-CD1 3.26Å; F621-C625 CarbonylContact O-C 3.54Å; F621-E626 PolarHBondContact O-N 2.89Å; F621-K627 HydrophobicContact CD1-CB 4.34Å; F621-K627 HydrophobicContact CD2-CB 4.04Å; F621-K627 HydrophobicContact CD2-CD 4.17Å; F621-K627 HydrophobicContact CE1-CB 4.11Å; F621-K627 HydrophobicContact CE2-CB 3.8Å; F621-K627 HydrophobicContact CE2-CD 3.66Å; F621-K627 HydrophobicContact CE2-CG 4.34Å; F621-K627 HydrophobicContact CG-CB 4.31Å; F621-K627 HydrophobicContact CZ-CB 3.83Å; F621-K627 HydrophobicContact CZ-CD 4.29Å; F621-K627 PolarHBondContact N-O 3.07Å; F621-K627 WeakPolarHBondContact O-CA 3.21Å; F621-K627 WeakPolarHBondContact O-CB 3.03Å; F621-K627 PolarHBondContact O-N 2.94Å; F621-P629 HydrophobicContact CE1-CG 3.96Å; F621-P629 HydrophobicContact CZ-CG 4.35Å
622	G	77.2	Confident	78.4	Confident	31 Å²	31	74.2 Å²	74.2	32%	0.32	41%	0.408	S	S	.	.	S	Bend	trans	112.6	166.3	-171.6	0	0	0	0	0	111.7	T624 C625 E626	G622-T624 PolarHBondContact O-N 3.02Å; G622-C625 PolarHBondContact O-N 3.49Å; G622-E626 WeakPolarHBondContact CA-OE1 3.42Å
623	E	80.7	Confident	77.2	Confident	161 Å²	161	69.8 Å²	69.8	75%	0.752	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-32	-178.6	-73.1	-75.9	142.9	0	0	111.6	C613	C613-E623 WeakPolarHBondContact CB-O 3.34Å
624	T	85.5	Confident	76.2	Confident	20 Å²	20	69.9 Å²	69.9	12%	0.123	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	19.2	178.3	59.7	0	0	0	0	112.7	C602 S603 G622 E626	C602-T624 CarbonylContact C-O 3.53Å; C602-T624 WeakPolarHBondContact CA-O 2.88Å; S603-T624 WeakPolarHBondContact CB-O 3.31Å; S603-T624 PolarHBondContact N-O 2.03Å; S603-T624 VanDerWaalsContact N-O 3.15Å; S603-T624 PolarHBondContact OG-O 2.94Å; G622-T624 PolarHBondContact O-N 3.02Å; T624-E626 WeakPolarHBondContact CA-OE2 3.41Å; T624-E626 PolarHBondContact N-OE2 2.77Å; T624-E626 PolarHBondContact O-N 3.03Å; T624-E626 PolarHBondContact OG1-OE2 2.95Å
625	C	85.8	Confident	75.5	Confident	0 Å²	0	66 Å²	66	0%	0	39%	0.388	C	S	.	.	S	Bend	trans	58.6	28.1	-174.9	-49.1	0	0	0	0	114	R605 C615 F621 G622	R605-C625 HydrophobicContact CB-CB 4Å; R605-C625 VanDerWaalsContact CD-O 3.31Å; R605-C625 WeakPolarHBondContact CD-O 3.47Å; C615-C625 WeakPolarHBondContact CA-SG 3.42Å; C615-C625 HydrophobicContact CB-CB 3.9Å; C615-C625 WeakPolarHBondContact CB-SG 3.18Å; C615-C625 VanDerWaalsContact SG-CA 3.51Å; C615-C625 WeakPolarHBondContact SG-CB 3.2Å; C615-C625 CovalentContact SG-SG 2.04Å; C615-C625 PolarHBondContact SG-SG 3.35Å; F621-C625 CarbonylContact O-C 3.54Å; G622-C625 PolarHBondContact O-N 3.49Å
626	E	76.8	Confident	74.8	Confident	77 Å²	77	65.5 Å²	65.5	36%	0.36	39%	0.39	S	S	.	.			trans	-74.6	-25.4	-174.6	68.9	-69.5	163.5	0	0	113.4	S603 F621 G622 T624	S603-E626 WeakPolarHBondContact OG-CA 3.44Å; F621-E626 PolarHBondContact O-N 2.89Å; G622-E626 WeakPolarHBondContact CA-OE1 3.42Å; T624-E626 WeakPolarHBondContact CA-OE2 3.41Å; T624-E626 PolarHBondContact N-OE2 2.77Å; T624-E626 PolarHBondContact O-N 3.03Å; T624-E626 PolarHBondContact OG1-OE2 2.95Å
627	K	75.4	Confident	74.2	Confident	112 Å²	112	64.3 Å²	64.3	49%	0.487	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-95.6	114.6	-175.9	-54	179.7	-176.2	174.2	0	109.5	A620 F621	A620-K627 CarbonylContact C-O 3.57Å; A620-K627 VanDerWaalsContact CA-O 3.29Å; A620-K627 WeakPolarHBondContact CA-O 3.45Å; F621-K627 HydrophobicContact CD1-CB 4.34Å; F621-K627 HydrophobicContact CD2-CB 4.04Å; F621-K627 HydrophobicContact CD2-CD 4.17Å; F621-K627 HydrophobicContact CE1-CB 4.11Å; F621-K627 HydrophobicContact CE2-CB 3.8Å; F621-K627 HydrophobicContact CE2-CD 3.66Å; F621-K627 HydrophobicContact CE2-CG 4.34Å; F621-K627 HydrophobicContact CG-CB 4.31Å; F621-K627 HydrophobicContact CZ-CB 3.83Å; F621-K627 HydrophobicContact CZ-CD 4.29Å; F621-K627 PolarHBondContact N-O 3.07Å; F621-K627 WeakPolarHBondContact O-CA 3.21Å; F621-K627 WeakPolarHBondContact O-CB 3.03Å; F621-K627 PolarHBondContact O-N 2.94Å
628	C	71.6	Confident	74.1	Confident	15 Å²	15	63.4 Å²	63.4	10%	0.101	38%	0.378	C	S	.	.			trans	-141.1	84.3	172	-169.6	0	0	0	0	112	A620 T630 C631	A620-C628 HydrophobicContact CB-CB 3.98Å; C628-T630 PolarHBondContact O-N 2.86Å; C628-C631 HydrophobicContact CB-CB 3.7Å; C628-C631 WeakPolarHBondContact CB-SG 2.98Å; C628-C631 PolarHBondContact O-N 3.02Å; C628-C631 WeakPolarHBondContact SG-CB 3.01Å; C628-C631 PolarHBondContact SG-N 3.28Å; C628-C631 VanDerWaalsContact SG-N 3.39Å; C628-C631 CovalentContact SG-SG 2.01Å; C628-C631 PolarHBondContact SG-SG 3.24Å
629	P	64.7	Low	74.4	Confident	89 Å²	89	62.4 Å²	62.4	58%	0.578	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.3	-179.4	-20.2	32.4	0	0	0	113.8	F621	F621-P629 HydrophobicContact CE1-CG 3.96Å; F621-P629 HydrophobicContact CZ-CG 4.35Å
630	T	64.6	Low	74.9	Confident	103 Å²	103	63.7 Å²	63.7	63%	0.632	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	3.5	-178.6	52.5	0	0	0	0	113.3	C628	C628-T630 PolarHBondContact O-N 2.86Å
631	C	66.6	Low	75.1	Confident	11 Å²	11	63.6 Å²	63.6	7%	0.074	35%	0.353	C	S	.	.			trans	-75.5	135.2	-179.3	-79.5	0	0	0	0	111.3	R605 E617 C628 D633	R605-C631 PolarHBondContact NH1-SG 3.01Å; E617-C631 PolarHBondContact OE1-SG 2.91Å; C628-C631 HydrophobicContact CB-CB 3.7Å; C628-C631 WeakPolarHBondContact CB-SG 2.98Å; C628-C631 PolarHBondContact O-N 3.02Å; C628-C631 WeakPolarHBondContact SG-CB 3.01Å; C628-C631 PolarHBondContact SG-N 3.28Å; C628-C631 VanDerWaalsContact SG-N 3.39Å; C628-C631 CovalentContact SG-SG 2.01Å; C628-C631 PolarHBondContact SG-SG 3.24Å; C631-D633 PolarHBondContact O-N 2.97Å
632	P	58.5	Low	75.3	Confident	114 Å²	114	58.3 Å²	58.3	74%	0.74	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-25.4	-175.2	-24.3	32.3	0	0	0	115.1
633	D	61.6	Low	75.6	Confident	103 Å²	103	58 Å²	58	55%	0.551	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	0.1	-167.4	-73.8	-21.4	0	0	0	115.6	C631 G636 T637	C631-D633 PolarHBondContact O-N 2.97Å; D633-G636 PolarHBondContact O-N 3.37Å; D633-T637 PolarHBondContact O-N 3.44Å; D633-T637 PolarHBondContact O-OG1 3.18Å
634	A	66.6	Low	75.9	Confident	25 Å²	25	50.4 Å²	50.4	21%	0.207	29%	0.285	C	S	.	.	H	α-helix	trans	-65.1	-47.2	-179.6	0	0	0	0	0	112.1	G636 T637 K638 Y696	A634-G636 VanDerWaalsContact C-N 3.35Å; A634-T637 PolarHBondContact O-OG1 3.48Å; A634-K638 VanDerWaalsContact O-CG 3.26Å; A634-K638 WeakPolarHBondContact O-CG 3.35Å; A634-K638 PolarHBondContact O-N 2.91Å; A634-Y696 HydrophobicContact CB-CE1 4.33Å; A634-Y696 WeakPolarHBondContact CB-OH 3.48Å
635	C	75.9	Confident	75.8	Confident	42 Å²	42	55 Å²	55	28%	0.284	30%	0.3	S	S	.	.	H	α-helix	trans	-69.3	-32.3	172.8	-70.5	0	0	0	0	112.5	R639 C682	C635-R639 WeakPolarHBondContact O-CB 3.45Å; C635-R639 PolarHBondContact O-N 2.95Å; C635-C682 VanDerWaalsContact CA-SG 3.51Å; C635-C682 HydrophobicContact CB-CB 3.71Å; C635-C682 WeakPolarHBondContact CB-SG 3.29Å; C635-C682 WeakPolarHBondContact SG-CB 3.41Å; C635-C682 CovalentContact SG-SG 2.04Å; C635-C682 PolarHBondContact SG-SG 2.89Å
636	G	76.1	Confident	75.7	Confident	32 Å²	32	57.9 Å²	57.9	33%	0.33	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-49.1	-178.3	0	0	0	0	0	112.9	D633 A634 R639 E640	D633-G636 PolarHBondContact O-N 3.37Å; A634-G636 VanDerWaalsContact C-N 3.35Å; G636-R639 WeakPolarHBondContact O-CB 3.49Å; G636-R639 PolarHBondContact O-N 3.2Å; G636-E640 PolarHBondContact O-N 3.22Å
637	T	75.4	Confident	75.8	Confident	79 Å²	79	58 Å²	58	49%	0.485	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-42.5	177.1	47.1	0	0	0	0	112.3	D633 A634 R639 E640	D633-T637 PolarHBondContact O-N 3.44Å; D633-T637 PolarHBondContact O-OG1 3.18Å; A634-T637 PolarHBondContact O-OG1 3.48Å; T637-R639 VanDerWaalsContact C-N 3.34Å; T637-R639 PolarHBondContact O-N 2.89Å; T637-E640 PolarHBondContact O-N 3.41Å
638	K	80.7	Confident	75.9	Confident	43 Å²	43	58.5 Å²	58.5	19%	0.187	32%	0.323	C	S	.	.	H	α-helix	trans	-70.5	-29.5	177.8	-61.5	-57.1	-175.9	-174.6	0	113	A634 C641 I642 D664 F694 S704 L706	A634-K638 VanDerWaalsContact O-CG 3.26Å; A634-K638 WeakPolarHBondContact O-CG 3.35Å; A634-K638 PolarHBondContact O-N 2.91Å; K638-C641 PolarHBondContact O-N 3.36Å; K638-I642 PolarHBondContact O-N 2.96Å; K638-D664 IonicContact NZ-OD1 3.23Å; K638-D664 IonicContact NZ-OD2 2.79Å; K638-D664 PolarHBondContact NZ-OD2 3.02Å; K638-F694 HydrophobicContact CB-CE2 3.88Å; K638-F694 HydrophobicContact CB-CZ 4.13Å; K638-S704 WeakPolarHBondContact CE-OG 3.48Å; K638-S704 PolarHBondContact NZ-OG 2.87Å; K638-L706 HydrophobicContact CB-CD2 3.85Å; K638-L706 HydrophobicContact CD-CD1 4.4Å; K638-L706 HydrophobicContact CD-CD2 4.38Å; K638-L706 HydrophobicContact CG-CD2 4.18Å
639	R	84.6	Confident	76.1	Confident	90 Å²	90	59.7 Å²	59.7	34%	0.34	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-46.3	171.8	167.7	-173.7	171.2	172.1	3.4	111.6	C635 G636 T637 C641 I642 E643 Y684 F694	C635-R639 WeakPolarHBondContact O-CB 3.45Å; C635-R639 PolarHBondContact O-N 2.95Å; G636-R639 WeakPolarHBondContact O-CB 3.49Å; G636-R639 PolarHBondContact O-N 3.2Å; T637-R639 VanDerWaalsContact C-N 3.34Å; T637-R639 PolarHBondContact O-N 2.89Å; R639-C641 PolarHBondContact O-N 2Å; R639-I642 PolarHBondContact O-N 3.07Å; R639-E643 HydrophobicContact CG-CG 4.32Å; R639-E643 IonicContact CZ-OE1 2.61Å; R639-E643 VanDerWaalsContact CZ-OE1 3.23Å; R639-E643 IonicContact NE-OE1 2.97Å; R639-E643 PolarHBondContact NE-OE1 3.14Å; R639-E643 IonicContact NH2-OE1 2.73Å; R639-E643 PolarHBondContact NH2-OE1 3.34Å; R639-E643 PolarHBondContact O-N 3.15Å; R639-Y684 HydrophobicContact CB-CD1 4.43Å; R639-Y684 HydrophobicContact CB-CE1 4.42Å; R639-Y684 HydrophobicContact CG-CD1 3.93Å; R639-Y684 HydrophobicContact CG-CD2 4.11Å; R639-Y684 HydrophobicContact CG-CE1 3.86Å; R639-Y684 HydrophobicContact CG-CE2 4.05Å; R639-Y684 HydrophobicContact CG-CG 4.04Å; R639-Y684 VanDerWaalsContact CZ-CD2 3.46Å; R639-Y684 VanDerWaalsContact NE-CD2 3.3Å; R639-F694 HydrophobicContact CB-CE1 4.33Å; R639-F694 HydrophobicContact CB-CZ 4.41Å
640	E	84.1	Confident	76.6	Confident	66 Å²	66	57.1 Å²	57.1	31%	0.308	32%	0.321	S	S	.	.	H	α-helix	trans	-57.9	-34.3	-179.4	-64.3	-175.8	166.8	0	0	111.7	G636 T637 C644 L652	G636-E640 PolarHBondContact O-N 3.22Å; T637-E640 PolarHBondContact O-N 3.41Å; E640-C644 PolarHBondContact O-N 3.09Å; E640-L652 HydrophobicContact CB-CD1 3.8Å; E640-L652 HydrophobicContact CB-CG 4.37Å
641	C	83.3	Confident	76.9	Confident	11 Å²	11	62.7 Å²	62.7	7%	0.074	33%	0.331	C	S	.	.	H	α-helix	trans	-72.4	-35.2	175.6	-72.2	0	0	0	0	114.3	K638 R639 R645 C662	K638-C641 PolarHBondContact O-N 3.36Å; R639-C641 PolarHBondContact O-N 2Å; C641-R645 VanDerWaalsContact O-CB 3.24Å; C641-R645 WeakPolarHBondContact O-CB 3.44Å; C641-R645 WeakPolarHBondContact O-CG 2.96Å; C641-R645 PolarHBondContact O-N 3.46Å; C641-C662 WeakPolarHBondContact CA-SG 3.47Å; C641-C662 HydrophobicContact CB-CB 3.57Å; C641-C662 WeakPolarHBondContact CB-SG 3.24Å; C641-C662 WeakPolarHBondContact SG-CA 3.42Å; C641-C662 WeakPolarHBondContact SG-CB 3Å; C641-C662 CovalentContact SG-SG 2.04Å; C641-C662 PolarHBondContact SG-SG 3.43Å
642	I	85.7	Confident	77.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.6	-46.8	174.2	-75.6	176.8	0	0	0	110.5	K638 R639 C644 L646 F647 Y684 M692 F694 L706 A708	K638-I642 PolarHBondContact O-N 2.96Å; R639-I642 PolarHBondContact O-N 3.07Å; I642-C644 VanDerWaalsContact C-N 3.33Å; I642-C644 PolarHBondContact O-N 3.17Å; I642-L646 HydrophobicContact CG2-CD1 4Å; I642-L646 WeakPolarHBondContact O-CB 3.45Å; I642-L646 PolarHBondContact O-N 2.63Å; I642-F647 HydrophobicContact CG2-CE2 4.35Å; I642-Y684 HydrophobicContact CG2-CE1 4.44Å; I642-Y684 WeakPolarHBondContact CG2-OH 3.32Å; I642-M692 HydrophobicContact CG2-CE 4.11Å; I642-F694 HydrophobicContact CD1-CB 3.5Å; I642-F694 HydrophobicContact CD1-CD1 3.43Å; I642-F694 VanDerWaalsContact CD1-CD1 3.43Å; I642-F694 HydrophobicContact CD1-CD2 3.41Å; I642-F694 VanDerWaalsContact CD1-CD2 3.41Å; I642-F694 HydrophobicContact CD1-CE1 3.88Å; I642-F694 HydrophobicContact CD1-CE2 3.87Å; I642-F694 HydrophobicContact CD1-CG 3.15Å; I642-F694 HydrophobicContact CD1-CZ 4.07Å; I642-L706 HydrophobicContact CD1-CD2 4.47Å; I642-A708 HydrophobicContact CD1-CB 4.03Å
643	E	84.4	Confident	77.6	Confident	25 Å²	25	60 Å²	60	12%	0.117	32%	0.316	C	S	.	.	H	α-helix	trans	-60	-41.8	179.7	-72.7	-178.4	170.4	0	0	112.2	R639 F647 N648 S649 Y684	R639-E643 HydrophobicContact CG-CG 4.32Å; R639-E643 IonicContact CZ-OE1 2.61Å; R639-E643 VanDerWaalsContact CZ-OE1 3.23Å; R639-E643 IonicContact NE-OE1 2.97Å; R639-E643 PolarHBondContact NE-OE1 3.14Å; R639-E643 IonicContact NH2-OE1 2.73Å; R639-E643 PolarHBondContact NH2-OE1 3.34Å; R639-E643 PolarHBondContact O-N 3.15Å; E643-F647 CarbonylContact O-C 3.6Å; E643-F647 WeakPolarHBondContact O-CA 3.01Å; E643-F647 WeakPolarHBondContact O-CB 3.49Å; E643-F647 PolarHBondContact O-N 2.75Å; E643-N648 PolarHBondContact O-N 3.4Å; E643-S649 CarbonylContact C-O 3.56Å; E643-S649 VanDerWaalsContact C-O 3.23Å; E643-S649 PolarHBondContact O-N 3.13Å; E643-S649 PolarHBondContact O-OG 2.9Å; E643-Y684 HydrophobicContact CG-CE2 4.04Å; E643-Y684 WeakPolarHBondContact CG-OH 3.47Å; E643-Y684 VanDerWaalsContact OE1-CE2 3.29Å; E643-Y684 WeakPolarHBondContact OE1-CE2 3.33Å
644	C	85.8	Confident	78.3	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.014	31%	0.311	C	S	.	.	H	α-helix	trans	-73	-54.8	176.2	173.8	0	0	0	0	112.7	E640 I642 L646 N648 S649 L652 C658	E640-C644 PolarHBondContact O-N 3.09Å; I642-C644 VanDerWaalsContact C-N 3.33Å; I642-C644 PolarHBondContact O-N 3.17Å; C644-L646 PolarHBondContact O-N 2.97Å; C644-N648 VanDerWaalsContact O-CA 3.24Å; C644-N648 WeakPolarHBondContact O-CA 3.34Å; C644-N648 PolarHBondContact O-N 2.98Å; C644-N648 PolarHBondContact O-OD1 3.18Å; C644-S649 PolarHBondContact N-O 2.91Å; C644-L652 HydrophobicContact CB-CB 4.22Å; C644-L652 PolarHBondContact SG-O 2.04Å; C644-C658 HydrophobicContact CB-CB 4.04Å; C644-C658 WeakPolarHBondContact CB-SG 3.38Å; C644-C658 WeakPolarHBondContact SG-CB 3.42Å; C644-C658 CovalentContact SG-SG 2Å; C644-C658 PolarHBondContact SG-SG 2.75Å
645	R	83.8	Confident	78.3	Confident	116 Å²	116	62.7 Å²	62.7	44%	0.438	33%	0.326	S	S	.	.	H	α-helix	trans	-68.3	-33.3	-170.3	-74.5	-73.5	-155.8	163.3	2.2	113.6	C641 C662 I666	C641-R645 VanDerWaalsContact O-CB 3.24Å; C641-R645 WeakPolarHBondContact O-CB 3.44Å; C641-R645 WeakPolarHBondContact O-CG 2.96Å; C641-R645 PolarHBondContact O-N 3.46Å; R645-C662 HydrophobicContact CG-CB 4.27Å; R645-C662 PolarHBondContact NE-O 3.35Å; R645-C662 PolarHBondContact NH2-O 3Å; R645-I666 HydrophobicContact CB-CD1 3.57Å; R645-I666 HydrophobicContact CG-CD1 3.86Å
646	L	83.3	Confident	78	Confident	61 Å²	61	68.4 Å²	68.4	32%	0.319	35%	0.349	S	S	.	.	H	α-helix	trans	-97.9	-35.4	-176.7	-70.7	165.6	0	0	0	112.8	I642 C644 I666 T668 A708	I642-L646 HydrophobicContact CG2-CD1 4Å; I642-L646 WeakPolarHBondContact O-CB 3.45Å; I642-L646 PolarHBondContact O-N 2.63Å; C644-L646 PolarHBondContact O-N 2.97Å; L646-I666 HydrophobicContact CD1-CG2 3.89Å; L646-I666 HydrophobicContact CG-CG2 4.37Å; L646-T668 HydrophobicContact CD1-CG2 4.27Å; L646-T668 HydrophobicContact CD2-CG2 3.39Å; L646-T668 HydrophobicContact CG-CG2 4.49Å; L646-A708 HydrophobicContact CD1-CB 4.02Å
647	F	80.1	Confident	77.9	Confident	78 Å²	78	69.1 Å²	69.1	34%	0.342	35%	0.347	S	S	.	.	H	α-helix	trans	-118.4	-0.5	-171.4	-54.4	-72.6	0	0	0	114	I642 E643 S649 M692	I642-F647 HydrophobicContact CG2-CE2 4.35Å; E643-F647 CarbonylContact O-C 3.6Å; E643-F647 WeakPolarHBondContact O-CA 3.01Å; E643-F647 WeakPolarHBondContact O-CB 3.49Å; E643-F647 PolarHBondContact O-N 2.75Å; F647-S649 WeakPolarHBondContact CB-OG 3.18Å; F647-S649 PolarHBondContact O-N 3.18Å; F647-M692 HydrophobicContact CE2-CE 3.83Å; F647-M692 HydrophobicContact CE2-SD 4.18Å; F647-M692 HydrophobicContact CZ-CE 3.87Å; F647-M692 HydrophobicContact CZ-SD 4.04Å
648	N	77.4	Confident	78.1	Confident	123 Å²	123	65.5 Å²	65.5	66%	0.658	33%	0.325	S	S	*	.	S	Bend	trans	48.2	39.8	-174	-67.7	-45.4	0	0	0	112.7	E643 C644	E643-N648 PolarHBondContact O-N 3.4Å; C644-N648 VanDerWaalsContact O-CA 3.24Å; C644-N648 WeakPolarHBondContact O-CA 3.34Å; C644-N648 PolarHBondContact O-N 2.98Å; C644-N648 PolarHBondContact O-OD1 3.18Å
649	S	74.5	Confident	77.8	Confident	41 Å²	41	68.5 Å²	68.5	29%	0.287	34%	0.339	S	S	.	.			trans	-132.4	174.5	-172.8	67.8	0	0	0	0	111.4	E643 C644 F647	E643-S649 CarbonylContact C-O 3.56Å; E643-S649 VanDerWaalsContact C-O 3.23Å; E643-S649 PolarHBondContact O-N 3.13Å; E643-S649 PolarHBondContact O-OG 2.9Å; C644-S649 PolarHBondContact N-O 2.91Å; F647-S649 WeakPolarHBondContact CB-OG 3.18Å; F647-S649 PolarHBondContact O-N 3.18Å
650	G	75.6	Confident	77.2	Confident	35 Å²	35	71.2 Å²	71.2	36%	0.361	35%	0.35	S	S	.	.	S	Bend	trans	85.2	-171.4	178.5	0	0	0	0	0	114.6	L652 A653	G650-L652 VanDerWaalsContact C-N 3.27Å; G650-L652 PolarHBondContact O-N 3.05Å; G650-A653 VanDerWaalsContact O-CB 3.29Å; G650-A653 WeakPolarHBondContact O-CB 3.24Å; G650-A653 PolarHBondContact O-N 3.43Å
651	R	70.6	Confident	76.6	Confident	219 Å²	219	72.8 Å²	72.8	83%	0.826	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.7	-172.2	-165.6	178.4	179.7	179	0.4	113.7
652	L	73.4	Confident	76.3	Confident	23 Å²	23	72.4 Å²	72.4	12%	0.12	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	21.7	177.5	-66.1	176.2	0	0	0	112.5	E640 C644 G650 D654 T657 C658 L661	E640-L652 HydrophobicContact CB-CD1 3.8Å; E640-L652 HydrophobicContact CB-CG 4.37Å; C644-L652 HydrophobicContact CB-CB 4.22Å; C644-L652 PolarHBondContact SG-O 2.04Å; G650-L652 VanDerWaalsContact C-N 3.27Å; G650-L652 PolarHBondContact O-N 3.05Å; L652-D654 PolarHBondContact O-N 3.49Å; L652-T657 HydrophobicContact CD2-CG2 3.95Å; L652-C658 WeakPolarHBondContact O-CB 3.29Å; L652-L661 HydrophobicContact CD2-CD1 3.8Å
653	A	67.3	Low	75.8	Confident	46 Å²	46	78.9 Å²	78.9	38%	0.38	39%	0.385	S	S	.	.			trans	-60.6	-15.3	-175.8	0	0	0	0	0	115.1	G650 N655	G650-A653 VanDerWaalsContact O-CB 3.29Å; G650-A653 WeakPolarHBondContact O-CB 3.24Å; G650-A653 PolarHBondContact O-N 3.43Å; A653-N655 PolarHBondContact O-N 2.93Å
654	D	75.5	Confident	75.6	Confident	87 Å²	87	79.3 Å²	79.3	47%	0.465	39%	0.388	S	S	.	.	S	Bend	trans	-68.4	125.4	171.7	172.9	46	0	0	0	111.7	L652 E656 T657 C658	L652-D654 PolarHBondContact O-N 3.49Å; D654-E656 PolarHBondContact O-N 2.86Å; D654-T657 PolarHBondContact O-N 3.06Å; D654-T657 WeakPolarHBondContact OD2-CB 3.37Å; D654-T657 PolarHBondContact OD2-N 2.97Å; D654-T657 PolarHBondContact OD2-OG1 3.04Å; D654-C658 WeakPolarHBondContact O-CB 3.41Å; D654-C658 PolarHBondContact O-N 3.06Å
655	N	66	Low	75.2	Confident	97 Å²	97	86.2 Å²	86.2	52%	0.519	42%	0.418	S	S	.	.	H	α-helix	trans	-65.3	-36.4	-169.6	-162.7	7.3	0	0	0	112.7	A653 Q659	A653-N655 PolarHBondContact O-N 2.93Å; N655-Q659 WeakPolarHBondContact O-CB 3.21Å; N655-Q659 VanDerWaalsContact O-CG 3.27Å; N655-Q659 WeakPolarHBondContact O-CG 3.39Å; N655-Q659 PolarHBondContact O-N 3.11Å; N655-Q659 VanDerWaalsContact O-N 3.11Å; N655-Q659 PolarHBondContact OD1-NE2 3.49Å
656	E	70.4	Confident	75.2	Confident	162 Å²	162	82.7 Å²	82.7	76%	0.757	41%	0.408	S	S	*	.	H	α-helix	trans	-68.2	-46	177.6	-73.9	-171.1	162	0	0	111.5	D654 R660	D654-E656 PolarHBondContact O-N 2.86Å; E656-R660 WeakPolarHBondContact O-CB 3.41Å; E656-R660 PolarHBondContact O-N 2.68Å
657	T	74.9	Confident	75.2	Confident	48 Å²	48	83.1 Å²	83.1	29%	0.294	41%	0.41	S	S	.	.	H	α-helix	trans	-68	-38.7	-178.5	-52.8	0	0	0	0	111.6	L652 D654 R660 L661	L652-T657 HydrophobicContact CD2-CG2 3.95Å; D654-T657 PolarHBondContact O-N 3.06Å; D654-T657 WeakPolarHBondContact OD2-CB 3.37Å; D654-T657 PolarHBondContact OD2-N 2.97Å; D654-T657 PolarHBondContact OD2-OG1 3.04Å; T657-R660 PolarHBondContact O-N 3.11Å; T657-L661 HydrophobicContact CG2-CD1 3.74Å; T657-L661 PolarHBondContact O-N 2.81Å; T657-L661 VanDerWaalsContact O-N 3.12Å
658	C	79.1	Confident	75.3	Confident	2 Å²	2	82.5 Å²	82.5	1%	0.014	41%	0.412	C	S	.	.	H	α-helix	trans	-66.3	-47.4	177.9	-177.1	0	0	0	0	113.8	C644 L652 D654 R660 L661 C662	C644-C658 HydrophobicContact CB-CB 4.04Å; C644-C658 WeakPolarHBondContact CB-SG 3.38Å; C644-C658 WeakPolarHBondContact SG-CB 3.42Å; C644-C658 CovalentContact SG-SG 2Å; C644-C658 PolarHBondContact SG-SG 2.75Å; L652-C658 WeakPolarHBondContact O-CB 3.29Å; D654-C658 WeakPolarHBondContact O-CB 3.41Å; D654-C658 PolarHBondContact O-N 3.06Å; C658-R660 PolarHBondContact O-N 2.03Å; C658-L661 PolarHBondContact O-N 3.3Å; C658-C662 VanDerWaalsContact O-CB 3.24Å; C658-C662 WeakPolarHBondContact O-CB 2.95Å; C658-C662 PolarHBondContact O-N 3.28Å
659	Q	74.4	Confident	75.6	Confident	106 Å²	106	78.5 Å²	78.5	50%	0.495	39%	0.392	S	S	.	.	H	α-helix	trans	-63.6	-31.8	178.3	-72.6	-179.1	15.2	0	0	112	N655	N655-Q659 WeakPolarHBondContact O-CB 3.21Å; N655-Q659 VanDerWaalsContact O-CG 3.27Å; N655-Q659 WeakPolarHBondContact O-CG 3.39Å; N655-Q659 PolarHBondContact O-N 3.11Å; N655-Q659 VanDerWaalsContact O-N 3.11Å; N655-Q659 PolarHBondContact OD1-NE2 3.49Å
660	R	72.4	Confident	75.7	Confident	148 Å²	148	85 Å²	85	56%	0.558	42%	0.418	S	S	*	.	H	α-helix	trans	-73.7	-45.1	179.6	-169	177.8	67.5	133.4	2.6	113.3	E656 T657 C658 K663	E656-R660 WeakPolarHBondContact O-CB 3.41Å; E656-R660 PolarHBondContact O-N 2.68Å; T657-R660 PolarHBondContact O-N 3.11Å; C658-R660 PolarHBondContact O-N 2.03Å; R660-K663 VanDerWaalsContact O-CE 3.3Å; R660-K663 WeakPolarHBondContact O-CE 3.28Å
661	L	71.3	Confident	75.8	Confident	99 Å²	99	87.1 Å²	87.1	52%	0.518	43%	0.427	S	S	.	.	H	α-helix	trans	-87.6	-33.1	-174.2	-70.7	165.2	0	0	0	113.1	L652 T657 C658 K663	L652-L661 HydrophobicContact CD2-CD1 3.8Å; T657-L661 HydrophobicContact CG2-CD1 3.74Å; T657-L661 PolarHBondContact O-N 2.81Å; T657-L661 VanDerWaalsContact O-N 3.12Å; C658-L661 PolarHBondContact O-N 3.3Å; L661-K663 PolarHBondContact O-N 2.75Å
662	C	77.5	Confident	76	Confident	2 Å²	2	78.5 Å²	78.5	1%	0.014	40%	0.397	C	S	.	.			trans	-99.8	76.7	-175.3	-59.7	0	0	0	0	111.2	C641 R645 C658	C641-C662 WeakPolarHBondContact CA-SG 3.47Å; C641-C662 HydrophobicContact CB-CB 3.57Å; C641-C662 WeakPolarHBondContact CB-SG 3.24Å; C641-C662 WeakPolarHBondContact SG-CA 3.42Å; C641-C662 WeakPolarHBondContact SG-CB 3Å; C641-C662 CovalentContact SG-SG 2.04Å; C641-C662 PolarHBondContact SG-SG 3.43Å; R645-C662 HydrophobicContact CG-CB 4.27Å; R645-C662 PolarHBondContact NE-O 3.35Å; R645-C662 PolarHBondContact NH2-O 3Å; C658-C662 VanDerWaalsContact O-CB 3.24Å; C658-C662 WeakPolarHBondContact O-CB 2.95Å; C658-C662 PolarHBondContact O-N 3.28Å
663	K	74.4	Confident	75.6	Confident	136 Å²	136	84.4 Å²	84.4	59%	0.591	42%	0.424	S	S	*	.			trans	-88.7	-6.3	179.6	-62.7	-173.2	179.8	-175.8	0	113.8	D415 R660 L661	D415-K663 IonicContact OD1-NZ 3.51Å; D415-K663 IonicContact OD2-NZ 2.67Å; D415-K663 PolarHBondContact OD2-NZ 2.79Å; R660-K663 VanDerWaalsContact O-CE 3.3Å; R660-K663 WeakPolarHBondContact O-CE 3.28Å; L661-K663 PolarHBondContact O-N 2.75Å
664	D	79.1	Confident	75.1	Confident	35 Å²	35	88.3 Å²	88.3	19%	0.187	44%	0.439	C	S	.	.	S	Bend	trans	-66.3	145.8	-179.8	-63.7	-51.9	0	0	0	112.3	K638 I666 S704 L706	K638-D664 IonicContact NZ-OD1 3.23Å; K638-D664 IonicContact NZ-OD2 2.79Å; K638-D664 PolarHBondContact NZ-OD2 3.02Å; D664-I666 PolarHBondContact O-N 2.78Å; D664-S704 PolarHBondContact OD1-OG 2.83Å; D664-S704 PolarHBondContact OD2-OG 3.49Å; D664-L706 HydrophobicContact CB-CD1 3.62Å; D664-L706 HydrophobicContact CB-CG 4.4Å
665	K	78.5	Confident	74.3	Confident	147 Å²	147	92 Å²	92	64%	0.639	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	117.7	176.5	-172.4	177.6	-179.4	-179.8	0	109.1	L706	K665-L706 PolarHBondContact O-N 2.9Å
666	I	83.5	Confident	74	Confident	42 Å²	42	91.6 Å²	91.6	22%	0.215	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.1	177.2	-56.4	172.4	0	0	0	109.1	R645 L646 D664 L706 A708	R645-I666 HydrophobicContact CB-CD1 3.57Å; R645-I666 HydrophobicContact CG-CD1 3.86Å; L646-I666 HydrophobicContact CD1-CG2 3.89Å; L646-I666 HydrophobicContact CG-CG2 4.37Å; D664-I666 PolarHBondContact O-N 2.78Å; I666-L706 CarbonylContact C-O 3.45Å; I666-L706 WeakPolarHBondContact CA-O 3.29Å; I666-L706 HydrophobicContact CG1-CB 4.16Å; I666-L706 HydrophobicContact CG1-CD1 4.03Å; I666-A708 HydrophobicContact CG2-CB 4.44Å
667	I	83.1	Confident	73.5	Confident	70 Å²	70	90.3 Å²	90.3	36%	0.359	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.9	173.7	-57	174.5	0	0	0	107.5	V669 I705 L706 T707 A708	I667-V669 HydrophobicContact CG2-CG1 4.35Å; I667-I705 HydrophobicContact CD1-CG2 3.88Å; I667-I705 HydrophobicContact CG1-CG2 4.43Å; I667-L706 PolarHBondContact N-O 2.75Å; I667-T707 CarbonylContact O-C 3.57Å; I667-T707 VanDerWaalsContact O-CA 3.31Å; I667-T707 WeakPolarHBondContact O-CA 3.46Å; I667-A708 PolarHBondContact O-N 3.44Å
668	T	81.5	Confident	72.9	Confident	65 Å²	65	91.3 Å²	91.3	40%	0.399	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132.5	176.4	49.9	0	0	0	0	110.6	L646 A708	L646-T668 HydrophobicContact CD1-CG2 4.27Å; L646-T668 HydrophobicContact CD2-CG2 3.39Å; L646-T668 HydrophobicContact CG-CG2 4.49Å; T668-A708 CarbonylContact C-O 3.57Å; T668-A708 VanDerWaalsContact CA-O 3.29Å; T668-A708 WeakPolarHBondContact CA-O 2.95Å
669	V	83.6	Confident	72.5	Confident	39 Å²	39	92.7 Å²	92.7	24%	0.236	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.2	178.7	-64.1	0	0	0	0	111.4	I667 S671 L672 T707 A708 L709 Q710	I667-V669 HydrophobicContact CG2-CG1 4.35Å; V669-S671 WeakPolarHBondContact CG2-O 3.44Å; V669-L672 HydrophobicContact CG2-CD2 3.86Å; V669-L672 HydrophobicContact CG2-CG 4.05Å; V669-T707 HydrophobicContact CB-CG2 4.4Å; V669-T707 HydrophobicContact CG1-CG2 3.7Å; V669-T707 HydrophobicContact CG2-CG2 3.74Å; V669-A708 PolarHBondContact N-O 2.79Å; V669-L709 CarbonylContact O-C 3.43Å; V669-L709 WeakPolarHBondContact O-CA 3.01Å; V669-Q710 PolarHBondContact O-N 3.3Å
670	E	78.3	Confident	72.7	Confident	176 Å²	176	90.5 Å²	90.5	82%	0.822	48%	0.475	S	S	*	.	S	Bend	trans	-74.4	-33.5	176.3	-66.9	-178	177	0	0	112.1
671	S	77.2	Confident	73.3	Confident	80 Å²	80	87 Å²	87	56%	0.559	47%	0.467	S	S	*	.	S	Bend	trans	-139.1	141.9	174.9	56.1	0	0	0	0	111	V669	V669-S671 WeakPolarHBondContact CG2-O 3.44Å
672	L	74.6	Confident	73.9	Confident	38 Å²	38	82.4 Å²	82.4	20%	0.199	44%	0.443	C	S	.	.			trans	-92.4	112.1	174.4	-77.7	162.3	0	0	0	109.6	V669 K693 T695 T707 L709	V669-L672 HydrophobicContact CG2-CD2 3.86Å; V669-L672 HydrophobicContact CG2-CG 4.05Å; L672-K693 HydrophobicContact CD1-CB 3.53Å; L672-K693 WeakPolarHBondContact CD1-O 3.34Å; L672-T695 HydrophobicContact CD2-CG2 4.26Å; L672-T707 HydrophobicContact CD2-CG2 3.93Å; L672-L709 HydrophobicContact CD1-CD1 4.38Å; L672-L709 HydrophobicContact CD1-CD2 4.15Å; L672-L709 HydrophobicContact CD1-CG 3.78Å; L672-L709 HydrophobicContact CG-CD2 4.05Å; L672-L709 HydrophobicContact CG-CG 4.2Å
673	E	64.6	Low	74.3	Confident	148 Å²	148	86.3 Å²	86.3	69%	0.692	47%	0.467	S	S	*	.			trans	-88.4	125.7	170.5	-65.8	-178.1	162.8	0	0	109.7	E675	E673-E675 VanDerWaalsContact C-N 3.25Å; E673-E675 HydrophobicContact CB-CG 4.29Å; E673-E675 PolarHBondContact O-N 3.04Å; E673-E675 VanDerWaalsContact O-N 3.09Å
674	N	58.1	Low	74.8	Confident	127 Å²	127	80.7 Å²	80.7	68%	0.679	44%	0.442	S	S	*	.			trans	-84.4	59.5	178.4	-75.7	-28.7	0	0	0	110.9
675	E	57.3	Low	75	Confident	166 Å²	166	84.5 Å²	84.5	78%	0.776	46%	0.457	S	S	*	.			trans	-89.5	-20.4	-178.9	-68.1	-152.1	147.1	0	0	114.1	E673 P677	E673-E675 VanDerWaalsContact C-N 3.25Å; E673-E675 HydrophobicContact CB-CG 4.29Å; E673-E675 PolarHBondContact O-N 3.04Å; E673-E675 VanDerWaalsContact O-N 3.09Å; E675-P677 WeakPolarHBondContact O-CD 3.07Å
676	D	61	Low	75	Confident	88 Å²	88	78.7 Å²	78.7	47%	0.471	43%	0.434	S	S	.	.			trans	-104.5	109.9	-173.4	-155.2	-24.7	0	0	0	112.5	A678 A679	D676-A678 PolarHBondContact O-N 2.85Å; D676-A678 VanDerWaalsContact O-N 3.13Å; D676-A678 PolarHBondContact OD1-N 3.1Å; D676-A679 HydrophobicContact CB-CB 4.2Å; D676-A679 PolarHBondContact O-N 2.82Å; D676-A679 VanDerWaalsContact O-N 3.12Å
677	P	59.9	Low	74.4	Confident	135 Å²	135	85.6 Å²	85.6	88%	0.877	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-11	-178.4	26.5	-33.6	0	0	0	113.9	E675	E675-P677 WeakPolarHBondContact O-CD 3.07Å
678	A	61.8	Low	73.8	Confident	68 Å²	68	89 Å²	89	56%	0.562	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-10.8	175.3	0	0	0	0	0	113.7	D676 L697	D676-A678 PolarHBondContact O-N 2.85Å; D676-A678 VanDerWaalsContact O-N 3.13Å; D676-A678 PolarHBondContact OD1-N 3.1Å; A678-L697 HydrophobicContact CB-CD1 3.91Å
679	A	70.9	Confident	73.5	Confident	31 Å²	31	91.3 Å²	91.3	26%	0.256	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-86.8	132.1	-177.9	0	0	0	0	0	111.6	D676 L697	D676-A679 HydrophobicContact CB-CB 4.2Å; D676-A679 PolarHBondContact O-N 2.82Å; D676-A679 VanDerWaalsContact O-N 3.12Å; A679-L697 HydrophobicContact CB-CD1 4.1Å
680	V	78.9	Confident	73.4	Confident	60 Å²	60	89.9 Å²	89.9	36%	0.364	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.5	177.7	178.8	0	0	0	0	109.3	T695 Y696	V680-T695 VanDerWaalsContact O-CA 3.3Å; V680-T695 WeakPolarHBondContact O-CA 2.94Å; V680-Y696 HydrophobicContact CB-CD1 3.81Å; V680-Y696 HydrophobicContact CB-CE1 3.39Å; V680-Y696 HydrophobicContact CG1-CD1 4.17Å; V680-Y696 HydrophobicContact CG1-CE1 3.52Å; V680-Y696 HydrophobicContact CG2-CE1 4.04Å; V680-Y696 PolarHBondContact N-O 3.44Å; V680-Y696 PolarHBondContact O-N 2.84Å
681	L	83.6	Confident	73.8	Confident	76 Å²	76	84.2 Å²	84.2	40%	0.398	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	117.8	176	-179.9	67.2	0	0	0	110.7	V683 T695	L681-V683 HydrophobicContact CD2-CG2 4.42Å; L681-V683 HydrophobicContact CG-CG2 4.14Å; L681-T695 HydrophobicContact CB-CG2 4.33Å; L681-T695 HydrophobicContact CD1-CG2 3.75Å
682	C	85	Confident	74.2	Confident	2 Å²	2	80.4 Å²	80.4	1%	0.014	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.3	174.5	-61.1	0	0	0	0	110.4	C635 K693 F694	C635-C682 VanDerWaalsContact CA-SG 3.51Å; C635-C682 HydrophobicContact CB-CB 3.71Å; C635-C682 WeakPolarHBondContact CB-SG 3.29Å; C635-C682 WeakPolarHBondContact SG-CB 3.41Å; C635-C682 CovalentContact SG-SG 2.04Å; C635-C682 PolarHBondContact SG-SG 2.89Å; C682-K693 WeakPolarHBondContact O-CA 3.43Å; C682-F694 HydrophobicContact CB-CD1 3.81Å; C682-F694 HydrophobicContact CB-CD2 3.99Å; C682-F694 HydrophobicContact CB-CE1 3.37Å; C682-F694 HydrophobicContact CB-CE2 3.56Å; C682-F694 HydrophobicContact CB-CG 4.12Å; C682-F694 HydrophobicContact CB-CZ 3.24Å; C682-F694 PolarHBondContact N-O 3.31Å; C682-F694 PolarHBondContact O-N 3.37Å; C682-F694 VanDerWaalsContact O-O 3.08Å
683	V	85.3	Confident	74.9	Confident	83 Å²	83	81.1 Å²	81.1	50%	0.503	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.5	-178.9	-173.7	0	0	0	0	109.3	L681 V691 M692 K693	L681-V683 HydrophobicContact CD2-CG2 4.42Å; L681-V683 HydrophobicContact CG-CG2 4.14Å; V683-V691 HydrophobicContact CG1-CG1 3.44Å; V683-V691 VanDerWaalsContact CG1-CG1 3.44Å; V683-M692 WeakPolarHBondContact CA-O 3.36Å; V683-K693 HydrophobicContact CG1-CG 4.14Å; V683-K693 HydrophobicContact CG2-CG 4.09Å
684	Y	84.5	Confident	76	Confident	19 Å²	19	74.1 Å²	74.1	8%	0.075	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.6	175	72.1	-85.6	0	0	0	112.2	R639 I642 E643 T686 M692 F694	R639-Y684 HydrophobicContact CB-CD1 4.43Å; R639-Y684 HydrophobicContact CB-CE1 4.42Å; R639-Y684 HydrophobicContact CG-CD1 3.93Å; R639-Y684 HydrophobicContact CG-CD2 4.11Å; R639-Y684 HydrophobicContact CG-CE1 3.86Å; R639-Y684 HydrophobicContact CG-CE2 4.05Å; R639-Y684 HydrophobicContact CG-CG 4.04Å; R639-Y684 VanDerWaalsContact CZ-CD2 3.46Å; R639-Y684 VanDerWaalsContact NE-CD2 3.3Å; I642-Y684 HydrophobicContact CG2-CE1 4.44Å; I642-Y684 WeakPolarHBondContact CG2-OH 3.32Å; E643-Y684 HydrophobicContact CG-CE2 4.04Å; E643-Y684 WeakPolarHBondContact CG-OH 3.47Å; E643-Y684 VanDerWaalsContact OE1-CE2 3.29Å; E643-Y684 WeakPolarHBondContact OE1-CE2 3.33Å; Y684-T686 HydrophobicContact CE2-CG2 4.16Å; Y684-M692 HydrophobicContact CD1-CB 4.07Å; Y684-M692 HydrophobicContact CD1-CG 4.38Å; Y684-M692 HydrophobicContact CD2-CB 4.4Å; Y684-M692 HydrophobicContact CE1-CB 3.66Å; Y684-M692 HydrophobicContact CE1-CG 3.57Å; Y684-M692 HydrophobicContact CE2-CB 4.02Å; Y684-M692 HydrophobicContact CE2-CG 4.47Å; Y684-M692 HydrophobicContact CG-CB 4.43Å; Y684-M692 PolarHBondContact N-O 2.79Å; Y684-M692 PolarHBondContact O-N 3.22Å; Y684-F694 HydrophobicContact CD1-CD1 4.22Å; Y684-F694 AromaticContact CD1-CE1 3.91Å; Y684-F694 HydrophobicContact CD1-CE1 3.91Å; Y684-F694 HydrophobicContact CE1-CD1 4.01Å; Y684-F694 AromaticContact CE1-CE1 3.91Å; Y684-F694 HydrophobicContact CE1-CE1 3.91Å
685	K	82.8	Confident	77.3	Confident	114 Å²	114	69 Å²	69	50%	0.496	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	131.6	177.9	-155.8	-176.2	-164.4	-162.2	0	109.9	D689 C690	K685-D689 VanDerWaalsContact CE-CG 3.43Å; K685-D689 WeakPolarHBondContact CE-OD1 3.46Å; K685-D689 IonicContact NZ-OD1 2.9Å; K685-D689 PolarHBondContact NZ-OD1 3.22Å; K685-D689 IonicContact NZ-OD2 2.69Å; K685-D689 PolarHBondContact NZ-OD2 3.08Å; K685-C690 WeakPolarHBondContact CA-O 3.33Å
686	T	78.5	Confident	78.5	Confident	26 Å²	26	61.9 Å²	61.9	16%	0.16	34%	0.344	C	S	.	.			trans	-84.8	166.4	175.1	67.5	0	0	0	0	111.3	Y684 N688 D689 C690 M692 P712	Y684-T686 HydrophobicContact CE2-CG2 4.16Å; T686-N688 PolarHBondContact O-N 2.84Å; T686-D689 PolarHBondContact O-N 2.82Å; T686-D689 VanDerWaalsContact O-N 3.14Å; T686-C690 PolarHBondContact N-O 3.47Å; T686-C690 PolarHBondContact OG1-N 2.82Å; T686-C690 PolarHBondContact OG1-O 3.17Å; T686-M692 HydrophobicContact CG2-CB 3.82Å; T686-P712 HydrophobicContact CG2-CB 4.14Å
687	E	71.3	Confident	79.3	Confident	187 Å²	187	60.1 Å²	60.1	87%	0.874	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.4	179.5	-65.4	-172.3	163.4	0	0	113.5	D689	E687-D689 PolarHBondContact O-N 2.8Å
688	N	71.1	Confident	79.7	Confident	140 Å²	140	59.8 Å²	59.8	75%	0.749	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	19.6	178.4	-66.6	-27	0	0	0	113.4	T686 C690	T686-N688 PolarHBondContact O-N 2.84Å; N688-C690 PolarHBondContact O-N 3.43Å; N688-C690 VanDerWaalsContact O-N 3.15Å; N688-C690 PolarHBondContact O-SG 2.96Å; N688-C690 VanDerWaalsContact O-SG 3.4Å
689	D	74.4	Confident	79.5	Confident	115 Å²	115	60.9 Å²	60.9	62%	0.615	32%	0.315	S	S	*	.	S	Bend	trans	62.3	16.9	-179.3	-112	33.8	0	0	0	115.2	K685 T686 E687	K685-D689 VanDerWaalsContact CE-CG 3.43Å; K685-D689 WeakPolarHBondContact CE-OD1 3.46Å; K685-D689 IonicContact NZ-OD1 2.9Å; K685-D689 PolarHBondContact NZ-OD1 3.22Å; K685-D689 IonicContact NZ-OD2 2.69Å; K685-D689 PolarHBondContact NZ-OD2 3.08Å; T686-D689 PolarHBondContact O-N 2.82Å; T686-D689 VanDerWaalsContact O-N 3.14Å; E687-D689 PolarHBondContact O-N 2.8Å
690	C	83	Confident	78.3	Confident	9 Å²	9	64.7 Å²	64.7	6%	0.061	35%	0.346	C	S	.	.			trans	-93.4	161.9	175.5	-50.7	0	0	0	0	111.7	K685 T686 N688 P712 C714	K685-C690 WeakPolarHBondContact CA-O 3.33Å; T686-C690 PolarHBondContact N-O 3.47Å; T686-C690 PolarHBondContact OG1-N 2.82Å; T686-C690 PolarHBondContact OG1-O 3.17Å; N688-C690 PolarHBondContact O-N 3.43Å; N688-C690 VanDerWaalsContact O-N 3.15Å; N688-C690 PolarHBondContact O-SG 2.96Å; N688-C690 VanDerWaalsContact O-SG 3.4Å; C690-P712 HydrophobicContact CB-CB 3.8Å; C690-P712 HydrophobicContact CB-CG 4.12Å; C690-C714 HydrophobicContact CB-CB 3.99Å; C690-C714 WeakPolarHBondContact CB-SG 3.33Å; C690-C714 WeakPolarHBondContact SG-CB 3.04Å; C690-C714 CovalentContact SG-SG 2.03Å; C690-C714 PolarHBondContact SG-SG 2.95Å
691	V	85.9	Confident	76.5	Confident	56 Å²	56	64 Å²	64	34%	0.339	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.5	-178.3	-178.6	0	0	0	0	109.9	V683 K693 E713	V683-V691 HydrophobicContact CG1-CG1 3.44Å; V683-V691 VanDerWaalsContact CG1-CG1 3.44Å; V691-K693 HydrophobicContact CG1-CG 4.28Å; V691-E713 PolarHBondContact N-O 2.94Å; V691-E713 PolarHBondContact O-N 3.23Å
692	M	86	Confident	74.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	135.2	172	-169.5	66.2	177.6	0	0	109.8	I642 F647 V683 Y684 T686 A708 L709 P712	I642-M692 HydrophobicContact CG2-CE 4.11Å; F647-M692 HydrophobicContact CE2-CE 3.83Å; F647-M692 HydrophobicContact CE2-SD 4.18Å; F647-M692 HydrophobicContact CZ-CE 3.87Å; F647-M692 HydrophobicContact CZ-SD 4.04Å; V683-M692 WeakPolarHBondContact CA-O 3.36Å; Y684-M692 HydrophobicContact CD1-CB 4.07Å; Y684-M692 HydrophobicContact CD1-CG 4.38Å; Y684-M692 HydrophobicContact CD2-CB 4.4Å; Y684-M692 HydrophobicContact CE1-CB 3.66Å; Y684-M692 HydrophobicContact CE1-CG 3.57Å; Y684-M692 HydrophobicContact CE2-CB 4.02Å; Y684-M692 HydrophobicContact CE2-CG 4.47Å; Y684-M692 HydrophobicContact CG-CB 4.43Å; Y684-M692 PolarHBondContact N-O 2.79Å; Y684-M692 PolarHBondContact O-N 3.22Å; T686-M692 HydrophobicContact CG2-CB 3.82Å; M692-A708 HydrophobicContact CE-CB 4Å; M692-L709 HydrophobicContact CE-CB 4.32Å; M692-L709 WeakPolarHBondContact CE-O 3.38Å; M692-L709 HydrophobicContact SD-CB 4.3Å; M692-P712 HydrophobicContact SD-CB 4.15Å
693	K	88.3	Confident	73.7	Confident	54 Å²	54	71.5 Å²	71.5	24%	0.235	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.4	176.2	-57.2	177.5	-168.8	153.1	0	109.3	L672 C682 V683 V691 L709 E713	L672-K693 HydrophobicContact CD1-CB 3.53Å; L672-K693 WeakPolarHBondContact CD1-O 3.34Å; C682-K693 WeakPolarHBondContact O-CA 3.43Å; V683-K693 HydrophobicContact CG1-CG 4.14Å; V683-K693 HydrophobicContact CG2-CG 4.09Å; V691-K693 HydrophobicContact CG1-CG 4.28Å; K693-L709 HydrophobicContact CB-CD1 3.82Å; K693-L709 HydrophobicContact CB-CG 4.37Å; K693-L709 HydrophobicContact CD-CD1 4.33Å; K693-L709 HydrophobicContact CG-CD1 4.21Å; K693-L709 PolarHBondContact O-N 2.86Å; K693-L709 VanDerWaalsContact O-N 3.15Å; K693-E713 WeakPolarHBondContact CE-OE2 3.42Å; K693-E713 IonicContact NZ-OE1 3.75Å; K693-E713 PolarHBondContact NZ-OE1 3.24Å; K693-E713 IonicContact NZ-OE2 3.73Å; K693-E713 PolarHBondContact NZ-OE2 3.06Å
694	F	88.1	Confident	72.9	Confident	1 Å²	1	67.7 Å²	67.7	0%	0.004	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.7	170.4	69.5	-85.9	0	0	0	110.1	K638 R639 I642 C682 Y684 L706 T707 A708	K638-F694 HydrophobicContact CB-CE2 3.88Å; K638-F694 HydrophobicContact CB-CZ 4.13Å; R639-F694 HydrophobicContact CB-CE1 4.33Å; R639-F694 HydrophobicContact CB-CZ 4.41Å; I642-F694 HydrophobicContact CD1-CB 3.5Å; I642-F694 HydrophobicContact CD1-CD1 3.43Å; I642-F694 VanDerWaalsContact CD1-CD1 3.43Å; I642-F694 HydrophobicContact CD1-CD2 3.41Å; I642-F694 VanDerWaalsContact CD1-CD2 3.41Å; I642-F694 HydrophobicContact CD1-CE1 3.88Å; I642-F694 HydrophobicContact CD1-CE2 3.87Å; I642-F694 HydrophobicContact CD1-CG 3.15Å; I642-F694 HydrophobicContact CD1-CZ 4.07Å; C682-F694 HydrophobicContact CB-CD1 3.81Å; C682-F694 HydrophobicContact CB-CD2 3.99Å; C682-F694 HydrophobicContact CB-CE1 3.37Å; C682-F694 HydrophobicContact CB-CE2 3.56Å; C682-F694 HydrophobicContact CB-CG 4.12Å; C682-F694 HydrophobicContact CB-CZ 3.24Å; C682-F694 PolarHBondContact N-O 3.31Å; C682-F694 PolarHBondContact O-N 3.37Å; C682-F694 VanDerWaalsContact O-O 3.08Å; Y684-F694 HydrophobicContact CD1-CD1 4.22Å; Y684-F694 AromaticContact CD1-CE1 3.91Å; Y684-F694 HydrophobicContact CD1-CE1 3.91Å; Y684-F694 HydrophobicContact CE1-CD1 4.01Å; Y684-F694 AromaticContact CE1-CE1 3.91Å; Y684-F694 HydrophobicContact CE1-CE1 3.91Å; F694-L706 HydrophobicContact CD2-CD2 3.76Å; F694-L706 HydrophobicContact CE2-CD2 3.77Å; F694-T707 CarbonylContact C-O 3.5Å; F694-T707 WeakPolarHBondContact CA-O 3.06Å; F694-T707 WeakPolarHBondContact CB-O 3.39Å; F694-A708 HydrophobicContact CB-CB 3.81Å
695	T	85.3	Confident	72.7	Confident	18 Å²	18	70 Å²	70	11%	0.11	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	145.4	168.4	54.9	0	0	0	0	109.2	L672 V680 L681 L706 T707	L672-T695 HydrophobicContact CD2-CG2 4.26Å; V680-T695 VanDerWaalsContact O-CA 3.3Å; V680-T695 WeakPolarHBondContact O-CA 2.94Å; L681-T695 HydrophobicContact CB-CG2 4.33Å; L681-T695 HydrophobicContact CD1-CG2 3.75Å; T695-L706 WeakPolarHBondContact O-CA 2.98Å; T695-T707 PolarHBondContact N-O 3.21Å; T695-T707 PolarHBondContact O-N 3.5Å
696	Y	83.2	Confident	72.8	Confident	17 Å²	17	64.6 Å²	64.6	7%	0.067	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.2	166.7	84.6	-92	0	0	0	109.8	A634 V680 I705	A634-Y696 HydrophobicContact CB-CE1 4.33Å; A634-Y696 WeakPolarHBondContact CB-OH 3.48Å; V680-Y696 HydrophobicContact CB-CD1 3.81Å; V680-Y696 HydrophobicContact CB-CE1 3.39Å; V680-Y696 HydrophobicContact CG1-CD1 4.17Å; V680-Y696 HydrophobicContact CG1-CE1 3.52Å; V680-Y696 HydrophobicContact CG2-CE1 4.04Å; V680-Y696 PolarHBondContact N-O 3.44Å; V680-Y696 PolarHBondContact O-N 2.84Å; Y696-I705 WeakPolarHBondContact CA-O 3.43Å
697	L	76.6	Confident	73.1	Confident	52 Å²	52	65 Å²	65	27%	0.272	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.2	173.8	-170.9	80.2	0	0	0	107.7	A678 A679 S704 I705	A678-L697 HydrophobicContact CB-CD1 3.91Å; A679-L697 HydrophobicContact CB-CD1 4.1Å; L697-S704 WeakPolarHBondContact O-CA 3.01Å; L697-I705 PolarHBondContact N-O 2.8Å; L697-I705 PolarHBondContact O-N 3.46Å
698	E	68.2	Low	73.8	Confident	127 Å²	127	56.1 Å²	56.1	59%	0.593	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.8	176.9	-156.6	166.7	-157.2	0	0	108.8
699	H	57.8	Low	74.5	Confident	91 Å²	91	49.7 Å²	49.7	42%	0.421	28%	0.279	S	S	.	.			trans	-76	152.7	177.9	-154.8	61.3	0	0	0	109.7	S701 G702 R703	H699-S701 PolarHBondContact CD2-OG 3.48Å; H699-S701 PolarHBondContact O-N 2.03Å; H699-G702 PolarHBondContact O-N 3.44Å; H699-R703 WeakPolarHBondContact CB-O 3.33Å; H699-R703 PolarHBondContact N-O 3.29Å; H699-R703 VanDerWaalsContact N-O 3.17Å
700	A	46.4	Very low	74.8	Confident	112 Å²	112	49.4 Å²	49.4	93%	0.926	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-10.9	177.4	0	0	0	0	0	114.1
701	S	41.9	Very low	74.6	Confident	45 Å²	45	56.3 Å²	56.3	32%	0.315	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	2.6	176.5	64.9	0	0	0	0	115.2	H699 R703	H699-S701 PolarHBondContact CD2-OG 3.48Å; H699-S701 PolarHBondContact O-N 2.03Å; S701-R703 PolarHBondContact O-N 2.03Å
702	G	49.7	Very low	74.4	Confident	61 Å²	61	55.2 Å²	55.2	63%	0.629	30%	0.299	S	S	*	.	S	Bend	trans	76.2	2.7	-179.6	0	0	0	0	0	115	H699	H699-G702 PolarHBondContact O-N 3.44Å
703	R	59.1	Low	74.2	Confident	175 Å²	175	60 Å²	60	66%	0.66	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-89.3	127.5	167.8	-75	-177	176.6	171.1	-0.7	109.3	H699 S701	H699-R703 WeakPolarHBondContact CB-O 3.33Å; H699-R703 PolarHBondContact N-O 3.29Å; H699-R703 VanDerWaalsContact N-O 3.17Å; S701-R703 PolarHBondContact O-N 2.03Å
704	S	68.9	Low	73.7	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.6	174.2	73.9	0	0	0	0	111.1	K638 D664 L697	K638-S704 WeakPolarHBondContact CE-OG 3.48Å; K638-S704 PolarHBondContact NZ-OG 2.87Å; D664-S704 PolarHBondContact OD1-OG 2.83Å; D664-S704 PolarHBondContact OD2-OG 3.49Å; L697-S704 WeakPolarHBondContact O-CA 3.01Å
705	I	79.8	Confident	72.5	Confident	68 Å²	68	65.1 Å²	65.1	35%	0.349	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.9	172.3	-60.6	175.4	0	0	0	106.8	I667 Y696 L697	I667-I705 HydrophobicContact CD1-CG2 3.88Å; I667-I705 HydrophobicContact CG1-CG2 4.43Å; Y696-I705 WeakPolarHBondContact CA-O 3.43Å; L697-I705 PolarHBondContact N-O 2.8Å; L697-I705 PolarHBondContact O-N 3.46Å
706	L	84.9	Confident	71.2	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.5	177.5	-69.2	157.6	0	0	0	108.1	K638 I642 D664 K665 I666 I667 F694 T695	K638-L706 HydrophobicContact CB-CD2 3.85Å; K638-L706 HydrophobicContact CD-CD1 4.4Å; K638-L706 HydrophobicContact CD-CD2 4.38Å; K638-L706 HydrophobicContact CG-CD2 4.18Å; I642-L706 HydrophobicContact CD1-CD2 4.47Å; D664-L706 HydrophobicContact CB-CD1 3.62Å; D664-L706 HydrophobicContact CB-CG 4.4Å; K665-L706 PolarHBondContact O-N 2.9Å; I666-L706 CarbonylContact C-O 3.45Å; I666-L706 WeakPolarHBondContact CA-O 3.29Å; I666-L706 HydrophobicContact CG1-CB 4.16Å; I666-L706 HydrophobicContact CG1-CD1 4.03Å; I667-L706 PolarHBondContact N-O 2.75Å; F694-L706 HydrophobicContact CD2-CD2 3.76Å; F694-L706 HydrophobicContact CE2-CD2 3.77Å; T695-L706 WeakPolarHBondContact O-CA 2.98Å
707	T	85.9	Confident	70.1	Confident	34 Å²	34	70.3 Å²	70.3	21%	0.209	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	113	172.2	-53.2	0	0	0	0	107.9	I667 V669 L672 F694 T695	I667-T707 CarbonylContact O-C 3.57Å; I667-T707 VanDerWaalsContact O-CA 3.31Å; I667-T707 WeakPolarHBondContact O-CA 3.46Å; V669-T707 HydrophobicContact CB-CG2 4.4Å; V669-T707 HydrophobicContact CG1-CG2 3.7Å; V669-T707 HydrophobicContact CG2-CG2 3.74Å; L672-T707 HydrophobicContact CD2-CG2 3.93Å; F694-T707 CarbonylContact C-O 3.5Å; F694-T707 WeakPolarHBondContact CA-O 3.06Å; F694-T707 WeakPolarHBondContact CB-O 3.39Å; T695-T707 PolarHBondContact N-O 3.21Å; T695-T707 PolarHBondContact O-N 3.5Å
708	A	86.1	Confident	69.2	Low	0 Å²	0	73 Å²	73	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	151.5	-172.9	0	0	0	0	0	111.2	I642 L646 I666 I667 T668 V669 M692 F694	I642-A708 HydrophobicContact CD1-CB 4.03Å; L646-A708 HydrophobicContact CD1-CB 4.02Å; I666-A708 HydrophobicContact CG2-CB 4.44Å; I667-A708 PolarHBondContact O-N 3.44Å; T668-A708 CarbonylContact C-O 3.57Å; T668-A708 VanDerWaalsContact CA-O 3.29Å; T668-A708 WeakPolarHBondContact CA-O 2.95Å; V669-A708 PolarHBondContact N-O 2.79Å; M692-A708 HydrophobicContact CE-CB 4Å; F694-A708 HydrophobicContact CB-CB 3.81Å
709	L	84.8	Confident	68.9	Low	5 Å²	5	70 Å²	70	3%	0.026	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	141.8	171	-72.7	173.1	0	0	0	111	V669 L672 M692 K693 E713	V669-L709 CarbonylContact O-C 3.43Å; V669-L709 WeakPolarHBondContact O-CA 3.01Å; L672-L709 HydrophobicContact CD1-CD1 4.38Å; L672-L709 HydrophobicContact CD1-CD2 4.15Å; L672-L709 HydrophobicContact CD1-CG 3.78Å; L672-L709 HydrophobicContact CG-CD2 4.05Å; L672-L709 HydrophobicContact CG-CG 4.2Å; M692-L709 HydrophobicContact CE-CB 4.32Å; M692-L709 WeakPolarHBondContact CE-O 3.38Å; M692-L709 HydrophobicContact SD-CB 4.3Å; K693-L709 HydrophobicContact CB-CD1 3.82Å; K693-L709 HydrophobicContact CB-CG 4.37Å; K693-L709 HydrophobicContact CD-CD1 4.33Å; K693-L709 HydrophobicContact CG-CD1 4.21Å; K693-L709 PolarHBondContact O-N 2.86Å; K693-L709 VanDerWaalsContact O-N 3.15Å; L709-E713 HydrophobicContact CD1-CG 4.15Å
710	Q	80.5	Confident	69.3	Low	109 Å²	109	69.9 Å²	69.9	51%	0.509	47%	0.468	S	S	.	.	S	Bend	trans	-67.8	-39.3	177.2	-174.4	172.4	-5.8	0	0	112.1	V669	V669-Q710 PolarHBondContact O-N 3.3Å
711	E	78.4	Confident	70.4	Confident	155 Å²	155	70.1 Å²	70.1	72%	0.724	45%	0.452	S	S	*	.	S	Bend	trans	-129	142.3	173.7	-66.7	-171.4	170	0	0	110.1
712	P	82.1	Confident	71.9	Confident	32 Å²	32	71.5 Å²	71.5	21%	0.208	46%	0.459	C	S	.	.			trans	-67.6	141.9	177.2	28.4	-33.6	0	0	0	110.8	T686 C690 M692 C714	T686-P712 HydrophobicContact CG2-CB 4.14Å; C690-P712 HydrophobicContact CB-CB 3.8Å; C690-P712 HydrophobicContact CB-CG 4.12Å; M692-P712 HydrophobicContact SD-CB 4.15Å; P712-C714 PolarHBondContact O-N 3.22Å
713	E	81.9	Confident	73.1	Confident	100 Å²	100	72.2 Å²	72.2	47%	0.467	45%	0.451	S	S	.	.	B	Isolated β-bridge	trans	-70.9	105.6	177.6	-72.3	174.6	-156.9	0	0	109.6	V691 K693 L709	V691-E713 PolarHBondContact N-O 2.94Å; V691-E713 PolarHBondContact O-N 3.23Å; K693-E713 WeakPolarHBondContact CE-OE2 3.42Å; K693-E713 IonicContact NZ-OE1 3.75Å; K693-E713 PolarHBondContact NZ-OE1 3.24Å; K693-E713 IonicContact NZ-OE2 3.73Å; K693-E713 PolarHBondContact NZ-OE2 3.06Å; L709-E713 HydrophobicContact CD1-CG 4.15Å
714	C	77.6	Confident	73.9	Confident	79 Å²	79	69 Å²	69	53%	0.534	45%	0.446	S	S	.	.			trans	-99.1	135.8	173.5	-54.3	0	0	0	0	109.8	C690 P712 G716	C690-C714 HydrophobicContact CB-CB 3.99Å; C690-C714 WeakPolarHBondContact CB-SG 3.33Å; C690-C714 WeakPolarHBondContact SG-CB 3.04Å; C690-C714 CovalentContact SG-SG 2.03Å; C690-C714 PolarHBondContact SG-SG 2.95Å; P712-C714 PolarHBondContact O-N 3.22Å; C714-G716 PolarHBondContact O-N 3.43Å
715	G	64.3	Low	74.4	Confident	85 Å²	85	74 Å²	74	88%	0.876	47%	0.473	S	S	*	.			trans	-65.9	106.9	175.2	0	0	0	0	0	111.4
716	G	58.2	Low	74.4	Confident	76 Å²	76	73.7 Å²	73.7	78%	0.784	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-73	129.3	170.8	0	0	0	0	0	111	C714	C714-G716 PolarHBondContact O-N 3.43Å
717	G	58.3	Low	74.5	Confident	67 Å²	67	77.2 Å²	77.2	69%	0.691	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-59.7	154.2	167.9	0	0	0	0	0	111.4	S719	G717-S719 PolarHBondContact O-N 3.18Å
718	P	59.3	Low	74.5	Confident	108 Å²	108	79 Å²	79	70%	0.701	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-58.7	134.6	-178.3	22.7	-31.5	0	0	0	110.9	V723	P718-V723 HydrophobicContact CB-CG2 4.35Å; P718-V723 HydrophobicContact CG-CG2 4.42Å
719	S	61.8	Low	74.6	Confident	65 Å²	65	80.8 Å²	80.8	46%	0.455	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-59.3	140.4	-177.9	67.3	0	0	0	0	110.9	G717 L721 T722 V723	G717-S719 PolarHBondContact O-N 3.18Å; S719-L721 PolarHBondContact O-N 2.73Å; S719-T722 PolarHBondContact N-OG1 3.48Å; S719-T722 PolarHBondContact O-N 2.76Å; S719-T722 PolarHBondContact O-OG1 3.38Å; S719-T722 PolarHBondContact OG-N 2.91Å; S719-T722 PolarHBondContact OG-OG1 2.85Å; S719-V723 PolarHBondContact O-N 3.04Å
720	A	65.4	Low	74.7	Confident	89 Å²	89	84.5 Å²	84.5	74%	0.736	55%	0.553	S	S	*	*	H	α-helix	trans	-52.7	-29.3	178.3	0	0	0	0	0	112.8	L724	A720-L724 VanDerWaalsContact O-CB 3.32Å; A720-L724 WeakPolarHBondContact O-CB 3.19Å; A720-L724 PolarHBondContact O-N 2.63Å
721	L	69.7	Low	75.2	Confident	116 Å²	116	84.7 Å²	84.7	61%	0.607	56%	0.557	S	S	*	*	H	α-helix	trans	-66.3	-41.4	175.9	-166.2	79.3	0	0	0	113	S719 L724 L725	S719-L721 PolarHBondContact O-N 2.73Å; L721-L724 PolarHBondContact O-N 3.1Å; L721-L725 HydrophobicContact CG-CD1 4.29Å; L721-L725 WeakPolarHBondContact O-CB 3.44Å; L721-L725 VanDerWaalsContact O-CG 3.31Å; L721-L725 WeakPolarHBondContact O-CG 3.43Å; L721-L725 PolarHBondContact O-N 2.81Å
722	T	72.3	Confident	75.6	Confident	74 Å²	74	82.9 Å²	82.9	45%	0.454	55%	0.551	S	S	.	*	H	α-helix	trans	-70.1	-38.6	179.6	39.6	0	0	0	0	111.6	S719 A726	S719-T722 PolarHBondContact N-OG1 3.48Å; S719-T722 PolarHBondContact O-N 2.76Å; S719-T722 PolarHBondContact O-OG1 3.38Å; S719-T722 PolarHBondContact OG-N 2.91Å; S719-T722 PolarHBondContact OG-OG1 2.85Å; T722-A726 WeakPolarHBondContact O-CB 3.39Å; T722-A726 PolarHBondContact O-N 2.02Å
723	V	75.3	Confident	75.9	Confident	76 Å²	76	87 Å²	87	46%	0.461	57%	0.571	S	S	.	*	H	α-helix	trans	-64	-43.6	172.9	-178.6	0	0	0	0	110.9	P718 S719 A726 V727	P718-V723 HydrophobicContact CB-CG2 4.35Å; P718-V723 HydrophobicContact CG-CG2 4.42Å; S719-V723 PolarHBondContact O-N 3.04Å; V723-A726 PolarHBondContact O-N 2.57Å; V723-V727 VanDerWaalsContact O-CG2 3.31Å; V723-V727 WeakPolarHBondContact O-CG2 2.99Å; V723-V727 PolarHBondContact O-N 3.49Å
724	L	75.5	Confident	76.3	Confident	107 Å²	107	86.3 Å²	86.3	56%	0.56	57%	0.573	S	S	*	*	H	α-helix	trans	-61.9	-46.4	178	-169.5	76.9	0	0	0	112	A720 L721 A726 V727 V728	A720-L724 VanDerWaalsContact O-CB 3.32Å; A720-L724 WeakPolarHBondContact O-CB 3.19Å; A720-L724 PolarHBondContact O-N 2.63Å; L721-L724 PolarHBondContact O-N 3.1Å; L724-A726 VanDerWaalsContact C-N 3.35Å; L724-A726 PolarHBondContact O-N 3.19Å; L724-V727 PolarHBondContact O-N 2.82Å; L724-V728 WeakPolarHBondContact O-CB 3.09Å; L724-V728 VanDerWaalsContact O-CG2 3.29Å; L724-V728 WeakPolarHBondContact O-CG2 3.48Å; L724-V728 PolarHBondContact O-N 3.24Å
725	L	80	Confident	76.9	Confident	110 Å²	110	84 Å²	84	58%	0.576	56%	0.563	S	S	*	*	H	α-helix	trans	-64.5	-38.5	178.9	-73.7	171.8	0	0	0	112.2	L721 G729	L721-L725 HydrophobicContact CG-CD1 4.29Å; L721-L725 WeakPolarHBondContact O-CB 3.44Å; L721-L725 VanDerWaalsContact O-CG 3.31Å; L721-L725 WeakPolarHBondContact O-CG 3.43Å; L721-L725 PolarHBondContact O-N 2.81Å; L725-G729 PolarHBondContact O-N 3.24Å
726	A	80.6	Confident	78	Confident	61 Å²	61	84.5 Å²	84.5	50%	0.504	55%	0.549	S	S	.	.	H	α-helix	trans	-64	-42.9	176.2	0	0	0	0	0	111.8	T722 V723 L724 T730	T722-A726 WeakPolarHBondContact O-CB 3.39Å; T722-A726 PolarHBondContact O-N 2.02Å; V723-A726 PolarHBondContact O-N 2.57Å; L724-A726 VanDerWaalsContact C-N 3.35Å; L724-A726 PolarHBondContact O-N 3.19Å; A726-T730 PolarHBondContact O-N 2.84Å; A726-T730 PolarHBondContact O-OG1 3.09Å
727	V	86.3	Confident	79.5	Confident	73 Å²	73	84.7 Å²	84.7	44%	0.442	54%	0.535	S	S	.	.	H	α-helix	trans	-67.9	-45.7	178.1	173.9	0	0	0	0	111.3	V723 L724 G729 T730 I731	V723-V727 VanDerWaalsContact O-CG2 3.31Å; V723-V727 WeakPolarHBondContact O-CG2 2.99Å; V723-V727 PolarHBondContact O-N 3.49Å; L724-V727 PolarHBondContact O-N 2.82Å; V727-G729 PolarHBondContact O-N 2.87Å; V727-T730 WeakPolarHBondContact CA-OG1 3.41Å; V727-T730 PolarHBondContact O-N 3.02Å; V727-T730 PolarHBondContact O-OG1 2.03Å; V727-I731 HydrophobicContact CG1-CD1 3.91Å; V727-I731 VanDerWaalsContact O-CG1 3.29Å; V727-I731 WeakPolarHBondContact O-CG1 3.43Å; V727-I731 PolarHBondContact O-N 2.97Å
728	V	87.1	Confident	81	Confident	72 Å²	72	86.8 Å²	86.8	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-64.8	-41.8	178	173.5	0	0	0	0	111	L724 T730 I731 L732	L724-V728 WeakPolarHBondContact O-CB 3.09Å; L724-V728 VanDerWaalsContact O-CG2 3.29Å; L724-V728 WeakPolarHBondContact O-CG2 3.48Å; L724-V728 PolarHBondContact O-N 3.24Å; V728-T730 PolarHBondContact O-N 3.09Å; V728-I731 PolarHBondContact O-N 3Å; V728-L732 HydrophobicContact CG1-CD1 4.04Å; V728-L732 PolarHBondContact O-N 3.35Å
729	G	87.3	Confident	82.4	Confident	37 Å²	37	86.9 Å²	86.9	38%	0.381	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-41.8	176.6	0	0	0	0	0	112.8	L725 V727 L732 L733	L725-G729 PolarHBondContact O-N 3.24Å; V727-G729 PolarHBondContact O-N 2.87Å; G729-L732 PolarHBondContact O-N 3.45Å; G729-L733 WeakPolarHBondContact O-CB 3.29Å; G729-L733 PolarHBondContact O-N 3.25Å
730	T	87.2	Confident	83.5	Confident	83 Å²	83	86.5 Å²	86.5	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-40.8	176.6	30	0	0	0	0	112.4	A726 V727 V728 L732 L733 V734	A726-T730 PolarHBondContact O-N 2.84Å; A726-T730 PolarHBondContact O-OG1 3.09Å; V727-T730 WeakPolarHBondContact CA-OG1 3.41Å; V727-T730 PolarHBondContact O-N 3.02Å; V727-T730 PolarHBondContact O-OG1 2.03Å; V728-T730 PolarHBondContact O-N 3.09Å; T730-L732 PolarHBondContact O-N 3.26Å; T730-L733 PolarHBondContact O-N 3.49Å; T730-V734 VanDerWaalsContact O-CG2 3.3Å; T730-V734 WeakPolarHBondContact O-CG2 3.46Å; T730-V734 PolarHBondContact O-N 3.13Å
731	I	90.4	Very high	84.5	Confident	114 Å²	114	85.5 Å²	85.5	59%	0.585	51%	0.509	S	S	*	.	H	α-helix	trans	-61.8	-45.6	176.2	-67.4	166.9	0	0	0	110.9	V727 V728 V734 G735	V727-I731 HydrophobicContact CG1-CD1 3.91Å; V727-I731 VanDerWaalsContact O-CG1 3.29Å; V727-I731 WeakPolarHBondContact O-CG1 3.43Å; V727-I731 PolarHBondContact O-N 2.97Å; V728-I731 PolarHBondContact O-N 3Å; I731-V734 PolarHBondContact O-N 2.75Å; I731-G735 PolarHBondContact O-N 3.32Å
732	L	88.1	Confident	85.5	Confident	116 Å²	116	87.7 Å²	87.7	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-43.9	177.3	-83	165.5	0	0	0	111.9	V728 G729 T730 V734 G735 V736	V728-L732 HydrophobicContact CG1-CD1 4.04Å; V728-L732 PolarHBondContact O-N 3.35Å; G729-L732 PolarHBondContact O-N 3.45Å; T730-L732 PolarHBondContact O-N 3.26Å; L732-V734 PolarHBondContact O-N 3.31Å; L732-G735 PolarHBondContact O-N 3.43Å; L732-V736 WeakPolarHBondContact O-CG2 3.28Å; L732-V736 PolarHBondContact O-N 2.85Å
733	L	88	Confident	86.2	Confident	120 Å²	120	91.3 Å²	91.3	63%	0.628	52%	0.519	S	S	*	.	H	α-helix	trans	-61.6	-45.3	179	-164.2	101.8	0	0	0	111.4	G729 T730 G735 V736 V737	G729-L733 WeakPolarHBondContact O-CB 3.29Å; G729-L733 PolarHBondContact O-N 3.25Å; T730-L733 PolarHBondContact O-N 3.49Å; L733-G735 VanDerWaalsContact C-N 3.32Å; L733-G735 PolarHBondContact O-N 3.41Å; L733-V736 PolarHBondContact O-N 3.48Å; L733-V737 VanDerWaalsContact O-CG2 3.32Å; L733-V737 WeakPolarHBondContact O-CG2 3.09Å; L733-V737 PolarHBondContact O-N 2.85Å
734	V	90.6	Very high	86.7	Confident	84 Å²	84	92.9 Å²	92.9	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-42.1	176.4	172.4	0	0	0	0	110.8	T730 I731 L732 V736 V737 L738	T730-V734 VanDerWaalsContact O-CG2 3.3Å; T730-V734 WeakPolarHBondContact O-CG2 3.46Å; T730-V734 PolarHBondContact O-N 3.13Å; I731-V734 PolarHBondContact O-N 2.75Å; L732-V734 PolarHBondContact O-N 3.31Å; V734-V736 PolarHBondContact O-N 3.49Å; V734-V737 PolarHBondContact O-N 3.31Å; V734-L738 HydrophobicContact CG1-CD1 4.07Å; V734-L738 WeakPolarHBondContact O-CG 2.92Å; V734-L738 PolarHBondContact O-N 3.4Å
735	G	88.6	Confident	87.3	Confident	32 Å²	32	92.2 Å²	92.2	33%	0.33	53%	0.525	S	S	.	.	H	α-helix	trans	-59.3	-44.3	174.9	0	0	0	0	0	113.1	I731 L732 L733 L738 L739	I731-G735 PolarHBondContact O-N 3.32Å; L732-G735 PolarHBondContact O-N 3.43Å; L733-G735 VanDerWaalsContact C-N 3.32Å; L733-G735 PolarHBondContact O-N 3.41Å; G735-L738 PolarHBondContact O-N 3.4Å; G735-L739 WeakPolarHBondContact O-CG 3.49Å; G735-L739 PolarHBondContact O-N 2.94Å
736	V	88.7	Confident	87.7	Confident	95 Å²	95	90.4 Å²	90.4	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-66.1	-40.8	177.6	173.2	0	0	0	0	111.6	L732 L733 V734 L739 A740	L732-V736 WeakPolarHBondContact O-CG2 3.28Å; L732-V736 PolarHBondContact O-N 2.85Å; L733-V736 PolarHBondContact O-N 3.48Å; V734-V736 PolarHBondContact O-N 3.49Å; V736-L739 PolarHBondContact O-N 3.26Å; V736-A740 WeakPolarHBondContact O-CB 3.37Å; V736-A740 PolarHBondContact O-N 3.07Å
737	V	88.7	Confident	87.9	Confident	79 Å²	79	90.8 Å²	90.8	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-40.5	177.2	172.2	0	0	0	0	111.3	L733 V734 A740 T741	L733-V737 VanDerWaalsContact O-CG2 3.32Å; L733-V737 WeakPolarHBondContact O-CG2 3.09Å; L733-V737 PolarHBondContact O-N 2.85Å; V734-V737 PolarHBondContact O-N 3.31Å; V737-A740 PolarHBondContact O-N 3.35Å; V737-T741 HydrophobicContact CG1-CG2 4.49Å; V737-T741 WeakPolarHBondContact O-CB 2.99Å; V737-T741 WeakPolarHBondContact O-CG2 3.31Å; V737-T741 PolarHBondContact O-N 2.02Å; V737-T741 PolarHBondContact O-OG1 3.11Å
738	L	89.1	Confident	87.9	Confident	112 Å²	112	91.1 Å²	91.1	59%	0.586	51%	0.509	S	S	*	.	H	α-helix	trans	-65.2	-40	175.2	-73.1	172.3	0	0	0	112.1	V734 G735 T741 W742	V734-L738 HydrophobicContact CG1-CD1 4.07Å; V734-L738 WeakPolarHBondContact O-CG 2.92Å; V734-L738 PolarHBondContact O-N 3.4Å; G735-L738 PolarHBondContact O-N 3.4Å; L738-T741 VanDerWaalsContact CA-OG1 3.32Å; L738-T741 WeakPolarHBondContact CA-OG1 2.98Å; L738-T741 PolarHBondContact O-OG1 2.83Å; L738-W742 VanDerWaalsContact O-CB 3.27Å; L738-W742 WeakPolarHBondContact O-CB 3.19Å; L738-W742 PolarHBondContact O-N 3.11Å
739	L	88.6	Confident	87.7	Confident	109 Å²	109	93.1 Å²	93.1	57%	0.571	51%	0.514	S	S	*	.	H	α-helix	trans	-67.5	-39.8	174.8	-72.9	172	0	0	0	112.3	G735 V736 W742 K743	G735-L739 WeakPolarHBondContact O-CG 3.49Å; G735-L739 PolarHBondContact O-N 2.94Å; V736-L739 PolarHBondContact O-N 3.26Å; L739-W742 HydrophobicContact CD2-CE3 4.3Å; L739-W742 PolarHBondContact O-N 3.29Å; L739-K743 VanDerWaalsContact O-CB 3.29Å; L739-K743 WeakPolarHBondContact O-CB 3.25Å; L739-K743 PolarHBondContact O-N 3.27Å
740	A	85.4	Confident	87.4	Confident	57 Å²	57	96.4 Å²	96.4	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-66.2	-43.6	177.2	0	0	0	0	0	111.5	V736 V737 K743 L744	V736-A740 WeakPolarHBondContact O-CB 3.37Å; V736-A740 PolarHBondContact O-N 3.07Å; V737-A740 PolarHBondContact O-N 3.35Å; A740-K743 PolarHBondContact O-N 3.47Å; A740-L744 VanDerWaalsContact O-CB 3.3Å; A740-L744 WeakPolarHBondContact O-CB 3.28Å; A740-L744 PolarHBondContact O-N 2.84Å
741	T	87.1	Confident	87.2	Confident	69 Å²	69	101.6 Å²	101.6	42%	0.423	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-42.6	175.4	47.5	0	0	0	0	111.6	V737 L738 K743 L744 V745	V737-T741 HydrophobicContact CG1-CG2 4.49Å; V737-T741 WeakPolarHBondContact O-CB 2.99Å; V737-T741 WeakPolarHBondContact O-CG2 3.31Å; V737-T741 PolarHBondContact O-N 2.02Å; V737-T741 PolarHBondContact O-OG1 3.11Å; L738-T741 VanDerWaalsContact CA-OG1 3.32Å; L738-T741 WeakPolarHBondContact CA-OG1 2.98Å; L738-T741 PolarHBondContact O-OG1 2.83Å; T741-K743 PolarHBondContact O-N 3.24Å; T741-L744 PolarHBondContact O-N 3.24Å; T741-V745 VanDerWaalsContact O-CG2 3.3Å; T741-V745 WeakPolarHBondContact O-CG2 3.49Å; T741-V745 PolarHBondContact O-N 3.38Å
742	W	89.6	Confident	86.8	Confident	161 Å²	161	104.5 Å²	104.5	61%	0.61	54%	0.536	S	S	*	.	H	α-helix	trans	-58.5	-47.6	172.7	176.5	62.6	0	0	0	112	L738 L739 L744 V745 I746	L738-W742 VanDerWaalsContact O-CB 3.27Å; L738-W742 WeakPolarHBondContact O-CB 3.19Å; L738-W742 PolarHBondContact O-N 3.11Å; L739-W742 HydrophobicContact CD2-CE3 4.3Å; L739-W742 PolarHBondContact O-N 3.29Å; W742-L744 VanDerWaalsContact C-N 3.33Å; W742-L744 PolarHBondContact O-N 3.36Å; W742-V745 PolarHBondContact O-N 3.25Å; W742-I746 HydrophobicContact CD2-CD1 4.25Å; W742-I746 VanDerWaalsContact CE2-CD1 3.44Å; W742-I746 HydrophobicContact CH2-CD1 4.4Å; W742-I746 HydrophobicContact CZ2-CD1 3.54Å; W742-I746 PolarHBondContact O-N 3.27Å
743	K	88.4	Confident	86.4	Confident	150 Å²	150	103.1 Å²	103.1	65%	0.652	53%	0.527	S	S	*	.	H	α-helix	trans	-63.9	-37.9	177.5	-170.1	160.1	-177	169.7	0	112	L739 A740 T741 T747	L739-K743 VanDerWaalsContact O-CB 3.29Å; L739-K743 WeakPolarHBondContact O-CB 3.25Å; L739-K743 PolarHBondContact O-N 3.27Å; A740-K743 PolarHBondContact O-N 3.47Å; T741-K743 PolarHBondContact O-N 3.24Å; K743-T747 VanDerWaalsContact O-CB 3.29Å; K743-T747 WeakPolarHBondContact O-CB 3.41Å; K743-T747 PolarHBondContact O-N 3.44Å; K743-T747 PolarHBondContact O-OG1 2.02Å
744	L	86.3	Confident	86	Confident	109 Å²	109	103.2 Å²	103.2	57%	0.571	52%	0.522	S	S	*	.	H	α-helix	trans	-64.7	-45.8	175.4	-166.3	106.1	0	0	0	111.3	A740 T741 W742 T747 I748	A740-L744 VanDerWaalsContact O-CB 3.3Å; A740-L744 WeakPolarHBondContact O-CB 3.28Å; A740-L744 PolarHBondContact O-N 2.84Å; T741-L744 PolarHBondContact O-N 3.24Å; W742-L744 VanDerWaalsContact C-N 3.33Å; W742-L744 PolarHBondContact O-N 3.36Å; L744-T747 PolarHBondContact O-N 3.42Å; L744-I748 HydrophobicContact CD2-CD1 3.85Å; L744-I748 HydrophobicContact CG-CD1 4.09Å; L744-I748 VanDerWaalsContact O-CG1 3.28Å; L744-I748 WeakPolarHBondContact O-CG1 3.19Å; L744-I748 PolarHBondContact O-N 3.05Å
745	V	87.8	Confident	85.5	Confident	94 Å²	94	101.9 Å²	101.9	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-61.7	-46.3	177.8	170.4	0	0	0	0	111	T741 W742 I748 H749	T741-V745 VanDerWaalsContact O-CG2 3.3Å; T741-V745 WeakPolarHBondContact O-CG2 3.49Å; T741-V745 PolarHBondContact O-N 3.38Å; W742-V745 PolarHBondContact O-N 3.25Å; V745-I748 PolarHBondContact O-N 3.23Å; V745-H749 PolarHBondContact O-N 2.82Å
746	I	87.1	Confident	85	Confident	72 Å²	72	108.2 Å²	108.2	37%	0.369	53%	0.534	S	S	.	.	H	α-helix	trans	-61.7	-45.7	175.2	-71.8	-169.6	0	0	0	110.6	W742 I748 H749 D750	W742-I746 HydrophobicContact CD2-CD1 4.25Å; W742-I746 VanDerWaalsContact CE2-CD1 3.44Å; W742-I746 HydrophobicContact CH2-CD1 4.4Å; W742-I746 HydrophobicContact CZ2-CD1 3.54Å; W742-I746 PolarHBondContact O-N 3.27Å; I746-I748 VanDerWaalsContact C-N 3.27Å; I746-I748 PolarHBondContact O-N 3.42Å; I746-H749 PolarHBondContact O-N 2.8Å; I746-H749 VanDerWaalsContact O-N 3.1Å; I746-D750 WeakPolarHBondContact O-CB 3.46Å; I746-D750 PolarHBondContact O-N 3.39Å
747	T	85.8	Confident	84.3	Confident	69 Å²	69	109.5 Å²	109.5	42%	0.423	53%	0.532	S	S	.	.	H	α-helix	trans	-61.9	-36.3	180	-54.6	0	0	0	0	111.8	K743 L744 R751	K743-T747 VanDerWaalsContact O-CB 3.29Å; K743-T747 WeakPolarHBondContact O-CB 3.41Å; K743-T747 PolarHBondContact O-N 3.44Å; K743-T747 PolarHBondContact O-OG1 2.02Å; L744-T747 PolarHBondContact O-N 3.42Å; T747-R751 WeakPolarHBondContact O-CB 3.21Å; T747-R751 WeakPolarHBondContact O-CG 3.44Å; T747-R751 PolarHBondContact O-N 3.17Å
748	I	85.6	Confident	83.6	Confident	80 Å²	80	110.4 Å²	110.4	41%	0.41	53%	0.531	S	S	.	.	H	α-helix	trans	-69.6	-42.1	174.6	-69.8	167.4	0	0	0	110.8	L744 V745 I746 R751 R752	L744-I748 HydrophobicContact CD2-CD1 3.85Å; L744-I748 HydrophobicContact CG-CD1 4.09Å; L744-I748 VanDerWaalsContact O-CG1 3.28Å; L744-I748 WeakPolarHBondContact O-CG1 3.19Å; L744-I748 PolarHBondContact O-N 3.05Å; V745-I748 PolarHBondContact O-N 3.23Å; I746-I748 VanDerWaalsContact C-N 3.27Å; I746-I748 PolarHBondContact O-N 3.42Å; I748-R751 PolarHBondContact O-N 2.03Å; I748-R752 WeakPolarHBondContact O-CG 3.26Å; I748-R752 PolarHBondContact O-N 2.8Å
749	H	83.8	Confident	82.6	Confident	113 Å²	113	108.6 Å²	108.6	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-46.9	177	-169.2	-11.1	0	0	0	111.2	V745 I746 R751 R752 E753	V745-H749 PolarHBondContact O-N 2.82Å; I746-H749 PolarHBondContact O-N 2.8Å; I746-H749 VanDerWaalsContact O-N 3.1Å; H749-R751 PolarHBondContact O-N 3.13Å; H749-R752 PolarHBondContact O-N 3.26Å; H749-E753 PolarHBondContact O-N 3.3Å
750	D	81.6	Confident	81.7	Confident	106 Å²	106	106.3 Å²	106.3	57%	0.567	52%	0.524	S	S	*	.	H	α-helix	trans	-62.5	-41.1	176.4	-95.8	-1.4	0	0	0	111.6	I746 R752 E753 F754	I746-D750 WeakPolarHBondContact O-CB 3.46Å; I746-D750 PolarHBondContact O-N 3.39Å; D750-R752 VanDerWaalsContact C-N 3.33Å; D750-R752 PolarHBondContact O-N 2.83Å; D750-E753 PolarHBondContact O-N 2.68Å; D750-F754 WeakPolarHBondContact O-CB 3.46Å; D750-F754 PolarHBondContact O-N 3.4Å
751	R	81.6	Confident	80.8	Confident	193 Å²	193	110.1 Å²	110.1	73%	0.728	53%	0.527	S	S	*	.	H	α-helix	trans	-63.5	-37.6	174.4	-85.3	-170.8	163.8	-166.2	-2.9	112.6	T747 I748 H749 A755	T747-R751 WeakPolarHBondContact O-CB 3.21Å; T747-R751 WeakPolarHBondContact O-CG 3.44Å; T747-R751 PolarHBondContact O-N 3.17Å; I748-R751 PolarHBondContact O-N 2.03Å; H749-R751 PolarHBondContact O-N 3.13Å; R751-A755 VanDerWaalsContact O-CB 3.3Å; R751-A755 WeakPolarHBondContact O-CB 3.44Å; R751-A755 PolarHBondContact O-N 3.32Å
752	R	82.9	Confident	79.7	Confident	174 Å²	174	110.4 Å²	110.4	66%	0.657	53%	0.528	S	S	*	.	H	α-helix	trans	-68	-43.2	175.6	-80.1	-177.6	174.2	-179.4	-0.3	111.8	I748 H749 D750 A755 R756	I748-R752 WeakPolarHBondContact O-CG 3.26Å; I748-R752 PolarHBondContact O-N 2.8Å; H749-R752 PolarHBondContact O-N 3.26Å; D750-R752 VanDerWaalsContact C-N 3.33Å; D750-R752 PolarHBondContact O-N 2.83Å; R752-A755 PolarHBondContact O-N 3.07Å; R752-R756 WeakPolarHBondContact O-CG 3.5Å; R752-R756 PolarHBondContact O-N 3.36Å
753	E	80.3	Confident	78.3	Confident	88 Å²	88	113 Å²	113	41%	0.411	54%	0.538	S	S	.	.	H	α-helix	trans	-62.8	-44.6	174.2	-80	-69.4	125.5	0	0	111.1	H749 D750 A755 R756 F757	H749-E753 PolarHBondContact O-N 3.3Å; D750-E753 PolarHBondContact O-N 2.68Å; E753-A755 PolarHBondContact O-N 2.68Å; E753-R756 WeakPolarHBondContact O-CB 2.99Å; E753-R756 PolarHBondContact O-N 2.78Å; E753-R756 IonicContact OE1-NH1 3.05Å; E753-R756 PolarHBondContact OE1-NH1 2.95Å; E753-F757 WeakPolarHBondContact O-CB 3.28Å; E753-F757 PolarHBondContact O-N 2.88Å
754	F	79.4	Confident	76.9	Confident	121 Å²	121	109.5 Å²	109.5	53%	0.531	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-39.1	176.6	-172.9	-102.8	0	0	0	112.5	D750 F757 Q758	D750-F754 WeakPolarHBondContact O-CB 3.46Å; D750-F754 PolarHBondContact O-N 3.4Å; F754-F757 WeakPolarHBondContact O-CB 3.36Å; F754-F757 PolarHBondContact O-N 3.46Å; F754-Q758 HydrophobicContact CD1-CG 4.26Å; F754-Q758 HydrophobicContact CE1-CG 3.91Å; F754-Q758 HydrophobicContact CZ-CG 4.16Å; F754-Q758 VanDerWaalsContact CZ-NE2 3.29Å; F754-Q758 PolarHBondContact O-N 3.44Å
755	A	79.8	Confident	75.4	Confident	56 Å²	56	113.4 Å²	113.4	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-67.3	-38.3	174.3	0	0	0	0	0	112.4	R751 R752 E753 F757 Q758 S759	R751-A755 VanDerWaalsContact O-CB 3.3Å; R751-A755 WeakPolarHBondContact O-CB 3.44Å; R751-A755 PolarHBondContact O-N 3.32Å; R752-A755 PolarHBondContact O-N 3.07Å; E753-A755 PolarHBondContact O-N 2.68Å; A755-F757 VanDerWaalsContact C-N 3.33Å; A755-Q758 PolarHBondContact O-N 2.77Å; A755-S759 WeakPolarHBondContact O-CB 3.4Å; A755-S759 PolarHBondContact O-N 3.49Å; A755-S759 PolarHBondContact O-OG 2.92Å
756	R	77.2	Confident	73.7	Confident	166 Å²	166	118.1 Å²	118.1	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-61.7	-41.4	170.2	-76.1	178.4	-177.4	164.9	-4	111.4	R752 E753 S759 A760	R752-R756 WeakPolarHBondContact O-CG 3.5Å; R752-R756 PolarHBondContact O-N 3.36Å; E753-R756 WeakPolarHBondContact O-CB 2.99Å; E753-R756 PolarHBondContact O-N 2.78Å; E753-R756 IonicContact OE1-NH1 3.05Å; E753-R756 PolarHBondContact OE1-NH1 2.95Å; R756-S759 WeakPolarHBondContact CA-OG 3.05Å; R756-S759 PolarHBondContact O-OG 2.82Å; R756-A760 WeakPolarHBondContact O-CB 3.3Å; R756-A760 PolarHBondContact O-N 2.03Å
757	F	75.1	Confident	71.7	Confident	122 Å²	122	122.1 Å²	122.1	54%	0.535	57%	0.574	S	S	.	*	H	α-helix	trans	-65.8	-42.9	176.4	-175.1	-102.3	0	0	0	112.6	E753 F754 A755 A760 R761	E753-F757 WeakPolarHBondContact O-CB 3.28Å; E753-F757 PolarHBondContact O-N 2.88Å; F754-F757 WeakPolarHBondContact O-CB 3.36Å; F754-F757 PolarHBondContact O-N 3.46Å; A755-F757 VanDerWaalsContact C-N 3.33Å; F757-A760 PolarHBondContact O-N 3.43Å; F757-R761 VanDerWaalsContact CE1-CD 3.46Å; F757-R761 HydrophobicContact CE1-CG 4.2Å; F757-R761 HydrophobicContact CZ-CG 4.41Å; F757-R761 PolarHBondContact O-N 2.95Å
758	Q	73.2	Confident	69.7	Low	98 Å²	98	127.6 Å²	127.6	46%	0.458	60%	0.598	S	S	.	*	H	α-helix	trans	-67.4	-41	176.8	-76.6	-150.2	-3.9	0	0	112.8	F754 A755 A760 R761 V762	F754-Q758 HydrophobicContact CD1-CG 4.26Å; F754-Q758 HydrophobicContact CE1-CG 3.91Å; F754-Q758 HydrophobicContact CZ-CG 4.16Å; F754-Q758 VanDerWaalsContact CZ-NE2 3.29Å; F754-Q758 PolarHBondContact O-N 3.44Å; A755-Q758 PolarHBondContact O-N 2.77Å; Q758-A760 VanDerWaalsContact C-N 3.31Å; Q758-A760 PolarHBondContact O-N 3.27Å; Q758-R761 PolarHBondContact O-N 3.4Å; Q758-R761 VanDerWaalsContact O-N 3.13Å; Q758-V762 WeakPolarHBondContact O-CG2 3.28Å; Q758-V762 PolarHBondContact O-N 3.38Å
759	S	69.1	Low	67.7	Low	74 Å²	74	127.8 Å²	127.8	52%	0.517	61%	0.611	S	S	.	*	H	α-helix	trans	-64.2	-35.9	175.2	49.9	0	0	0	0	112.1	A755 R756 R763	A755-S759 WeakPolarHBondContact O-CB 3.4Å; A755-S759 PolarHBondContact O-N 3.49Å; A755-S759 PolarHBondContact O-OG 2.92Å; R756-S759 WeakPolarHBondContact CA-OG 3.05Å; R756-S759 PolarHBondContact O-OG 2.82Å; S759-R763 WeakPolarHBondContact O-CB 3.33Å; S759-R763 PolarHBondContact O-N 2.93Å
760	A	69.3	Low	65.5	Low	60 Å²	60	128 Å²	128	50%	0.496	63%	0.625	S	S	.	*	H	α-helix	trans	-63.2	-42	169.1	0	0	0	0	0	112.6	R756 F757 Q758 A764	R756-A760 WeakPolarHBondContact O-CB 3.3Å; R756-A760 PolarHBondContact O-N 2.03Å; F757-A760 PolarHBondContact O-N 3.43Å; Q758-A760 VanDerWaalsContact C-N 3.31Å; Q758-A760 PolarHBondContact O-N 3.27Å; A760-A764 PolarHBondContact O-N 3.38Å
761	R	66.2	Low	63.6	Low	137 Å²	137	129.3 Å²	129.3	52%	0.517	63%	0.632	S	S	.	*	H	α-helix	trans	-66.3	-39.5	175.9	-79.2	-175.8	67	-179.5	3.5	113.6	F757 Q758 A764 R765	F757-R761 VanDerWaalsContact CE1-CD 3.46Å; F757-R761 HydrophobicContact CE1-CG 4.2Å; F757-R761 HydrophobicContact CZ-CG 4.41Å; F757-R761 PolarHBondContact O-N 2.95Å; Q758-R761 PolarHBondContact O-N 3.4Å; Q758-R761 VanDerWaalsContact O-N 3.13Å; R761-A764 PolarHBondContact O-N 3.18Å; R761-R765 PolarHBondContact O-N 3.39Å; R761-R765 VanDerWaalsContact O-N 3.15Å
762	V	64.5	Low	62.3	Low	76 Å²	76	125.9 Å²	125.9	46%	0.461	64%	0.635	S	S	.	*	H	α-helix	trans	-71.2	-36.9	179.2	173.1	0	0	0	0	111	Q758 A764 R765 Y766	Q758-V762 WeakPolarHBondContact O-CG2 3.28Å; Q758-V762 PolarHBondContact O-N 3.38Å; V762-A764 VanDerWaalsContact C-N 3.27Å; V762-A764 PolarHBondContact O-N 3.37Å; V762-R765 PolarHBondContact O-N 3.39Å; V762-R765 VanDerWaalsContact O-N 3.11Å; V762-Y766 HydrophobicContact CG1-CD2 3.95Å; V762-Y766 HydrophobicContact CG1-CE2 4.13Å; V762-Y766 PolarHBondContact O-N 3.23Å
763	R	60	Low	60.4	Low	214 Å²	214	125.3 Å²	125.3	81%	0.808	64%	0.644	S	S	*	*	H	α-helix	trans	-64.1	-32.6	173.5	-151.2	176.9	-147.5	176.5	5.6	112.5	S759	S759-R763 WeakPolarHBondContact O-CB 3.33Å; S759-R763 PolarHBondContact O-N 2.93Å
764	A	58.4	Low	58.8	Low	77 Å²	77	129.7 Å²	129.7	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-74.1	-26.5	173.1	0	0	0	0	0	113.5	A760 R761 V762	A760-A764 PolarHBondContact O-N 3.38Å; R761-A764 PolarHBondContact O-N 3.18Å; V762-A764 VanDerWaalsContact C-N 3.27Å; V762-A764 PolarHBondContact O-N 3.37Å
765	R	55.9	Low	57.5	Low	192 Å²	192	133.7 Å²	133.7	73%	0.725	68%	0.675	S	S	*	*	H	α-helix	trans	-84.6	-18.7	-179.9	-108.1	177.3	177.2	166.7	-3.2	114.7	R761 V762 L767	R761-R765 PolarHBondContact O-N 3.39Å; R761-R765 VanDerWaalsContact O-N 3.15Å; V762-R765 PolarHBondContact O-N 3.39Å; V762-R765 VanDerWaalsContact O-N 3.11Å; R765-L767 PolarHBondContact O-N 2.95Å
766	Y	50.5	Low	55.7	Low	192 Å²	192	136.3 Å²	136.3	75%	0.753	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-5.2	-177.5	-106.7	-86	0	0	0	115.6	V762	V762-Y766 HydrophobicContact CG1-CD2 3.95Å; V762-Y766 HydrophobicContact CG1-CE2 4.13Å; V762-Y766 PolarHBondContact O-N 3.23Å
767	L	45.3	Very low	54.1	Low	156 Å²	156	133.9 Å²	133.9	82%	0.817	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	1.8	176.1	-83.1	169.1	0	0	0	114.5	R765	R765-L767 PolarHBondContact O-N 2.95Å
768	M	43.8	Very low	53	Low	185 Å²	185	135.9 Å²	135.9	91%	0.911	70%	0.702	S	S	*	*			trans	-134.6	65.9	177.7	-69	-175.5	176.5	0	0	110.8
769	A	43.3	Very low	51.6	Low	84 Å²	84	137.1 Å²	137.1	69%	0.694	72%	0.716	S	S	*	*			trans	-129.3	106.4	158.2	0	0	0	0	0	108.7
770	S	37.8	Very low	50.2	Low	117 Å²	117	138.5 Å²	138.5	82%	0.818	72%	0.722	S	S	*	*			trans	178.9	123.7	133.5	42.4	0	0	0	0	110.7
771	N	42	Very low	48.6	Very low	134 Å²	134	143 Å²	143	72%	0.717	73%	0.732	S	S	*	*			trans	-135.5	120.6	137.7	-165.5	-13.7	0	0	0	108	L773	N771-L773 VanDerWaalsContact C-N 3.31Å; N771-L773 PolarHBondContact O-N 3Å; N771-L773 VanDerWaalsContact O-N 3.15Å
772	P	55.4	Low	47.2	Very low	121 Å²	121	145.4 Å²	145.4	79%	0.786	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	24.6	-159.9	-6.1	27	0	0	0	115.4
773	L	42.6	Very low	45.7	Very low	162 Å²	162	145.8 Å²	145.8	85%	0.848	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	12.5	-170.9	-82.3	167.6	0	0	0	115.7	N771	N771-L773 VanDerWaalsContact C-N 3.31Å; N771-L773 PolarHBondContact O-N 3Å; N771-L773 VanDerWaalsContact O-N 3.15Å
774	Y	47.1	Very low	44.7	Very low	179 Å²	179	144.3 Å²	144.3	70%	0.702	76%	0.76	S	S	*	*			trans	-112.1	115.1	-175.1	-158.3	-104.8	0	0	0	112.4	D776	Y774-D776 HydrophobicContact CD1-CB 4.3Å; Y774-D776 HydrophobicContact CE1-CB 3.64Å; Y774-D776 WeakPolarHBondContact CE1-OD2 3.35Å; Y774-D776 VanDerWaalsContact CZ-CG 3.43Å; Y774-D776 PolarHBondContact OH-OD1 2.89Å; Y774-D776 PolarHBondContact OH-OD2 3.39Å
775	K	50.3	Low	43.6	Very low	206 Å²	206	149.3 Å²	149.3	90%	0.896	77%	0.772	S	S	*	*			trans	-114.3	120.4	165.1	-95.4	-174.9	175.8	179.8	0	107.6
776	D	43.8	Very low	42.8	Very low	111 Å²	111	147.3 Å²	147.3	59%	0.594	77%	0.771	S	S	*	*			trans	-121.3	155	169.8	-108.9	-1	0	0	0	111.4	Y774	Y774-D776 HydrophobicContact CD1-CB 4.3Å; Y774-D776 HydrophobicContact CE1-CB 3.64Å; Y774-D776 WeakPolarHBondContact CE1-OD2 3.35Å; Y774-D776 VanDerWaalsContact CZ-CG 3.43Å; Y774-D776 PolarHBondContact OH-OD1 2.89Å; Y774-D776 PolarHBondContact OH-OD2 3.39Å
777	P	42.5	Very low	42.1	Very low	115 Å²	115	145.3 Å²	145.3	75%	0.747	78%	0.779	S	S	*	*			trans	-112.2	172.5	-142.7	13.2	11.3	0	0	0	113.2
778	I	51.9	Low	41.7	Very low	164 Å²	164	146.4 Å²	146.4	84%	0.841	78%	0.778	S	S	*	*			trans	-71.7	134.9	-178.8	-59.8	165.9	0	0	0	111.6
779	T	44.2	Very low	41.4	Very low	123 Å²	123	144.5 Å²	144.5	76%	0.755	77%	0.767	S	S	*	*			trans	-145.4	106.5	159.5	52.1	0	0	0	0	111.7
780	T	39.4	Very low	41.2	Very low	104 Å²	104	148 Å²	148	64%	0.638	77%	0.766	S	S	*	*				15.7	155.7	122.9	48.6	0	0	0	0	120.4
781	H	35.8	Very low	41.2	Very low	153 Å²	153	146.8 Å²	146.8	71%	0.708	76%	0.758	S	S	*	*			cis	-170	157.5	9.7	-102.8	-67.1	0	0	0	109
782	F	36.7	Very low	41	Very low	189 Å²	189	149.5 Å²	149.5	83%	0.829	76%	0.764	S	S	*	*			trans	19.5	156.9	135.1	-64.7	-108.4	0	0	0	120.9
783	A	34.1	Very low	40.4	Very low	84 Å²	84	151 Å²	151	69%	0.694	77%	0.765	S	S	*	*			cis	-168	161.8	24.7	0	0	0	0	0	111.3
784	E	38.4	Very low	40.2	Very low	182 Å²	182	147.1 Å²	147.1	85%	0.85	76%	0.764	S	S	*	*			trans	16.9	136.7	145	-83.5	163.6	171.9	0	0	123.2
785	M	34.7	Very low	39.6	Very low	182 Å²	182	141.9 Å²	141.9	90%	0.897	76%	0.764	S	S	*	*				-158	144.6	114.1	-121.4	-179.5	101.4	0	0	112.8
786	E	38.6	Very low	39.3	Very low	151 Å²	151	138.1 Å²	138.1	71%	0.706	76%	0.758	S	S	*	*			trans	-67.6	160.3	-173.9	-59.4	170	127.4	0	0	114.8
787	T	37.4	Very low	39.2	Very low	150 Å²	150	145 Å²	145	92%	0.92	79%	0.787	S	S	*	*				-158	131	124.5	10.1	0	0	0	0	111.6
788	F	36.5	Very low	39	Very low	178 Å²	178	146.5 Å²	146.5	78%	0.781	79%	0.789	S	S	*	*			trans	-82.7	146.3	172.6	-113.9	-104.7	0	0	0	110.6
789	E	37.1	Very low	38.3	Very low	145 Å²	145	145.6 Å²	145.6	68%	0.678	79%	0.786	S	S	*	*				167.7	126.5	110.3	-91.6	-155	127	0	0	114.5
790	K	38.6	Very low	38	Very low	159 Å²	159	146.8 Å²	146.8	69%	0.691	79%	0.787	S	S	*	*			trans	45	119.4	135.4	-69.2	174.7	-174.2	146.8	0	120.4
791	S	37.9	Very low	37.9	Very low	91 Å²	91	149.4 Å²	149.4	64%	0.636	80%	0.796	S	S	*	*				64.7	120.3	71.3	87.3	0	0	0	0	115.7
792	F	37.5	Very low	38	Very low	191 Å²	191	149.1 Å²	149.1	84%	0.838	80%	0.802	S	S	*	*				176.8	160.1	106.5	-126.2	-98.9	0	0	0	113.3
793	N	43.4	Very low	38.1	Very low	151 Å²	151	146.5 Å²	146.5	81%	0.807	80%	0.8	S	S	*	*			trans	-57.9	166.4	179.3	-73.9	-30.8	0	0	0	117.9
794	G	37.8	Very low	38.4	Very low	81 Å²	81	150.9 Å²	150.9	84%	0.835	81%	0.808	S	S	*	*			trans	152.8	132.9	147	0	0	0	0	0	109.5
795	G	35.2	Very low	38.4	Very low	69 Å²	69	148.5 Å²	148.5	71%	0.711	80%	0.804	S	S	*	*			cis	156.1	146.5	10.3	0	0	0	0	0	107.1
796	V	44.3	Very low	38.7	Very low	127 Å²	127	145.8 Å²	145.8	77%	0.77	80%	0.797	S	S	*	*			trans	51.5	101.7	151.1	-161.6	0	0	0	0	118.4
797	H	40.3	Very low	38.7	Very low	256 Å²	256	145.3 Å²	145.3	100%	1.185	81%	0.805	S	S	*	*				-173.4	0	106.3	-102.3	-62.1	0	0	0	110.9

Retrieved 797 of 797 residues in 160.8 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).