A0A087X6F7_POEFO Loading...

Alpha-N-acetylgalactosaminide alpha-2,6-sialyltransferase 5

Predominantly catalyzes the biosynthesis of ganglioside GD1alpha from GM1b in the brain, by transferring the sialyl group (N-acetyl-alpha-neuraminyl or NeuAc) from CMP-NeuAc to the GalNAc residue on the NeuAc-alpha-2,3-Gal-beta-1,3-GalNAc sequence of GM1b. GD1alpha is a critical molecule in the communication and interaction between neuronal cells and their supportive cells, particularly in brain tissues, and functions as an adhesion molecule in the process of metastasis. Also shows activity towards sialyl Lc4Cer (N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acyl-sphing-4-enine) generating disialyl Lc4Cer, which can lead to the synthesis of disialyl Lewis a (Le(a)), suggested to be a cancer-associated antigen.

AlphaFold DB , UniProt , Accession A0A087X6F7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 333 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.1	Very low	59.8	Low	226 Å²	226	128.5 Å²	128.5	100%	1.113	68%	0.682	S	S	*	*				0	128.3	0	-86.2	162.3	77.3	0	0	110.1
2	K	54.1	Low	61.2	Low	186 Å²	186	127 Å²	127	81%	0.809	67%	0.673	S	S	*	*			trans	65.7	77	157.5	-61.4	-178.4	178.8	178.1	0	120.1
3	T	55.7	Low	62.3	Low	106 Å²	106	125 Å²	125	65%	0.65	66%	0.662	S	S	*	*			trans	-147.1	-9.2	156.1	32.4	0	0	0	0	118.9
4	P	54.2	Low	63.3	Low	112 Å²	112	122.5 Å²	122.5	73%	0.727	65%	0.653	S	S	*	*	H	α-helix	trans	-82.6	-25.3	178.3	30	-30.3	0	0	0	113.5	R6	P4-R6 PolarHBondContact O-N 2.86Å
5	M	54.2	Low	64.2	Low	158 Å²	158	121.7 Å²	121.7	78%	0.778	65%	0.648	S	S	*	*	H	α-helix	trans	-68.7	-30.5	-179.8	-95.5	178.5	74.4	0	0	114.1	V9	M5-V9 VanDerWaalsContact O-CG2 3.28Å; M5-V9 WeakPolarHBondContact O-CG2 3.34Å; M5-V9 PolarHBondContact O-N 3.1Å
6	R	56.9	Low	64.8	Low	209 Å²	209	120.6 Å²	120.6	79%	0.789	64%	0.642	S	S	*	*	H	α-helix	trans	-71.1	-31.8	-177.9	-82.2	176.4	87.2	178	5.5	112.9	P4 A10	P4-R6 PolarHBondContact O-N 2.86Å; R6-A10 WeakPolarHBondContact O-CB 3.42Å; R6-A10 PolarHBondContact O-N 3Å
7	H	58.4	Low	65.5	Low	147 Å²	147	119.8 Å²	119.8	68%	0.681	64%	0.637	S	S	*	*	H	α-helix	trans	-75.7	-40.9	177.6	-79.4	70.2	0	0	0	111.6	V9 A10 V11	H7-V9 VanDerWaalsContact C-N 3.35Å; H7-V9 PolarHBondContact O-N 2.78Å; H7-A10 PolarHBondContact O-N 3.36Å; H7-V11 WeakPolarHBondContact O-CG2 3.28Å; H7-V11 PolarHBondContact O-N 2.96Å
8	G	64.9	Low	65.7	Low	47 Å²	47	116.8 Å²	116.8	49%	0.485	63%	0.627	S	S	.	*	H	α-helix	trans	-60.6	-42.1	175.6	0	0	0	0	0	112.9	L12	G8-L12 WeakPolarHBondContact O-CB 3.3Å; G8-L12 PolarHBondContact O-N 3.35Å; G8-L12 VanDerWaalsContact O-N 3.07Å
9	V	69.7	Low	65.9	Low	82 Å²	82	113.4 Å²	113.4	50%	0.497	62%	0.616	S	S	.	*	H	α-helix	trans	-69.7	-38.1	178.3	175.7	0	0	0	0	111.9	M5 H7 L12 L13	M5-V9 VanDerWaalsContact O-CG2 3.28Å; M5-V9 WeakPolarHBondContact O-CG2 3.34Å; M5-V9 PolarHBondContact O-N 3.1Å; H7-V9 VanDerWaalsContact C-N 3.35Å; H7-V9 PolarHBondContact O-N 2.78Å; V9-L12 PolarHBondContact O-N 3.38Å; V9-L13 HydrophobicContact CG1-CD1 4.02Å; V9-L13 HydrophobicContact CG1-CG 4.47Å; V9-L13 WeakPolarHBondContact O-CB 3.5Å; V9-L13 VanDerWaalsContact O-CG 3.3Å; V9-L13 WeakPolarHBondContact O-CG 3.33Å; V9-L13 PolarHBondContact O-N 3.47Å
10	A	70.1	Confident	66.1	Low	52 Å²	52	110.7 Å²	110.7	43%	0.43	61%	0.606	S	S	.	*	H	α-helix	trans	-65.6	-41.3	177.2	0	0	0	0	0	112.3	R6 H7 L13 V14	R6-A10 WeakPolarHBondContact O-CB 3.42Å; R6-A10 PolarHBondContact O-N 3Å; H7-A10 PolarHBondContact O-N 3.36Å; A10-L13 PolarHBondContact O-N 3.43Å; A10-V14 WeakPolarHBondContact O-CG2 3.45Å; A10-V14 PolarHBondContact O-N 3.4Å; A10-V14 VanDerWaalsContact O-N 3.13Å
11	V	73.3	Confident	66	Low	89 Å²	89	110.9 Å²	110.9	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-66.9	-40.2	176.8	174.6	0	0	0	0	111	H7 L13 V14 L15	H7-V11 WeakPolarHBondContact O-CG2 3.28Å; H7-V11 PolarHBondContact O-N 2.96Å; V11-L13 PolarHBondContact O-N 3.02Å; V11-V14 PolarHBondContact O-N 3.32Å; V11-L15 HydrophobicContact CG1-CD1 4.03Å; V11-L15 WeakPolarHBondContact O-CG 3.42Å; V11-L15 PolarHBondContact O-N 3.42Å
12	L	76.3	Confident	66.9	Low	110 Å²	110	106.9 Å²	106.9	58%	0.576	58%	0.582	S	S	*	*	H	α-helix	trans	-63.3	-40.7	177	-150.9	92	0	0	0	112.1	G8 V9 L15 L16	G8-L12 WeakPolarHBondContact O-CB 3.3Å; G8-L12 PolarHBondContact O-N 3.35Å; G8-L12 VanDerWaalsContact O-N 3.07Å; V9-L12 PolarHBondContact O-N 3.38Å; L12-L15 PolarHBondContact O-N 2.99Å; L12-L16 HydrophobicContact CD2-CD1 4.3Å; L12-L16 HydrophobicContact CG-CD1 4.47Å; L12-L16 WeakPolarHBondContact O-CB 3.37Å; L12-L16 WeakPolarHBondContact O-CG 3.35Å; L12-L16 PolarHBondContact O-N 3.07Å
13	L	76.1	Confident	67.2	Low	101 Å²	101	104.4 Å²	104.4	53%	0.529	58%	0.577	S	S	.	*	H	α-helix	trans	-66	-39.4	177.9	-74.8	169.8	0	0	0	112.4	V9 A10 V11 L17	V9-L13 HydrophobicContact CG1-CD1 4.02Å; V9-L13 HydrophobicContact CG1-CG 4.47Å; V9-L13 WeakPolarHBondContact O-CB 3.5Å; V9-L13 VanDerWaalsContact O-CG 3.3Å; V9-L13 WeakPolarHBondContact O-CG 3.33Å; V9-L13 PolarHBondContact O-N 3.47Å; A10-L13 PolarHBondContact O-N 3.43Å; V11-L13 PolarHBondContact O-N 3.02Å; L13-L17 WeakPolarHBondContact O-CB 3.32Å; L13-L17 PolarHBondContact O-N 3.2Å
14	V	76.6	Confident	67.5	Low	90 Å²	90	104.3 Å²	104.3	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-66.6	-41.4	175.9	172.5	0	0	0	0	111.1	A10 V11 L17 C18	A10-V14 WeakPolarHBondContact O-CG2 3.45Å; A10-V14 PolarHBondContact O-N 3.4Å; A10-V14 VanDerWaalsContact O-N 3.13Å; V11-V14 PolarHBondContact O-N 3.32Å; V14-L17 PolarHBondContact O-N 3.46Å; V14-C18 WeakPolarHBondContact O-CB 3.48Å; V14-C18 PolarHBondContact O-N 3.49Å; V14-C18 PolarHBondContact O-SG 3.19Å
15	L	75.7	Confident	67.8	Low	110 Å²	110	108 Å²	108	58%	0.576	58%	0.577	S	S	*	*	H	α-helix	trans	-65.6	-40.3	177.7	-72.1	171.2	0	0	0	112.3	V11 L12 C18 A19	V11-L15 HydrophobicContact CG1-CD1 4.03Å; V11-L15 WeakPolarHBondContact O-CG 3.42Å; V11-L15 PolarHBondContact O-N 3.42Å; L12-L15 PolarHBondContact O-N 2.99Å; L15-C18 PolarHBondContact O-N 2.93Å; L15-A19 WeakPolarHBondContact O-CB 3.29Å; L15-A19 PolarHBondContact O-N 3.47Å
16	L	74.5	Confident	67.5	Low	104 Å²	104	105.6 Å²	105.6	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-65.9	-40.9	175.5	-73.7	167.4	0	0	0	112	L12 A19 S20	L12-L16 HydrophobicContact CD2-CD1 4.3Å; L12-L16 HydrophobicContact CG-CD1 4.47Å; L12-L16 WeakPolarHBondContact O-CB 3.37Å; L12-L16 WeakPolarHBondContact O-CG 3.35Å; L12-L16 PolarHBondContact O-N 3.07Å; L16-A19 PolarHBondContact O-N 3.04Å; L16-S20 PolarHBondContact O-N 3.43Å; L16-S20 PolarHBondContact O-OG 3.39Å; L16-S20 VanDerWaalsContact O-OG 3.1Å
17	L	75.9	Confident	66.8	Low	107 Å²	107	98.4 Å²	98.4	56%	0.56	56%	0.558	S	S	*	*	H	α-helix	trans	-60.8	-45.8	173.3	-95.1	153.7	0	0	0	111.7	L13 V14 A19 S20 L21	L13-L17 WeakPolarHBondContact O-CB 3.32Å; L13-L17 PolarHBondContact O-N 3.2Å; V14-L17 PolarHBondContact O-N 3.46Å; L17-A19 PolarHBondContact O-N 2.95Å; L17-S20 WeakPolarHBondContact CA-OG 3.34Å; L17-S20 PolarHBondContact O-N 3.02Å; L17-S20 PolarHBondContact O-OG 3Å; L17-L21 PolarHBondContact O-N 2.99Å
18	C	69.6	Low	66.2	Low	67 Å²	67	96 Å²	96	45%	0.453	56%	0.558	S	S	.	*	H	α-helix	trans	-63.8	-39.7	176.7	-71.5	0	0	0	0	112.6	V14 L15 L21 F22	V14-C18 WeakPolarHBondContact O-CB 3.48Å; V14-C18 PolarHBondContact O-N 3.49Å; V14-C18 PolarHBondContact O-SG 3.19Å; L15-C18 PolarHBondContact O-N 2.93Å; C18-L21 PolarHBondContact O-N 3.33Å; C18-F22 PolarHBondContact O-N 3.44Å
19	A	70.4	Confident	65.3	Low	51 Å²	51	102.7 Å²	102.7	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-66.2	-40	176.6	0	0	0	0	0	112.1	L15 L16 L17 F22 L23	L15-A19 WeakPolarHBondContact O-CB 3.29Å; L15-A19 PolarHBondContact O-N 3.47Å; L16-A19 PolarHBondContact O-N 3.04Å; L17-A19 PolarHBondContact O-N 2.95Å; A19-F22 PolarHBondContact O-N 3Å; A19-L23 PolarHBondContact O-N 2.93Å
20	S	68.8	Low	63.6	Low	59 Å²	59	106.7 Å²	106.7	41%	0.413	59%	0.593	S	S	.	*	H	α-helix	trans	-66.8	-38.2	175.7	58.4	0	0	0	0	112.9	L16 L17 L23 V24	L16-S20 PolarHBondContact O-N 3.43Å; L16-S20 PolarHBondContact O-OG 3.39Å; L16-S20 VanDerWaalsContact O-OG 3.1Å; L17-S20 WeakPolarHBondContact CA-OG 3.34Å; L17-S20 PolarHBondContact O-N 3.02Å; L17-S20 PolarHBondContact O-OG 3Å; S20-L23 PolarHBondContact O-N 3.4Å; S20-V24 VanDerWaalsContact O-CG2 3.32Å; S20-V24 WeakPolarHBondContact O-CG2 3.48Å; S20-V24 PolarHBondContact O-N 2.93Å
21	L	64.3	Low	61.7	Low	115 Å²	115	110 Å²	110	60%	0.602	61%	0.613	S	S	*	*	H	α-helix	trans	-65.5	-37.5	172.5	-88	154.5	0	0	0	112.3	L17 C18 V24 Y25	L17-L21 PolarHBondContact O-N 2.99Å; C18-L21 PolarHBondContact O-N 3.33Å; L21-V24 PolarHBondContact O-N 3.03Å; L21-Y25 VanDerWaalsContact O-CB 3.29Å; L21-Y25 WeakPolarHBondContact O-CB 3.41Å; L21-Y25 PolarHBondContact O-N 3.31Å
22	F	64.5	Low	59.8	Low	142 Å²	142	111 Å²	111	62%	0.623	62%	0.621	S	S	*	*	H	α-helix	trans	-66.2	-39	175	-113.8	-85.8	0	0	0	112.7	C18 A19 Y25 N26	C18-F22 PolarHBondContact O-N 3.44Å; A19-F22 PolarHBondContact O-N 3Å; F22-Y25 PolarHBondContact O-N 3.37Å; F22-N26 WeakPolarHBondContact O-CB 3.4Å; F22-N26 PolarHBondContact O-N 3.13Å
23	L	60.8	Low	57.6	Low	134 Å²	134	110.7 Å²	110.7	70%	0.702	63%	0.628	S	S	*	*	H	α-helix	trans	-70.6	-35.2	176.5	-76	167.6	0	0	0	112.5	A19 S20 G27	A19-L23 PolarHBondContact O-N 2.93Å; S20-L23 PolarHBondContact O-N 3.4Å; L23-G27 WeakPolarHBondContact O-CA 3.39Å; L23-G27 PolarHBondContact O-N 3.48Å
24	V	63	Low	55.4	Low	104 Å²	104	117.1 Å²	117.1	63%	0.63	65%	0.646	S	S	*	*	H	α-helix	trans	-70.2	-38.3	173.9	173.2	0	0	0	0	111.3	S20 L21	S20-V24 VanDerWaalsContact O-CG2 3.32Å; S20-V24 WeakPolarHBondContact O-CG2 3.48Å; S20-V24 PolarHBondContact O-N 2.93Å; L21-V24 PolarHBondContact O-N 3.03Å
25	Y	59.7	Low	53.1	Low	190 Å²	190	121.5 Å²	121.5	75%	0.745	66%	0.66	S	S	*	*	H	α-helix	trans	-70.1	-40.5	178	-170	-99.9	0	0	0	112.4	L21 F22	L21-Y25 VanDerWaalsContact O-CB 3.29Å; L21-Y25 WeakPolarHBondContact O-CB 3.41Å; L21-Y25 PolarHBondContact O-N 3.31Å; F22-Y25 PolarHBondContact O-N 3.37Å
26	N	47.7	Very low	51.1	Low	108 Å²	108	122.9 Å²	122.9	58%	0.578	67%	0.673	S	S	*	*	H	α-helix	trans	-85.2	-12.6	177.4	-71.6	-23	0	0	0	113.8	F22	F22-N26 WeakPolarHBondContact O-CB 3.4Å; F22-N26 PolarHBondContact O-N 3.13Å
27	G	43.5	Very low	49	Very low	58 Å²	58	125.2 Å²	125.2	60%	0.598	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-4.4	-179.3	0	0	0	0	0	115.4	L23	L23-G27 WeakPolarHBondContact O-CA 3.39Å; L23-G27 PolarHBondContact O-N 3.48Å
28	S	45.6	Very low	46.9	Very low	97 Å²	97	127.6 Å²	127.6	68%	0.678	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	11.4	-178.5	-70.5	0	0	0	0	115.3
29	F	45.2	Very low	45	Very low	187 Å²	187	130.3 Å²	130.3	82%	0.82	71%	0.714	S	S	*	*			trans	-132.4	84.2	170.9	-87.1	-87.2	0	0	0	110.5
30	N	34.1	Very low	43.1	Very low	166 Å²	166	138.7 Å²	138.7	89%	0.888	74%	0.735	S	S	*	*			trans	-159.1	102.3	154.6	-104.1	-16.9	0	0	0	110.6
31	S	31	Very low	41.4	Very low	122 Å²	122	141.8 Å²	141.8	85%	0.853	75%	0.751	S	S	*	*			trans	-141	134.2	147.9	-118.1	0	0	0	0	109.3
32	P	33.3	Very low	39.8	Very low	108 Å²	108	146.4 Å²	146.4	70%	0.701	76%	0.761	S	S	*	*			trans	-101.9	159.9	-164	37.7	-31.2	0	0	0	114.2
33	S	29	Very low	38.2	Very low	105 Å²	105	147.9 Å²	147.9	73%	0.734	77%	0.769	S	S	*	*			trans	80.3	118.9	145.9	72.9	0	0	0	0	119.3
34	R	29.7	Very low	36.8	Very low	236 Å²	236	149.7 Å²	149.7	89%	0.891	77%	0.774	S	S	*	*				179.8	114.7	84.9	-104.8	176.2	167.1	156.7	-4.1	110.3
35	E	29.7	Very low	35.3	Very low	182 Å²	182	153.8 Å²	153.8	85%	0.85	79%	0.786	S	S	*	*			trans	-80.6	134.2	158.8	-75.3	179.6	158.1	0	0	109
36	T	32	Very low	34	Very low	138 Å²	138	152.9 Å²	152.9	85%	0.847	79%	0.788	S	S	*	*			trans	-132.7	108.4	153.4	36	0	0	0	0	107.3
37	N	31.2	Very low	33.2	Very low	154 Å²	154	154.1 Å²	154.1	82%	0.824	79%	0.794	S	S	*	*			trans	-60.1	133.6	161	-78.3	-31.3	0	0	0	109.2
38	D	31.2	Very low	32.7	Very low	156 Å²	156	160 Å²	160	83%	0.834	81%	0.806	S	S	*	*			trans	-144.6	126.3	138.2	-155.2	2.3	0	0	0	111.1
39	T	31.3	Very low	31.9	Very low	124 Å²	124	164.3 Å²	164.3	76%	0.761	82%	0.815	S	S	*	*			trans	-91.3	121.2	-179.9	10.2	0	0	0	0	107.8
40	R	30.3	Very low	31.6	Very low	227 Å²	227	161.2 Å²	161.2	86%	0.857	81%	0.814	S	S	*	*			trans	-147.2	101.9	155.5	-136.8	172.4	-171	172.3	4.1	113
41	V	31.9	Very low	31.6	Very low	125 Å²	125	158.9 Å²	158.9	76%	0.758	81%	0.808	S	S	*	*			trans	-55.3	127.9	159.9	174.9	0	0	0	0	109.2
42	R	30.7	Very low	31.7	Very low	212 Å²	212	162 Å²	162	80%	0.8	81%	0.809	S	S	*	*			trans	-143.2	100.4	156.7	-112.5	-178.7	-178	177.7	-0.4	109.4
43	Q	31.7	Very low	32	Very low	172 Å²	172	162 Å²	162	80%	0.804	82%	0.818	S	S	*	*			trans	-61.9	130.5	158.2	-87.4	169.3	-36.9	0	0	109
44	H	31.9	Very low	32.6	Very low	172 Å²	172	162.3 Å²	162.3	80%	0.796	82%	0.82	S	S	*	*			trans	-145.5	101.7	154.1	-94.6	-76.7	0	0	0	108
45	E	30.9	Very low	33	Very low	190 Å²	190	154.2 Å²	154.2	89%	0.888	81%	0.811	S	S	*	*			trans	-82.7	126.8	159	-85.9	174.6	118	0	0	108.8
46	H	31.9	Very low	33.7	Very low	172 Å²	172	150.9 Å²	150.9	80%	0.796	81%	0.807	S	S	*	*			trans	-149.8	109.8	156	-157.1	67.1	0	0	0	111.5
47	L	30.6	Very low	34.5	Very low	134 Å²	134	148.7 Å²	148.7	70%	0.702	80%	0.803	S	S	*	*			trans	28.7	109.8	152.6	-80.1	83.8	0	0	0	122.7
48	Q	32.7	Very low	35.4	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	80%	0.795	S	S	*	*				28	121.6	129.6	-77.8	162.4	-36.7	0	0	122.9
49	Q	29.7	Very low	36.4	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.874	79%	0.794	S	S	*	*				-160.2	143	118	-121.4	169.9	-10.2	0	0	111.1
50	P	38.6	Very low	37.4	Very low	123 Å²	123	146.4 Å²	146.4	80%	0.799	80%	0.796	S	S	*	*			trans	-97.6	134.7	-169.9	34.1	-27.3	0	0	0	113.2
51	P	34.9	Very low	39.3	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	79%	0.792	S	S	*	*			trans	-105.2	116	159.7	23.8	-7.4	0	0	0	110.9
52	E	32.4	Very low	41.5	Very low	187 Å²	187	141.5 Å²	141.5	87%	0.874	78%	0.776	S	S	*	*			trans	43.1	117.8	142.9	-66.9	178.3	159.8	0	0	119.5	S54	E52-S54 PolarHBondContact O-N 3.42Å
53	A	40.6	Very low	43.9	Very low	108 Å²	108	135 Å²	135	89%	0.893	76%	0.761	S	S	*	*			trans	-59.4	94.2	166.6	0	0	0	0	0	110.9	G55	A53-G55 PolarHBondContact O-N 3.47Å
54	S	40.1	Very low	46.6	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	73%	0.734	S	S	*	*			trans	-61.8	100	157.4	156.5	0	0	0	0	107.6	E52 S56	E52-S54 PolarHBondContact O-N 3.42Å; S54-S56 PolarHBondContact O-N 3.19Å
55	G	38.9	Very low	49.6	Very low	67 Å²	67	120.6 Å²	120.6	69%	0.691	70%	0.699	S	S	*	*			trans	-49.9	110.8	169.6	0	0	0	0	0	109.5	A53 A57	A53-G55 PolarHBondContact O-N 3.47Å; G55-A57 VanDerWaalsContact C-N 3.29Å; G55-A57 PolarHBondContact O-N 3.18Å
56	S	43.4	Very low	52.5	Low	111 Å²	111	117.8 Å²	117.8	78%	0.776	69%	0.686	S	S	*	*			trans	-59.8	97	168.5	164.4	0	0	0	0	107	S54 A58	S54-S56 PolarHBondContact O-N 3.19Å; S56-A58 PolarHBondContact O-N 2.84Å
57	A	48.9	Very low	55.6	Low	92 Å²	92	110.3 Å²	110.3	76%	0.76	66%	0.656	S	S	*	*			trans	-51.9	108.6	168.4	0	0	0	0	0	107.2	G55 K59	G55-A57 VanDerWaalsContact C-N 3.29Å; G55-A57 PolarHBondContact O-N 3.18Å; A57-K59 PolarHBondContact O-N 3.27Å; A57-K59 VanDerWaalsContact O-N 3.14Å
58	A	50	Low	58.8	Low	80 Å²	80	104 Å²	104	66%	0.661	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-54.9	123.8	178.1	0	0	0	0	0	107.5	S56	S56-A58 PolarHBondContact O-N 2.84Å
59	K	52.4	Low	61.8	Low	184 Å²	184	97.5 Å²	97.5	80%	0.8	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-50.8	130.3	174.3	-73.1	-177.3	179.1	-179.6	0	107.7	A57 H61	A57-K59 PolarHBondContact O-N 3.27Å; A57-K59 VanDerWaalsContact O-N 3.14Å; K59-H61 PolarHBondContact O-N 3.44Å
60	P	53.9	Low	65	Low	123 Å²	123	88.7 Å²	88.7	80%	0.799	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-51.5	120.4	178.9	-24.3	31.6	0	0	0	109.6	L62	P60-L62 PolarHBondContact O-N 2.85Å
61	H	68.3	Low	67.6	Low	167 Å²	167	83 Å²	83	77%	0.773	52%	0.515	S	S	*	.			trans	-70	103.6	176.3	-83.5	-69.2	0	0	0	108.4	K59	K59-H61 PolarHBondContact O-N 3.44Å
62	L	78.3	Confident	70.4	Confident	81 Å²	81	81.5 Å²	81.5	42%	0.424	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-53	135.2	173.6	-70	172.3	0	0	0	110.4	P60 R78 H80	P60-L62 PolarHBondContact O-N 2.85Å; L62-R78 HydrophobicContact CB-CB 4.27Å; L62-R78 PolarHBondContact O-NH1 3.4Å; L62-H80 HydrophobicContact CD2-CB 3.85Å
63	P	82.6	Confident	73.2	Confident	75 Å²	75	76.7 Å²	76.7	49%	0.487	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-59.6	141.9	179.9	23.8	-31.9	0	0	0	110.8
64	A	88.4	Confident	75.7	Confident	29 Å²	29	76 Å²	76	24%	0.24	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	121.3	177.1	0	0	0	0	0	109.9	Q66 P76 L77 R78	A64-Q66 PolarHBondContact O-N 2.95Å; A64-P76 HydrophobicContact CB-CB 4.21Å; A64-P76 HydrophobicContact CB-CG 3.99Å; A64-L77 CarbonylContact C-O 3.58Å; A64-L77 WeakPolarHBondContact CA-O 3.24Å; A64-R78 HydrophobicContact CB-CG 4.09Å
65	L	93.2	Very high	78.3	Confident	13 Å²	13	77 Å²	77	7%	0.068	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	111.4	175.1	-63.9	174.4	0	0	0	109.2	Y68 L77 E232 L233	L65-Y68 HydrophobicContact CB-CD2 3.5Å; L65-Y68 HydrophobicContact CB-CE2 3.79Å; L65-L77 HydrophobicContact CB-CB 4.44Å; L65-L77 HydrophobicContact CD1-CD2 4Å; L65-L77 HydrophobicContact CD1-CG 4.25Å; L65-L77 PolarHBondContact N-O 2.81Å; L65-E232 HydrophobicContact CD2-CB 3.9Å; L65-E232 WeakPolarHBondContact CD2-O 3.43Å; L65-L233 HydrophobicContact CD1-CD1 4.19Å
66	Q	93.4	Very high	81.1	Confident	131 Å²	131	76 Å²	76	61%	0.612	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	139.3	-176.9	-63	-59.7	-27.2	0	0	111.6	A64	A64-Q66 PolarHBondContact O-N 2.95Å
67	G	95.6	Very high	83.6	Confident	15 Å²	15	71 Å²	71	16%	0.155	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86.9	-3	176.2	0	0	0	0	0	115.8	S194	G67-S194 WeakPolarHBondContact O-CB 3.1Å; G67-S194 PolarHBondContact O-N 3.49Å
68	Y	97.6	Very high	85.8	Confident	1 Å²	1	72.9 Å²	72.9	0%	0.004	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	104.4	169.3	-48	-85.6	0	0	0	109	L65 P76 L77 I158 I192 I193 K197 F201 I229 E232	L65-Y68 HydrophobicContact CB-CD2 3.5Å; L65-Y68 HydrophobicContact CB-CE2 3.79Å; Y68-P76 CarbonylContact O-C 3.6Å; Y68-P76 WeakPolarHBondContact O-CA 3.09Å; Y68-L77 PolarHBondContact O-N 3.02Å; Y68-I158 HydrophobicContact CD1-CD1 3.94Å; Y68-I158 HydrophobicContact CD1-CG2 4.08Å; Y68-I158 HydrophobicContact CE1-CD1 4.42Å; Y68-I192 WeakPolarHBondContact CA-O 3.5Å; Y68-I193 HydrophobicContact CD1-CG1 4.12Å; Y68-I193 HydrophobicContact CE1-CD1 4.28Å; Y68-I193 HydrophobicContact CE1-CG1 4.28Å; Y68-K197 WeakPolarHBondContact OH-CE 3.37Å; Y68-F201 HydrophobicContact CE1-CZ 4.28Å; Y68-F201 WeakPolarHBondContact OH-CZ 3.38Å; Y68-I229 HydrophobicContact CE1-CD1 3.94Å; Y68-I229 HydrophobicContact CE1-CG1 3.62Å; Y68-I229 WeakPolarHBondContact OH-CG1 3.46Å; Y68-E232 VanDerWaalsContact CE2-OE2 3.26Å; Y68-E232 WeakPolarHBondContact CE2-OE2 3.46Å; Y68-E232 PolarHBondContact OH-OE2 3.05Å
69	I	96.8	Very high	87.9	Confident	46 Å²	46	70.2 Å²	70.2	24%	0.236	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.8	-164.9	-56.8	175.4	0	0	0	110	H74 Y191 I192	I69-H74 HydrophobicContact CG2-CB 4.08Å; I69-Y191 VanDerWaalsContact C-CD1 3.49Å; I69-Y191 CarbonylContact O-C 3.54Å; I69-Y191 WeakPolarHBondContact O-CA 3.3Å; I69-I192 HydrophobicContact CB-CG1 4.36Å; I69-I192 PolarHBondContact N-O 2.79Å; I69-I192 PolarHBondContact O-N 2.74Å
70	G	96.3	Very high	90	Very high	2 Å²	2	64 Å²	64	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	134.5	175.3	0	0	0	0	0	112.1	I72 H74 K75 Y191	G70-I72 VanDerWaalsContact C-N 3.28Å; G70-I72 PolarHBondContact O-N 3.48Å; G70-H74 VanDerWaalsContact O-CA 3.23Å; G70-H74 WeakPolarHBondContact O-CA 3.22Å; G70-H74 PolarHBondContact O-N 3.11Å; G70-H74 VanDerWaalsContact O-N 3.11Å; G70-H74 PolarHBondContact O-ND1 2.86Å; G70-H74 VanDerWaalsContact O-ND1 3.09Å; G70-K75 PolarHBondContact N-O 3.08Å; G70-Y191 VanDerWaalsContact N-CD1 3.3Å
71	I	94.5	Very high	92.1	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.015	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-31.1	-173.3	-162.4	73.1	0	0	0	112.6	H74 Y175 L178 R179 N182 V190 I192	I71-H74 PolarHBondContact O-CE1 2.84Å; I71-Y175 HydrophobicContact CD1-CD2 3.51Å; I71-Y175 HydrophobicContact CD1-CE1 4.41Å; I71-Y175 HydrophobicContact CD1-CE2 3.26Å; I71-Y175 HydrophobicContact CD1-CG 4.17Å; I71-Y175 HydrophobicContact CG1-CE2 4.4Å; I71-L178 HydrophobicContact CD1-CB 4.18Å; I71-L178 HydrophobicContact CG1-CB 4.27Å; I71-R179 HydrophobicContact CG1-CB 4.33Å; I71-N182 HydrophobicContact CG2-CB 3.77Å; I71-V190 HydrophobicContact CB-CB 4.49Å; I71-V190 HydrophobicContact CB-CG1 4.28Å; I71-V190 HydrophobicContact CG2-CB 3.88Å; I71-V190 HydrophobicContact CG2-CG1 4.1Å; I71-V190 PolarHBondContact N-O 2.81Å; I71-I192 HydrophobicContact CD1-CG2 3.88Å
72	I	91.7	Very high	93.5	Very high	85 Å²	85	55.9 Å²	55.9	44%	0.436	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-57.1	-178.7	-57.5	-52.5	0	0	0	112.1	G70 H74 R179 N182	G70-I72 VanDerWaalsContact C-N 3.28Å; G70-I72 PolarHBondContact O-N 3.48Å; I72-H74 PolarHBondContact O-CE1 3.19Å; I72-H74 VanDerWaalsContact O-CE1 3.27Å; I72-H74 PolarHBondContact O-ND1 3.09Å; I72-R179 HydrophobicContact CD1-CG 4.19Å; I72-N182 HydrophobicContact CD1-CB 4.22Å; I72-N182 HydrophobicContact CG1-CB 4.18Å; I72-N182 WeakPolarHBondContact CG1-OD1 3.43Å
73	D	92.1	Very high	94.5	Very high	85 Å²	85	54.1 Å²	54.1	46%	0.455	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-12.7	-172	68.2	-7.3	0	0	0	114.1	K75	D73-K75 HydrophobicContact CB-CD 4.45Å; D73-K75 HydrophobicContact CB-CG 4.22Å; D73-K75 PolarHBondContact O-N 3.13Å; D73-K75 VanDerWaalsContact O-N 3.11Å; D73-K75 PolarHBondContact OD1-N 3.37Å; D73-K75 VanDerWaalsContact OD1-N 3.12Å; D73-K75 WeakPolarHBondContact OD2-CD 3.34Å
74	H	94.1	Very high	95.2	Very high	93 Å²	93	50.5 Å²	50.5	43%	0.431	25%	0.251	S	S	.	.			trans	60.1	18.8	-179.9	-50.2	-16.8	0	0	0	113.9	I69 G70 I71 I72 R168	I69-H74 HydrophobicContact CG2-CB 4.08Å; G70-H74 VanDerWaalsContact O-CA 3.23Å; G70-H74 WeakPolarHBondContact O-CA 3.22Å; G70-H74 PolarHBondContact O-N 3.11Å; G70-H74 VanDerWaalsContact O-N 3.11Å; G70-H74 PolarHBondContact O-ND1 2.86Å; G70-H74 VanDerWaalsContact O-ND1 3.09Å; I71-H74 PolarHBondContact O-CE1 2.84Å; I72-H74 PolarHBondContact O-CE1 3.19Å; I72-H74 VanDerWaalsContact O-CE1 3.27Å; I72-H74 PolarHBondContact O-ND1 3.09Å; H74-R168 PolarHBondContact CE1-NH2 2.8Å; H74-R168 VanDerWaalsContact CG-NH2 3.31Å; H74-R168 PolarHBondContact ND1-NH2 3.25Å; H74-R168 PolarHBondContact NE2-NH2 3.33Å
75	K	94.8	Very high	95.7	Very high	134 Å²	134	49.2 Å²	49.2	58%	0.583	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-80.8	149.4	177.1	-66.8	-176.9	-177.5	174.2	0	110.1	G70 D73	G70-K75 PolarHBondContact N-O 3.08Å; D73-K75 HydrophobicContact CB-CD 4.45Å; D73-K75 HydrophobicContact CB-CG 4.22Å; D73-K75 PolarHBondContact O-N 3.13Å; D73-K75 VanDerWaalsContact O-N 3.11Å; D73-K75 PolarHBondContact OD1-N 3.37Å; D73-K75 VanDerWaalsContact OD1-N 3.12Å; D73-K75 WeakPolarHBondContact OD2-CD 3.34Å
76	P	96.3	Very high	96	Very high	47 Å²	47	48.6 Å²	48.6	31%	0.305	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	148.7	172.8	28.4	-34.4	0	0	0	110.7	A64 Y68	A64-P76 HydrophobicContact CB-CB 4.21Å; A64-P76 HydrophobicContact CB-CG 3.99Å; Y68-P76 CarbonylContact O-C 3.6Å; Y68-P76 WeakPolarHBondContact O-CA 3.09Å
77	L	95.9	Very high	96.3	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	137.3	171.6	177.9	61.3	0	0	0	110.2	A64 L65 Y68 M79 V156 I158 Y191	A64-L77 CarbonylContact C-O 3.58Å; A64-L77 WeakPolarHBondContact CA-O 3.24Å; L65-L77 HydrophobicContact CB-CB 4.44Å; L65-L77 HydrophobicContact CD1-CD2 4Å; L65-L77 HydrophobicContact CD1-CG 4.25Å; L65-L77 PolarHBondContact N-O 2.81Å; Y68-L77 PolarHBondContact O-N 3.02Å; L77-M79 HydrophobicContact CD1-CB 4.29Å; L77-M79 HydrophobicContact CG-CB 4.22Å; L77-V156 HydrophobicContact CD1-CG1 3.92Å; L77-V156 HydrophobicContact CD1-CG2 4.21Å; L77-V156 HydrophobicContact CD2-CG1 4.19Å; L77-I158 HydrophobicContact CD2-CD1 3.8Å; L77-Y191 HydrophobicContact CB-CD1 3.91Å; L77-Y191 HydrophobicContact CB-CE1 3.74Å; L77-Y191 HydrophobicContact CD1-CD2 4.28Å; L77-Y191 HydrophobicContact CD1-CE1 4.16Å; L77-Y191 HydrophobicContact CD1-CE2 3.77Å
78	R	95.2	Very high	96.4	Very high	132 Å²	132	42.2 Å²	42.2	50%	0.498	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	108.2	171.1	-71.2	-177.7	177.3	-100	4.1	108.6	L62 A64	L62-R78 HydrophobicContact CB-CB 4.27Å; L62-R78 PolarHBondContact O-NH1 3.4Å; A64-R78 HydrophobicContact CB-CG 4.09Å
79	M	94.9	Very high	96.4	Very high	24 Å²	24	42.7 Å²	42.7	12%	0.118	21%	0.207	C	C	.	.			trans	-159.2	134.4	-176.8	-171.5	168.4	176.4	0	0	108.9	L77 C107 L130 V156 L233	L77-M79 HydrophobicContact CD1-CB 4.29Å; L77-M79 HydrophobicContact CG-CB 4.22Å; M79-C107 HydrophobicContact CE-CB 4.24Å; M79-C107 VanDerWaalsContact CE-SG 3.55Å; M79-L130 HydrophobicContact CE-CB 4.35Å; M79-V156 HydrophobicContact SD-CG2 4.2Å; M79-L233 HydrophobicContact CB-CD1 4.09Å; M79-L233 HydrophobicContact CE-CD1 4.31Å; M79-L233 HydrophobicContact CE-CD2 4.38Å; M79-L233 HydrophobicContact CG-CD1 3.77Å; M79-L233 HydrophobicContact CG-CD2 4.44Å; M79-L233 HydrophobicContact CG-CG 4.16Å; M79-L233 HydrophobicContact SD-CD1 3.8Å
80	H	96.6	Very high	96.5	Very high	53 Å²	53	40.6 Å²	40.6	25%	0.245	20%	0.197	C	C	.	.			trans	-145.3	144.5	172.2	-175.5	75	0	0	0	107.7	L62 L233 D235	L62-H80 HydrophobicContact CD2-CB 3.85Å; H80-L233 CarbonylContact C-O 3.47Å; H80-L233 WeakPolarHBondContact CA-O 3.26Å; H80-L233 PolarHBondContact ND1-O 3.07Å; H80-D235 IonicContact CE1-OD1 3.76Å; H80-D235 PolarHBondContact CE1-OD1 2.99Å; H80-D235 IonicContact CE1-OD2 2.94Å; H80-D235 IonicContact NE2-OD1 3.8Å; H80-D235 PolarHBondContact NE2-OD1 2.98Å; H80-D235 IonicContact NE2-OD2 2.64Å; H80-D235 PolarHBondContact NE2-OD2 3.49Å; H80-D235 VanDerWaalsContact NE2-OD2 3.09Å
81	C	97.1	Very high	96.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	141	175.5	-39.8	0	0	0	0	110.4	E106 C107 L233 C234 D235	C81-E106 WeakPolarHBondContact CA-OE2 3.35Å; C81-E106 HydrophobicContact CB-CB 4.23Å; C81-E106 HydrophobicContact CB-CG 4.09Å; C81-C107 HydrophobicContact CB-CB 3.62Å; C81-C107 WeakPolarHBondContact CB-SG 3.38Å; C81-C107 WeakPolarHBondContact SG-CB 3.48Å; C81-C107 CovalentContact SG-SG 2.01Å; C81-C107 PolarHBondContact SG-SG 2.96Å; C81-L233 HydrophobicContact CB-CD2 4.14Å; C81-L233 PolarHBondContact N-O 3.07Å; C81-L233 WeakPolarHBondContact SG-CD2 3.42Å; C81-C234 VanDerWaalsContact O-CA 3.26Å; C81-C234 WeakPolarHBondContact O-CA 3.47Å; C81-D235 PolarHBondContact O-N 2.83Å; C81-D235 VanDerWaalsContact O-N 3.14Å
82	H	97.9	Very high	96.7	Very high	119 Å²	119	41.4 Å²	41.4	55%	0.551	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	-37.4	177	-67.1	-57.8	0	0	0	112.2	E106 D235 R236	H82-E106 IonicContact CD2-OE2 3.82Å; H82-E106 IonicContact CG-OE2 3.6Å; H82-E106 PolarHBondContact N-OE2 3.02Å; H82-D235 IonicContact CE1-OD2 3.99Å; H82-D235 IonicContact CG-OD2 3.32Å; H82-D235 IonicContact ND1-OD2 3.85Å; H82-D235 PolarHBondContact ND1-OD2 3.28Å; H82-R236 PolarHBondContact O-N 3.12Å
83	T	98.6	Very high	97.1	Very high	43 Å²	43	37.4 Å²	37.4	26%	0.264	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	126.4	178.7	-59.2	0	0	0	0	110.9	A105 E106 C107	T83-A105 HydrophobicContact CG2-CB 4.26Å; T83-E106 WeakPolarHBondContact O-CB 3.48Å; T83-E106 PolarHBondContact O-N 3.36Å; T83-E106 VanDerWaalsContact O-N 3.1Å; T83-C107 PolarHBondContact O-N 3.45Å; T83-C107 VanDerWaalsContact O-N 3.17Å
84	C	98.9	Very high	97.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.2	176.9	-66.5	0	0	0	0	111.2	C107 I109 C234 R236 N238	C84-C107 CarbonylContact C-O 3.16Å; C84-C107 VanDerWaalsContact CA-O 3.27Å; C84-C107 WeakPolarHBondContact CA-O 3.37Å; C84-I109 HydrophobicContact CB-CD1 4.1Å; C84-C234 HydrophobicContact CB-CB 3.74Å; C84-C234 WeakPolarHBondContact CB-SG 3.26Å; C84-C234 WeakPolarHBondContact SG-CB 3.41Å; C84-C234 CovalentContact SG-SG 2.02Å; C84-C234 PolarHBondContact SG-SG 3.21Å; C84-R236 PolarHBondContact N-O 3.36Å; C84-N238 PolarHBondContact O-N 3.02Å
85	S	98.9	Very high	97.4	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.7	160.3	-70.5	0	0	0	0	108.3	I87 I102 A105 C107 V108 I109 N238	S85-I87 VanDerWaalsContact O-CD1 3.31Å; S85-I87 WeakPolarHBondContact O-CD1 3.29Å; S85-I102 PolarHBondContact OG-O 3.1Å; S85-A105 WeakPolarHBondContact OG-CB 3.4Å; S85-C107 PolarHBondContact N-O 2.85Å; S85-V108 CarbonylContact O-C 3.54Å; S85-V108 WeakPolarHBondContact O-CA 3.42Å; S85-I109 PolarHBondContact O-N 3.27Å; S85-N238 CarbonylContact C-O 3.56Å; S85-N238 WeakPolarHBondContact CA-O 3.28Å
86	L	98.9	Very high	97.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	118	173.9	-175.4	159.3	0	0	0	108.8	T88 I109 M111 T226 M227 A230 I237 N238 V239 Y240	L86-T88 HydrophobicContact CD2-CG2 4.3Å; L86-I109 HydrophobicContact CB-CB 4.46Å; L86-I109 HydrophobicContact CG-CB 4.48Å; L86-M111 HydrophobicContact CD2-CE 3.63Å; L86-M111 HydrophobicContact CG-CE 4.43Å; L86-T226 HydrophobicContact CD1-CG2 3.64Å; L86-T226 HydrophobicContact CG-CG2 3.96Å; L86-M227 HydrophobicContact CD1-CG 4.39Å; L86-M227 HydrophobicContact CD1-SD 3.63Å; L86-M227 HydrophobicContact CD2-SD 4.29Å; L86-A230 HydrophobicContact CD1-CB 3.98Å; L86-I237 HydrophobicContact CB-CG2 4.27Å; L86-N238 PolarHBondContact N-O 3.5Å; L86-V239 HydrophobicContact CB-CG2 4.48Å; L86-V239 HydrophobicContact CD2-CG1 4.12Å; L86-V239 CarbonylContact O-C 3.58Å; L86-V239 WeakPolarHBondContact O-CA 3.42Å; L86-Y240 PolarHBondContact O-N 2.83Å
87	I	98.8	Very high	97.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.2	-175.9	-54.7	91.4	0	0	0	107.9	S85 L93 I102 V108 I109 R110 V124 Y240	S85-I87 VanDerWaalsContact O-CD1 3.31Å; S85-I87 WeakPolarHBondContact O-CD1 3.29Å; I87-L93 HydrophobicContact CG2-CD1 3.62Å; I87-L93 HydrophobicContact CG2-CD2 4.43Å; I87-I102 HydrophobicContact CD1-CG2 3.62Å; I87-I102 HydrophobicContact CG1-CD1 4.17Å; I87-I102 HydrophobicContact CG1-CG1 4.46Å; I87-I102 HydrophobicContact CG1-CG2 3.92Å; I87-V108 HydrophobicContact CD1-CG1 3.37Å; I87-I109 PolarHBondContact N-O 3.48Å; I87-R110 HydrophobicContact CD1-CG 4.45Å; I87-V124 HydrophobicContact CG2-CB 4.37Å; I87-Y240 HydrophobicContact CG1-CD2 4.49Å
88	T	98.4	Very high	97.5	Very high	11 Å²	11	39.3 Å²	39.3	7%	0.067	20%	0.198	C	C	.	.			trans	-73.6	-166.6	173.2	78.3	0	0	0	0	110.2	L86 S90 M111 V239 Y240 G241 M242	L86-T88 HydrophobicContact CD2-CG2 4.3Å; T88-S90 PolarHBondContact OG1-N 2.79Å; T88-M111 HydrophobicContact CG2-CE 4.4Å; T88-V239 HydrophobicContact CG2-CG1 4.39Å; T88-Y240 WeakPolarHBondContact CG2-O 3.37Å; T88-Y240 PolarHBondContact N-O 3.3Å; T88-Y240 PolarHBondContact OG1-O 2.92Å; T88-G241 WeakPolarHBondContact CB-O 3.21Å; T88-G241 WeakPolarHBondContact CG2-O 3.37Å; T88-G241 VanDerWaalsContact OG1-C 3.3Å; T88-G241 PolarHBondContact OG1-O 3.49Å; T88-M242 HydrophobicContact CG2-CB 4.03Å; T88-M242 HydrophobicContact CG2-CE 3.62Å
89	S	98.1	Very high	97.7	Very high	12 Å²	12	33 Å²	33	8%	0.084	18%	0.175	C	C	.	.			trans	-104	4.5	170.4	-62.7	0	0	0	0	113.7	H259 Y260	S89-H259 WeakPolarHBondContact CB-CD2 3.38Å; S89-H259 CarbonylContact O-C 3.55Å; S89-H259 WeakPolarHBondContact O-CA 3.43Å; S89-Y260 VanDerWaalsContact O-CD1 3.32Å; S89-Y260 WeakPolarHBondContact O-CD1 3.34Å; S89-Y260 PolarHBondContact O-N 3.08Å
90	S	98.4	Very high	97.8	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.014	21%	0.206	C	C	.	.			trans	-57.4	144	-171.5	179.7	0	0	0	0	114.3	T88 H92 L93 G241 E268	T88-S90 PolarHBondContact OG1-N 2.79Å; S90-H92 PolarHBondContact O-N 2.93Å; S90-H92 PolarHBondContact OG-N 2.99Å; S90-H92 VanDerWaalsContact OG-N 3.17Å; S90-L93 WeakPolarHBondContact O-CB 3.26Å; S90-L93 WeakPolarHBondContact O-CG 3.23Å; S90-L93 PolarHBondContact O-N 2.96Å; S90-G241 WeakPolarHBondContact CB-O 3.41Å; S90-E268 WeakPolarHBondContact CB-OE1 3.28Å; S90-E268 VanDerWaalsContact OG-CD 3.29Å; S90-E268 PolarHBondContact OG-OE1 3.09Å
91	G	98.3	Very high	97.9	Very high	2 Å²	2	41 Å²	41	2%	0.021	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-63.1	-17.1	171	0	0	0	0	0	114.7	L93 I94 P257	G91-L93 PolarHBondContact O-N 3.26Å; G91-I94 WeakPolarHBondContact O-CB 3.42Å; G91-I94 VanDerWaalsContact O-CG1 3.31Å; G91-I94 WeakPolarHBondContact O-CG1 3.36Å; G91-I94 PolarHBondContact O-N 3.11Å; G91-P257 WeakPolarHBondContact CA-O 3.43Å; G91-P257 PolarHBondContact N-O 3.17Å
92	H	97.9	Very high	98	Very high	20 Å²	20	41 Å²	41	9%	0.093	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-61.5	-15	173.1	-80.6	-78	0	0	0	113.7	S90 I94 V243 F247 V256 E268 Q306	S90-H92 PolarHBondContact O-N 2.93Å; S90-H92 PolarHBondContact OG-N 2.99Å; S90-H92 VanDerWaalsContact OG-N 3.17Å; H92-I94 VanDerWaalsContact C-N 3.29Å; H92-V243 WeakPolarHBondContact CD2-CG1 3.29Å; H92-V243 VanDerWaalsContact NE2-CG1 3.32Å; H92-V243 WeakPolarHBondContact NE2-CG1 3.11Å; H92-F247 AromaticContact CE1-CE1 3.96Å; H92-F247 AromaticContact CE1-CZ 3.62Å; H92-F247 AromaticContact NE2-CE1 3.55Å; H92-F247 AromaticContact NE2-CZ 3.7Å; H92-V256 VanDerWaalsContact CD2-CG2 3.47Å; H92-V256 WeakPolarHBondContact CD2-CG2 3.18Å; H92-E268 IonicContact CD2-OE2 3.93Å; H92-E268 PolarHBondContact CD2-OE2 2.73Å; H92-E268 IonicContact NE2-OE2 2.86Å; H92-Q306 VanDerWaalsContact CB-O 3.23Å; H92-Q306 WeakPolarHBondContact CB-O 3.2Å
93	L	98.3	Very high	98	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-69.9	-26.5	174.6	-66.4	170.2	0	0	0	112.7	I87 S90 G91 G95 G96 D123 V124 Y260 Q306	I87-L93 HydrophobicContact CG2-CD1 3.62Å; I87-L93 HydrophobicContact CG2-CD2 4.43Å; S90-L93 WeakPolarHBondContact O-CB 3.26Å; S90-L93 WeakPolarHBondContact O-CG 3.23Å; S90-L93 PolarHBondContact O-N 2.96Å; G91-L93 PolarHBondContact O-N 3.26Å; L93-G95 PolarHBondContact O-N 3.19Å; L93-G96 PolarHBondContact O-N 3.5Å; L93-D123 WeakPolarHBondContact O-CB 3.48Å; L93-V124 HydrophobicContact CB-CG1 3.97Å; L93-V124 HydrophobicContact CD1-CG1 3.98Å; L93-V124 HydrophobicContact CG-CG1 4.44Å; L93-Y260 HydrophobicContact CB-CD1 4.42Å; L93-Y260 HydrophobicContact CD1-CD1 3.65Å; L93-Y260 HydrophobicContact CD1-CE1 3.93Å; L93-Q306 PolarHBondContact O-NE2 2.76Å
94	I	97.1	Very high	98	Very high	85 Å²	85	44.1 Å²	44.1	44%	0.436	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	127.8	-175	-61.4	169.9	0	0	0	110.6	G91 H92 G96 P257	G91-I94 WeakPolarHBondContact O-CB 3.42Å; G91-I94 VanDerWaalsContact O-CG1 3.31Å; G91-I94 WeakPolarHBondContact O-CG1 3.36Å; G91-I94 PolarHBondContact O-N 3.11Å; H92-I94 VanDerWaalsContact C-N 3.29Å; I94-G96 PolarHBondContact O-N 3.46Å; I94-P257 HydrophobicContact CD1-CG 3.78Å
95	G	96	Very high	97.9	Very high	51 Å²	51	44.5 Å²	44.5	53%	0.526	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	-0.1	177.1	0	0	0	0	0	115	L93 R97 D123	L93-G95 PolarHBondContact O-N 3.19Å; G95-R97 VanDerWaalsContact C-N 3.3Å; G95-R97 PolarHBondContact O-N 2.97Å; G95-D123 WeakPolarHBondContact CA-OD1 3.44Å; G95-D123 PolarHBondContact N-OD1 2.83Å; G95-D123 PolarHBondContact N-OD2 3.41Å
96	G	95.6	Very high	97.9	Very high	33 Å²	33	48.9 Å²	48.9	34%	0.34	24%	0.237	S	C	.	.			trans	-71.7	-21.1	-180	0	0	0	0	0	114.3	L93 I94 R98 D123	L93-G96 PolarHBondContact O-N 3.5Å; I94-G96 PolarHBondContact O-N 3.46Å; G96-R98 VanDerWaalsContact O-CG 3.29Å; G96-R98 WeakPolarHBondContact O-CG 3.38Å; G96-R98 PolarHBondContact O-N 3.43Å; G96-R98 VanDerWaalsContact O-N 3.13Å; G96-D123 PolarHBondContact N-OD1 2.72Å
97	R	97.1	Very high	97.9	Very high	191 Å²	191	49.3 Å²	49.3	72%	0.721	24%	0.24	S	C	*	.			trans	53	30.7	176	-63.3	-176	-70.8	173.9	-1.7	115.1	G95 Q122 D123	G95-R97 VanDerWaalsContact C-N 3.3Å; G95-R97 PolarHBondContact O-N 2.97Å; R97-Q122 CarbonylContact C-O 3.59Å; R97-Q122 VanDerWaalsContact CA-O 3.22Å; R97-Q122 WeakPolarHBondContact CA-O 3.18Å; R97-D123 WeakPolarHBondContact CA-OD1 3.3Å; R97-D123 PolarHBondContact N-OD1 2.91Å
98	R	97.8	Very high	97.9	Very high	43 Å²	43	49.2 Å²	49.2	16%	0.162	24%	0.24	C	C	.	.			trans	-92.7	10	-178.1	-56.8	-166.8	80.5	-161.3	17.7	113.8	G96 K100 E101 I102 Q122 Y240 Q306	G96-R98 VanDerWaalsContact O-CG 3.29Å; G96-R98 WeakPolarHBondContact O-CG 3.38Å; G96-R98 PolarHBondContact O-N 3.43Å; G96-R98 VanDerWaalsContact O-N 3.13Å; R98-K100 VanDerWaalsContact C-N 3.28Å; R98-K100 PolarHBondContact O-N 3.24Å; R98-E101 HydrophobicContact CB-CB 4.48Å; R98-E101 VanDerWaalsContact CZ-CD 3.49Å; R98-E101 IonicContact CZ-OE1 3.1Å; R98-E101 IonicContact CZ-OE2 3.42Å; R98-E101 IonicContact NE-OE1 2.73Å; R98-E101 IonicContact NE-OE2 2.96Å; R98-E101 PolarHBondContact NE-OE2 2.8Å; R98-E101 IonicContact NH2-OE1 3.2Å; R98-E101 PolarHBondContact NH2-OE1 3.01Å; R98-E101 IonicContact NH2-OE2 3.49Å; R98-E101 PolarHBondContact NH2-OE2 3.18Å; R98-E101 WeakPolarHBondContact O-CA 3.39Å; R98-E101 WeakPolarHBondContact O-CB 3.34Å; R98-E101 PolarHBondContact O-N 3.17Å; R98-I102 HydrophobicContact CB-CD1 4.41Å; R98-I102 PolarHBondContact O-N 3.23Å; R98-Q122 PolarHBondContact N-O 2.96Å; R98-Y240 HydrophobicContact CB-CE1 4.35Å; R98-Q306 VanDerWaalsContact CD-OE1 3.22Å
99	G	98.2	Very high	97.9	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-56.8	-38.7	-175	0	0	0	0	0	114.2	E101 I102 D103 Q122 D123 G125	G99-E101 VanDerWaalsContact C-N 3.33Å; G99-E101 PolarHBondContact O-N 3.32Å; G99-I102 PolarHBondContact O-N 3.4Å; G99-D103 WeakPolarHBondContact O-CB 3.38Å; G99-D103 PolarHBondContact O-N 2.9Å; G99-Q122 WeakPolarHBondContact CA-O 3.32Å; G99-Q122 PolarHBondContact N-O 3.1Å; G99-D123 PolarHBondContact N-O 3.38Å; G99-G125 VanDerWaalsContact CA-CA 3.44Å; G99-G125 WeakPolarHBondContact O-CA 3.5Å
100	K	98.2	Very high	97.9	Very high	175 Å²	175	48.2 Å²	48.2	76%	0.761	23%	0.233	S	C	*	.	H	α-helix	trans	-66.7	-33.8	174.7	-67.8	-173.7	-178.8	179.2	0	113.1	R98 R104	R98-K100 VanDerWaalsContact C-N 3.28Å; R98-K100 PolarHBondContact O-N 3.24Å; K100-R104 WeakPolarHBondContact O-CG 3.22Å; K100-R104 PolarHBondContact O-N 3.34Å
101	E	98.3	Very high	97.9	Very high	70 Å²	70	48.6 Å²	48.6	33%	0.327	23%	0.234	S	C	.	.	H	α-helix	trans	-72.7	-45.6	177.6	-173	-176.4	162.3	0	0	110.7	R98 G99 D103 R104	R98-E101 HydrophobicContact CB-CB 4.48Å; R98-E101 VanDerWaalsContact CZ-CD 3.49Å; R98-E101 IonicContact CZ-OE1 3.1Å; R98-E101 IonicContact CZ-OE2 3.42Å; R98-E101 IonicContact NE-OE1 2.73Å; R98-E101 IonicContact NE-OE2 2.96Å; R98-E101 PolarHBondContact NE-OE2 2.8Å; R98-E101 IonicContact NH2-OE1 3.2Å; R98-E101 PolarHBondContact NH2-OE1 3.01Å; R98-E101 IonicContact NH2-OE2 3.49Å; R98-E101 PolarHBondContact NH2-OE2 3.18Å; R98-E101 WeakPolarHBondContact O-CA 3.39Å; R98-E101 WeakPolarHBondContact O-CB 3.34Å; R98-E101 PolarHBondContact O-N 3.17Å; G99-E101 VanDerWaalsContact C-N 3.33Å; G99-E101 PolarHBondContact O-N 3.32Å; E101-D103 VanDerWaalsContact C-N 3.28Å; E101-D103 PolarHBondContact O-N 2.94Å; E101-R104 WeakPolarHBondContact O-CB 3.41Å; E101-R104 PolarHBondContact O-N 3.45Å
102	I	98.6	Very high	97.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-53.6	-48.3	174.4	-72.4	164.8	0	0	0	110.6	S85 I87 R98 G99 R104 A105 V108 Y240	S85-I102 PolarHBondContact OG-O 3.1Å; I87-I102 HydrophobicContact CD1-CG2 3.62Å; I87-I102 HydrophobicContact CG1-CD1 4.17Å; I87-I102 HydrophobicContact CG1-CG1 4.46Å; I87-I102 HydrophobicContact CG1-CG2 3.92Å; R98-I102 HydrophobicContact CB-CD1 4.41Å; R98-I102 PolarHBondContact O-N 3.23Å; G99-I102 PolarHBondContact O-N 3.4Å; I102-R104 PolarHBondContact O-N 3.4Å; I102-A105 PolarHBondContact O-N 2.86Å; I102-V108 HydrophobicContact CG2-CG1 4.01Å; I102-V108 HydrophobicContact CG2-CG2 4.49Å; I102-Y240 HydrophobicContact CD1-CD1 3.91Å; I102-Y240 HydrophobicContact CD1-CE1 4.18Å; I102-Y240 HydrophobicContact CD1-CG 4.15Å; I102-Y240 HydrophobicContact CG1-CD1 3.75Å; I102-Y240 HydrophobicContact CG1-CD2 4.09Å; I102-Y240 HydrophobicContact CG1-CE1 3.56Å; I102-Y240 HydrophobicContact CG1-CE2 3.94Å; I102-Y240 HydrophobicContact CG1-CG 4.01Å
103	D	98.1	Very high	97.7	Very high	31 Å²	31	49.9 Å²	49.9	17%	0.166	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-4.1	-177.9	-77	-8.4	0	0	0	113.7	G99 E101 S126 R127	G99-D103 WeakPolarHBondContact O-CB 3.38Å; G99-D103 PolarHBondContact O-N 2.9Å; E101-D103 VanDerWaalsContact C-N 3.28Å; E101-D103 PolarHBondContact O-N 2.94Å; D103-S126 PolarHBondContact OD1-N 2.81Å; D103-S126 VanDerWaalsContact OD1-N 3.12Å; D103-S126 PolarHBondContact OD2-N 2.9Å; D103-S126 PolarHBondContact OD2-OG 3.32Å; D103-R127 HydrophobicContact CB-CG 4.22Å; D103-R127 WeakPolarHBondContact O-CD 3.47Å; D103-R127 PolarHBondContact O-NH1 2.86Å; D103-R127 WeakPolarHBondContact OD1-CB 3.42Å; D103-R127 PolarHBondContact OD1-N 3.14Å
104	R	98.2	Very high	97.5	Very high	198 Å²	198	50 Å²	50	75%	0.747	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-20.5	172.7	-74.4	167.5	-173.6	171.8	-0.8	113.6	K100 E101 I102	K100-R104 WeakPolarHBondContact O-CG 3.22Å; K100-R104 PolarHBondContact O-N 3.34Å; E101-R104 WeakPolarHBondContact O-CB 3.41Å; E101-R104 PolarHBondContact O-N 3.45Å; I102-R104 PolarHBondContact O-N 3.4Å
105	A	98.1	Very high	97.4	Very high	8 Å²	8	47.1 Å²	47.1	7%	0.066	23%	0.229	C	C	.	.	S	Bend	trans	-62.5	150.9	176.5	0	0	0	0	0	110.9	T83 S85 I102 C107 R127	T83-A105 HydrophobicContact CG2-CB 4.26Å; S85-A105 WeakPolarHBondContact OG-CB 3.4Å; I102-A105 PolarHBondContact O-N 2.86Å; A105-C107 VanDerWaalsContact C-N 3.29Å; A105-C107 PolarHBondContact O-N 3.07Å; A105-R127 PolarHBondContact O-NH1 2.84Å
106	E	97.8	Very high	97.3	Very high	92 Å²	92	45.5 Å²	45.5	43%	0.43	21%	0.209	S	C	.	.	S	Bend	trans	-59.3	-47.4	175.4	-175.1	-179.7	168.9	0	0	109.8	C81 H82 T83 R127	C81-E106 WeakPolarHBondContact CA-OE2 3.35Å; C81-E106 HydrophobicContact CB-CB 4.23Å; C81-E106 HydrophobicContact CB-CG 4.09Å; H82-E106 IonicContact CD2-OE2 3.82Å; H82-E106 IonicContact CG-OE2 3.6Å; H82-E106 PolarHBondContact N-OE2 3.02Å; T83-E106 WeakPolarHBondContact O-CB 3.48Å; T83-E106 PolarHBondContact O-N 3.36Å; T83-E106 VanDerWaalsContact O-N 3.1Å; E106-R127 PolarHBondContact O-NH2 3.07Å; E106-R127 VanDerWaalsContact O-NH2 3.1Å
107	C	98.4	Very high	96.9	Very high	9 Å²	9	46.9 Å²	46.9	6%	0.061	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133	179.5	-67.9	0	0	0	0	112.6	M79 C81 T83 C84 S85 A105 S129	M79-C107 HydrophobicContact CE-CB 4.24Å; M79-C107 VanDerWaalsContact CE-SG 3.55Å; C81-C107 HydrophobicContact CB-CB 3.62Å; C81-C107 WeakPolarHBondContact CB-SG 3.38Å; C81-C107 WeakPolarHBondContact SG-CB 3.48Å; C81-C107 CovalentContact SG-SG 2.01Å; C81-C107 PolarHBondContact SG-SG 2.96Å; T83-C107 PolarHBondContact O-N 3.45Å; T83-C107 VanDerWaalsContact O-N 3.17Å; C84-C107 CarbonylContact C-O 3.16Å; C84-C107 VanDerWaalsContact CA-O 3.27Å; C84-C107 WeakPolarHBondContact CA-O 3.37Å; S85-C107 PolarHBondContact N-O 2.85Å; A105-C107 VanDerWaalsContact C-N 3.29Å; A105-C107 PolarHBondContact O-N 3.07Å; C107-S129 WeakPolarHBondContact CA-OG 3.42Å
108	V	98.6	Very high	96.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.4	176	-177.3	0	0	0	0	109	S85 I87 I102 R127 S129 L130	S85-V108 CarbonylContact O-C 3.54Å; S85-V108 WeakPolarHBondContact O-CA 3.42Å; I87-V108 HydrophobicContact CD1-CG1 3.37Å; I102-V108 HydrophobicContact CG2-CG1 4.01Å; I102-V108 HydrophobicContact CG2-CG2 4.49Å; V108-R127 HydrophobicContact CB-CB 4.39Å; V108-R127 WeakPolarHBondContact CG1-O 3.24Å; V108-R127 HydrophobicContact CG2-CB 4.04Å; V108-S129 PolarHBondContact N-OG 3.2Å; V108-S129 VanDerWaalsContact N-OG 3.14Å; V108-S129 PolarHBondContact O-N 2.79Å; V108-L130 PolarHBondContact O-N 2.91Å; V108-L130 VanDerWaalsContact O-N 3.11Å
109	I	98.8	Very high	96	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.5	-173.9	-48.3	177.4	0	0	0	109.7	C84 S85 L86 I87 L130 V132 T226 A230	C84-I109 HydrophobicContact CB-CD1 4.1Å; S85-I109 PolarHBondContact O-N 3.27Å; L86-I109 HydrophobicContact CB-CB 4.46Å; L86-I109 HydrophobicContact CG-CB 4.48Å; I87-I109 PolarHBondContact N-O 3.48Å; I109-L130 CarbonylContact C-O 3.18Å; I109-L130 VanDerWaalsContact CA-O 3.3Å; I109-L130 WeakPolarHBondContact CA-O 3.47Å; I109-L130 HydrophobicContact CD1-CD2 4.4Å; I109-L130 HydrophobicContact CG1-CB 4.32Å; I109-L130 HydrophobicContact CG1-CD2 4.36Å; I109-L130 HydrophobicContact CG2-CB 4.33Å; I109-L130 HydrophobicContact CG2-CD2 4.03Å; I109-L130 HydrophobicContact CG2-CG 4.13Å; I109-V132 HydrophobicContact CG2-CG2 4.48Å; I109-T226 HydrophobicContact CG2-CG2 3.41Å; I109-T226 VanDerWaalsContact CG2-CG2 3.41Å; I109-A230 HydrophobicContact CD1-CB 4.01Å
110	R	98.1	Very high	95.9	Very high	1 Å²	1	46 Å²	46	0%	0.004	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	165.4	-180	-59.9	-170.3	-171.3	-90.6	-2.4	112.2	I87 V124 G125 R127 T128 L130 R131 V132	I87-R110 HydrophobicContact CD1-CG 4.45Å; R110-V124 VanDerWaalsContact CZ-O 3.26Å; R110-V124 PolarHBondContact NH1-O 2.99Å; R110-V124 PolarHBondContact NH2-O 3.4Å; R110-G125 PolarHBondContact NH2-O 3.12Å; R110-R127 PolarHBondContact NE-O 2.83Å; R110-R127 PolarHBondContact NH2-O 2.83Å; R110-T128 HydrophobicContact CB-CG2 4.31Å; R110-T128 VanDerWaalsContact CD-OG1 3.24Å; R110-T128 WeakPolarHBondContact CD-OG1 3.31Å; R110-T128 HydrophobicContact CG-CG2 4.22Å; R110-T128 PolarHBondContact NE-OG1 3.5Å; R110-T128 VanDerWaalsContact NE-OG1 3.12Å; R110-L130 PolarHBondContact N-O 3.18Å; R110-R131 HydrophobicContact CB-CG 4.46Å; R110-R131 CarbonylContact O-C 3.14Å; R110-R131 VanDerWaalsContact O-CA 3.3Å; R110-R131 WeakPolarHBondContact O-CA 3.37Å; R110-V132 PolarHBondContact O-N 3.38Å
111	M	98	Very high	95.7	Very high	11 Å²	11	38.8 Å²	38.8	5%	0.054	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.6	-177.5	-57.2	-177	-158.4	0	0	111.9	L86 T88 D113 A114 V132 T222 T226	L86-M111 HydrophobicContact CD2-CE 3.63Å; L86-M111 HydrophobicContact CG-CE 4.43Å; T88-M111 HydrophobicContact CG2-CE 4.4Å; M111-D113 PolarHBondContact O-N 2.78Å; M111-A114 VanDerWaalsContact O-CB 3.23Å; M111-A114 WeakPolarHBondContact O-CB 3.29Å; M111-A114 PolarHBondContact O-N 3.29Å; M111-V132 CarbonylContact C-O 3.55Å; M111-V132 WeakPolarHBondContact CA-O 3.45Å; M111-T222 HydrophobicContact CB-CG2 3.85Å; M111-T222 HydrophobicContact CG-CG2 3.94Å; M111-T222 HydrophobicContact SD-CG2 4.12Å; M111-T226 HydrophobicContact CE-CG2 3.91Å; M111-T226 HydrophobicContact CG-CG2 4.28Å
112	N	97.1	Very high	95.7	Very high	22 Å²	22	42.1 Å²	42.1	12%	0.118	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-129.8	169	-58.2	-51.5	0	0	0	112.7	R131 V132 A134 S137 V141 T222	N112-R131 VanDerWaalsContact O-CD 3.29Å; N112-R131 WeakPolarHBondContact O-CD 3.45Å; N112-V132 PolarHBondContact N-O 3.05Å; N112-A134 PolarHBondContact OD1-N 3.35Å; N112-S137 PolarHBondContact OD1-OG 3.01Å; N112-S137 VanDerWaalsContact OD1-OG 3.09Å; N112-V141 WeakPolarHBondContact O-CG2 3.27Å; N112-T222 PolarHBondContact ND2-OG1 3.19Å; N112-T222 PolarHBondContact OD1-OG1 2.7Å
113	D	94.8	Very high	95.7	Very high	26 Å²	26	43.2 Å²	43.2	14%	0.139	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	17.9	-177.9	54	-50.3	0	0	0	114	M111 P115 R140 V141	M111-D113 PolarHBondContact O-N 2.78Å; D113-P115 VanDerWaalsContact O-CD 3.27Å; D113-P115 WeakPolarHBondContact O-CD 3.46Å; D113-P115 VanDerWaalsContact O-N 3.13Å; D113-R140 HydrophobicContact CB-CB 3.98Å; D113-R140 IonicContact OD1-CZ 3.67Å; D113-R140 IonicContact OD1-NE 3.35Å; D113-R140 PolarHBondContact OD1-NE 3.43Å; D113-R140 IonicContact OD1-NH2 3.68Å; D113-R140 PolarHBondContact OD1-NH2 2.81Å; D113-R140 WeakPolarHBondContact OD2-CB 3.23Å; D113-R140 WeakPolarHBondContact OD2-CD 3.04Å; D113-R140 IonicContact OD2-CZ 3.33Å; D113-R140 IonicContact OD2-NE 2.97Å; D113-R140 PolarHBondContact OD2-NE 3.23Å; D113-V141 HydrophobicContact CB-CG2 3.97Å
114	A	95.6	Very high	95.7	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.017	25%	0.245	C	C	.	.			trans	-60.8	112.9	178.9	0	0	0	0	0	111	M111 R131 Y260 Y261	M111-A114 VanDerWaalsContact O-CB 3.23Å; M111-A114 WeakPolarHBondContact O-CB 3.29Å; M111-A114 PolarHBondContact O-N 3.29Å; A114-R131 PolarHBondContact O-NH2 3.32Å; A114-Y260 HydrophobicContact CB-CE1 4.32Å; A114-Y260 WeakPolarHBondContact CB-OH 3.48Å; A114-Y261 HydrophobicContact CB-CD1 4.47Å; A114-Y261 HydrophobicContact CB-CE1 3.78Å
115	P	94.1	Very high	95.6	Very high	26 Å²	26	32.3 Å²	32.3	17%	0.169	21%	0.209	C	C	.	.			trans	-83.9	152.7	-169.9	33.9	-34.8	0	0	0	112.8	D113 F120 Y260 Y261	D113-P115 VanDerWaalsContact O-CD 3.27Å; D113-P115 WeakPolarHBondContact O-CD 3.46Å; D113-P115 VanDerWaalsContact O-N 3.13Å; P115-F120 HydrophobicContact CB-CD2 4.21Å; P115-F120 HydrophobicContact CB-CE2 4.4Å; P115-F120 HydrophobicContact CG-CD2 3.75Å; P115-F120 HydrophobicContact CG-CE2 3.71Å; P115-F120 HydrophobicContact CG-CZ 4.46Å; P115-Y260 HydrophobicContact CG-CE2 4.32Å; P115-Y260 PolarHBondContact O-OH 3.03Å; P115-Y261 VanDerWaalsContact CD-CD1 3.41Å; P115-Y261 VanDerWaalsContact CD-CG 3.4Å; P115-Y261 HydrophobicContact CG-CD1 4.29Å; P115-Y261 HydrophobicContact CG-CG 3.91Å
116	T	93.1	Very high	95.4	Very high	17 Å²	17	35.7 Å²	35.7	10%	0.104	23%	0.232	C	C	.	.			trans	-114.7	-18.8	175.5	61.2	0	0	0	0	113.5	G121 G125 E147	T116-G121 WeakPolarHBondContact O-CA 3.39Å; T116-G121 PolarHBondContact O-N 3.13Å; T116-G125 WeakPolarHBondContact CB-O 3.49Å; T116-E147 PolarHBondContact N-OE1 2.89Å; T116-E147 VanDerWaalsContact N-OE1 3.11Å
117	A	87.6	Confident	95.3	Very high	62 Å²	62	36 Å²	36	51%	0.512	23%	0.229	S	C	.	.	S	Bend	trans	-68.4	157.9	-175.9	0	0	0	0	0	113.7	F120 E147	A117-F120 VanDerWaalsContact O-CD2 3.29Å; A117-F120 WeakPolarHBondContact O-CD2 3.46Å; A117-E147 PolarHBondContact N-OE1 2.92Å
118	G	88.2	Confident	95.2	Very high	72 Å²	72	36.6 Å²	36.6	74%	0.742	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	67.2	-132	171.6	0	0	0	0	0	113.3	F120 G121	G118-F120 PolarHBondContact O-N 3.43Å; G118-G121 PolarHBondContact O-N 2.86Å
119	A	89	Confident	95.1	Very high	84 Å²	84	37.6 Å²	37.6	69%	0.694	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-64.3	-21.5	-173	0	0	0	0	0	113.8
120	F	94.8	Very high	95.1	Very high	61 Å²	61	37.6 Å²	37.6	27%	0.268	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-76.1	-28.8	-176	-52.1	-60.9	0	0	0	113	P115 A117 G118 Q122 D123 V124 Y260	P115-F120 HydrophobicContact CB-CD2 4.21Å; P115-F120 HydrophobicContact CB-CE2 4.4Å; P115-F120 HydrophobicContact CG-CD2 3.75Å; P115-F120 HydrophobicContact CG-CE2 3.71Å; P115-F120 HydrophobicContact CG-CZ 4.46Å; A117-F120 VanDerWaalsContact O-CD2 3.29Å; A117-F120 WeakPolarHBondContact O-CD2 3.46Å; G118-F120 PolarHBondContact O-N 3.43Å; F120-Q122 PolarHBondContact O-N 3.26Å; F120-Q122 VanDerWaalsContact O-N 3.08Å; F120-D123 PolarHBondContact O-N 3.14Å; F120-V124 HydrophobicContact CB-CG2 3.98Å; F120-V124 WeakPolarHBondContact O-CG2 3.28Å; F120-V124 PolarHBondContact O-N 2.89Å; F120-Y260 HydrophobicContact CB-CE2 4.09Å; F120-Y260 AromaticContact CD1-CD2 3.64Å; F120-Y260 HydrophobicContact CD1-CD2 3.64Å; F120-Y260 AromaticContact CD1-CE2 3.88Å; F120-Y260 HydrophobicContact CD1-CE2 3.88Å; F120-Y260 HydrophobicContact CE1-CD2 4.08Å; F120-Y260 HydrophobicContact CE1-CE2 4.49Å; F120-Y260 HydrophobicContact CG-CD2 4.2Å; F120-Y260 AromaticContact CG-CE2 3.94Å; F120-Y260 HydrophobicContact CG-CE2 3.94Å
121	G	95.6	Very high	95	Very high	22 Å²	22	37.9 Å²	37.9	23%	0.227	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-28.5	-170.9	0	0	0	0	0	114.5	T116 G118 D123 G125	T116-G121 WeakPolarHBondContact O-CA 3.39Å; T116-G121 PolarHBondContact O-N 3.13Å; G118-G121 PolarHBondContact O-N 2.86Å; G121-D123 VanDerWaalsContact C-N 3.33Å; G121-G125 VanDerWaalsContact O-CA 3.26Å; G121-G125 WeakPolarHBondContact O-CA 3.46Å; G121-G125 PolarHBondContact O-N 2.92Å
122	Q	97.4	Very high	95.1	Very high	140 Å²	140	37.4 Å²	37.4	65%	0.654	24%	0.238	S	C	*	.	H	α-helix	trans	-64.9	-38.6	175	-66.1	-171.9	32.8	0	0	112.1	R97 R98 G99 F120	R97-Q122 CarbonylContact C-O 3.59Å; R97-Q122 VanDerWaalsContact CA-O 3.22Å; R97-Q122 WeakPolarHBondContact CA-O 3.18Å; R98-Q122 PolarHBondContact N-O 2.96Å; G99-Q122 WeakPolarHBondContact CA-O 3.32Å; G99-Q122 PolarHBondContact N-O 3.1Å; F120-Q122 PolarHBondContact O-N 3.26Å; F120-Q122 VanDerWaalsContact O-N 3.08Å
123	D	98.1	Very high	95.1	Very high	23 Å²	23	36.3 Å²	36.3	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-87.1	-45.6	-176.1	-71.3	-26.4	0	0	0	111.9	L93 G95 G96 R97 G99 F120 G121	L93-D123 WeakPolarHBondContact O-CB 3.48Å; G95-D123 WeakPolarHBondContact CA-OD1 3.44Å; G95-D123 PolarHBondContact N-OD1 2.83Å; G95-D123 PolarHBondContact N-OD2 3.41Å; G96-D123 PolarHBondContact N-OD1 2.72Å; R97-D123 WeakPolarHBondContact CA-OD1 3.3Å; R97-D123 PolarHBondContact N-OD1 2.91Å; G99-D123 PolarHBondContact N-O 3.38Å; F120-D123 PolarHBondContact O-N 3.14Å; G121-D123 VanDerWaalsContact C-N 3.33Å
124	V	97.9	Very high	95.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-110.1	-1.6	-168.4	-52.5	0	0	0	0	114.4	I87 L93 R110 F120 Y260	I87-V124 HydrophobicContact CG2-CB 4.37Å; L93-V124 HydrophobicContact CB-CG1 3.97Å; L93-V124 HydrophobicContact CD1-CG1 3.98Å; L93-V124 HydrophobicContact CG-CG1 4.44Å; R110-V124 VanDerWaalsContact CZ-O 3.26Å; R110-V124 PolarHBondContact NH1-O 2.99Å; R110-V124 PolarHBondContact NH2-O 3.4Å; F120-V124 HydrophobicContact CB-CG2 3.98Å; F120-V124 WeakPolarHBondContact O-CG2 3.28Å; F120-V124 PolarHBondContact O-N 2.89Å; V124-Y260 HydrophobicContact CG1-CD1 4.39Å; V124-Y260 HydrophobicContact CG1-CD2 4.35Å; V124-Y260 HydrophobicContact CG1-CE1 4.15Å; V124-Y260 HydrophobicContact CG1-CE2 4.13Å; V124-Y260 HydrophobicContact CG1-CG 4.49Å; V124-Y260 HydrophobicContact CG2-CE2 4.25Å
125	G	97.1	Very high	95.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	24%	0.236	C	C	.	.			trans	77.7	176.5	-177.5	0	0	0	0	0	112.8	G99 R110 T116 G121	G99-G125 VanDerWaalsContact CA-CA 3.44Å; G99-G125 WeakPolarHBondContact O-CA 3.5Å; R110-G125 PolarHBondContact NH2-O 3.12Å; T116-G125 WeakPolarHBondContact CB-O 3.49Å; G121-G125 VanDerWaalsContact O-CA 3.26Å; G121-G125 WeakPolarHBondContact O-CA 3.46Å; G121-G125 PolarHBondContact O-N 2.92Å
126	S	94.1	Very high	95.3	Very high	78 Å²	78	39.7 Å²	39.7	55%	0.545	25%	0.254	S	S	.	.	S	Bend	trans	-113.4	-23.6	-174.2	64.1	0	0	0	0	113.3	D103	D103-S126 PolarHBondContact OD1-N 2.81Å; D103-S126 VanDerWaalsContact OD1-N 3.12Å; D103-S126 PolarHBondContact OD2-N 2.9Å; D103-S126 PolarHBondContact OD2-OG 3.32Å
127	R	94.6	Very high	95.4	Very high	99 Å²	99	39 Å²	39	37%	0.374	25%	0.25	S	C	.	.			trans	-79.1	150.6	-175.9	-65.7	176.7	64.5	-144.1	-8.9	111.3	D103 A105 E106 V108 R110	D103-R127 HydrophobicContact CB-CG 4.22Å; D103-R127 WeakPolarHBondContact O-CD 3.47Å; D103-R127 PolarHBondContact O-NH1 2.86Å; D103-R127 WeakPolarHBondContact OD1-CB 3.42Å; D103-R127 PolarHBondContact OD1-N 3.14Å; A105-R127 PolarHBondContact O-NH1 2.84Å; E106-R127 PolarHBondContact O-NH2 3.07Å; E106-R127 VanDerWaalsContact O-NH2 3.1Å; V108-R127 HydrophobicContact CB-CB 4.39Å; V108-R127 WeakPolarHBondContact CG1-O 3.24Å; V108-R127 HydrophobicContact CG2-CB 4.04Å; R110-R127 PolarHBondContact NE-O 2.83Å; R110-R127 PolarHBondContact NH2-O 2.83Å
128	T	96	Very high	95.5	Very high	22 Å²	22	36.3 Å²	36.3	14%	0.135	23%	0.227	C	C	.	.			trans	-145.6	114.9	168.4	-56.2	0	0	0	0	108.7	R110 R131 T155	R110-T128 HydrophobicContact CB-CG2 4.31Å; R110-T128 VanDerWaalsContact CD-OG1 3.24Å; R110-T128 WeakPolarHBondContact CD-OG1 3.31Å; R110-T128 HydrophobicContact CG-CG2 4.22Å; R110-T128 PolarHBondContact NE-OG1 3.5Å; R110-T128 VanDerWaalsContact NE-OG1 3.12Å; T128-R131 HydrophobicContact CG2-CB 4.16Å; T128-T155 HydrophobicContact CG2-CG2 4.05Å; T128-T155 PolarHBondContact O-OG1 2.01Å
129	S	97.4	Very high	95.6	Very high	21 Å²	21	37.5 Å²	37.5	15%	0.147	21%	0.213	C	C	.	.	S	Bend	trans	-92.6	-38.4	174.5	-50.1	0	0	0	0	111	C107 V108 T155 V156	C107-S129 WeakPolarHBondContact CA-OG 3.42Å; V108-S129 PolarHBondContact N-OG 3.2Å; V108-S129 VanDerWaalsContact N-OG 3.14Å; V108-S129 PolarHBondContact O-N 2.79Å; S129-T155 WeakPolarHBondContact O-CA 3.3Å; S129-V156 PolarHBondContact O-N 3.03Å
130	L	97.8	Very high	95.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	134.4	-179.5	173.4	63.2	0	0	0	110.3	M79 V108 I109 R110 V132 V156 I158 I229 L233	M79-L130 HydrophobicContact CE-CB 4.35Å; V108-L130 PolarHBondContact O-N 2.91Å; V108-L130 VanDerWaalsContact O-N 3.11Å; I109-L130 CarbonylContact C-O 3.18Å; I109-L130 VanDerWaalsContact CA-O 3.3Å; I109-L130 WeakPolarHBondContact CA-O 3.47Å; I109-L130 HydrophobicContact CD1-CD2 4.4Å; I109-L130 HydrophobicContact CG1-CB 4.32Å; I109-L130 HydrophobicContact CG1-CD2 4.36Å; I109-L130 HydrophobicContact CG2-CB 4.33Å; I109-L130 HydrophobicContact CG2-CD2 4.03Å; I109-L130 HydrophobicContact CG2-CG 4.13Å; R110-L130 PolarHBondContact N-O 3.18Å; L130-V132 HydrophobicContact CD2-CG2 4.45Å; L130-V132 HydrophobicContact CG-CG2 4.35Å; L130-V156 CarbonylContact C-O 3.15Å; L130-V156 WeakPolarHBondContact CA-O 3.29Å; L130-V156 HydrophobicContact CD1-CB 3.89Å; L130-V156 HydrophobicContact CD1-CG1 3.74Å; L130-I158 HydrophobicContact CD1-CD1 3.59Å; L130-I158 HydrophobicContact CD1-CG1 3.72Å; L130-I158 HydrophobicContact CD2-CD1 4.45Å; L130-I229 HydrophobicContact CD2-CG2 3.87Å; L130-L233 HydrophobicContact CD2-CD1 3.99Å
131	R	97.7	Very high	95.4	Very high	7 Å²	7	36 Å²	36	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	119.1	173	-165.7	171.9	-104.2	161.5	-2.5	110.7	R110 N112 A114 T128 I133 E147 V156 F157 I158	R110-R131 HydrophobicContact CB-CG 4.46Å; R110-R131 CarbonylContact O-C 3.14Å; R110-R131 VanDerWaalsContact O-CA 3.3Å; R110-R131 WeakPolarHBondContact O-CA 3.37Å; N112-R131 VanDerWaalsContact O-CD 3.29Å; N112-R131 WeakPolarHBondContact O-CD 3.45Å; A114-R131 PolarHBondContact O-NH2 3.32Å; T128-R131 HydrophobicContact CG2-CB 4.16Å; R131-I133 HydrophobicContact CG-CD1 4.1Å; R131-I133 HydrophobicContact CG-CG1 3.91Å; R131-E147 IonicContact CZ-OE2 2.77Å; R131-E147 IonicContact NH1-OE2 3.72Å; R131-E147 PolarHBondContact NH1-OE2 3.14Å; R131-E147 IonicContact NH2-OE2 2.67Å; R131-E147 PolarHBondContact NH2-OE2 2.81Å; R131-V156 PolarHBondContact N-O 3.07Å; R131-F157 HydrophobicContact CB-CD1 3.96Å; R131-F157 HydrophobicContact CB-CE1 4.22Å; R131-F157 WeakPolarHBondContact O-CA 3.29Å; R131-I158 PolarHBondContact O-N 3.43Å
132	V	98.6	Very high	94.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.9	178.6	-174.8	0	0	0	0	109.2	I109 R110 M111 N112 L130 I158 T222 F225 T226 I229	I109-V132 HydrophobicContact CG2-CG2 4.48Å; R110-V132 PolarHBondContact O-N 3.38Å; M111-V132 CarbonylContact C-O 3.55Å; M111-V132 WeakPolarHBondContact CA-O 3.45Å; N112-V132 PolarHBondContact N-O 3.05Å; L130-V132 HydrophobicContact CD2-CG2 4.45Å; L130-V132 HydrophobicContact CG-CG2 4.35Å; V132-I158 CarbonylContact C-O 3.57Å; V132-I158 WeakPolarHBondContact CA-O 3.4Å; V132-T222 HydrophobicContact CB-CG2 4.31Å; V132-T222 HydrophobicContact CG1-CG2 4.06Å; V132-T222 WeakPolarHBondContact O-CG2 3.17Å; V132-F225 HydrophobicContact CG1-CB 4.29Å; V132-T226 HydrophobicContact CB-CG2 4.49Å; V132-T226 WeakPolarHBondContact CB-OG1 3.31Å; V132-T226 HydrophobicContact CG2-CG2 4.03Å; V132-I229 HydrophobicContact CG1-CD1 4.02Å; V132-I229 HydrophobicContact CG2-CD1 3.84Å
133	I	98	Very high	94.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.9	-166.2	-58	163.7	0	0	0	110.2	R131 V141 F157 I158 F159 W160	R131-I133 HydrophobicContact CG-CD1 4.1Å; R131-I133 HydrophobicContact CG-CG1 3.91Å; I133-V141 HydrophobicContact CD1-CG1 4.05Å; I133-V141 HydrophobicContact CD1-CG2 4.23Å; I133-V141 HydrophobicContact CG1-CG2 4.37Å; I133-V141 HydrophobicContact CG2-CG2 3.95Å; I133-F157 HydrophobicContact CD1-CB 4.49Å; I133-F157 HydrophobicContact CD1-CD1 3.83Å; I133-I158 PolarHBondContact N-O 2.93Å; I133-F159 HydrophobicContact CB-CD1 3.78Å; I133-F159 HydrophobicContact CB-CE1 3.76Å; I133-F159 HydrophobicContact CB-CG 4.33Å; I133-F159 HydrophobicContact CB-CZ 4.3Å; I133-F159 HydrophobicContact CD1-CE1 3.8Å; I133-F159 HydrophobicContact CD1-CE2 3.94Å; I133-F159 HydrophobicContact CD1-CZ 3.48Å; I133-F159 VanDerWaalsContact CD1-CZ 3.48Å; I133-F159 HydrophobicContact CG1-CE1 4.39Å; I133-F159 HydrophobicContact CG1-CZ 4.49Å; I133-F159 HydrophobicContact CG2-CD1 3.69Å; I133-F159 HydrophobicContact CG2-CE1 3.45Å; I133-F159 VanDerWaalsContact CG2-CE1 3.45Å; I133-F159 HydrophobicContact CG2-CZ 4.29Å; I133-F159 WeakPolarHBondContact O-CA 3.5Å; I133-W160 VanDerWaalsContact O-CD1 3.29Å; I133-W160 PolarHBondContact O-N 3.31Å
134	A	97.6	Very high	93.4	Very high	3 Å²	3	40.9 Å²	40.9	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144.4	169	0	0	0	0	0	110.7	N112 S136 S137 M138 W160	N112-A134 PolarHBondContact OD1-N 3.35Å; A134-S136 PolarHBondContact O-N 3.12Å; A134-S136 VanDerWaalsContact O-N 3.11Å; A134-S137 WeakPolarHBondContact O-CA 3.43Å; A134-S137 WeakPolarHBondContact O-CB 3.27Å; A134-S137 PolarHBondContact O-N 3.39Å; A134-M138 PolarHBondContact O-N 3.25Å; A134-W160 CarbonylContact C-O 3.59Å; A134-W160 HydrophobicContact CB-CD2 4.42Å; A134-W160 HydrophobicContact CB-CH2 4.26Å; A134-W160 HydrophobicContact CB-CZ2 3.48Å; A134-W160 VanDerWaalsContact CB-CZ2 3.48Å
135	H	95.5	Very high	92.2	Very high	43 Å²	43	49.4 Å²	49.4	20%	0.199	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-52.2	-36.3	176.4	73.9	-67.6	0	0	0	113	S137 M138 W160 P162 V174	H135-S137 PolarHBondContact O-N 3.04Å; H135-M138 VanDerWaalsContact O-CB 3.3Å; H135-M138 WeakPolarHBondContact O-CB 3.09Å; H135-M138 PolarHBondContact O-N 3.22Å; H135-W160 WeakPolarHBondContact CB-O 3.46Å; H135-W160 PolarHBondContact N-O 2.86Å; H135-P162 WeakPolarHBondContact CE1-CD 3.17Å; H135-P162 WeakPolarHBondContact ND1-CD 3.5Å; H135-V174 HydrophobicContact CB-CG1 4.28Å; H135-V174 HydrophobicContact CB-CG2 4.04Å
136	S	94.8	Very high	91	Very high	78 Å²	78	56.3 Å²	56.3	55%	0.545	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-67.2	-22.5	177.6	53.2	0	0	0	0	113.5	A134	A134-S136 PolarHBondContact O-N 3.12Å; A134-S136 VanDerWaalsContact O-N 3.11Å
137	S	94.9	Very high	90.1	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.021	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-91	-8.3	177.8	-54.4	0	0	0	0	113	N112 A134 H135 Q139 R140 V141	N112-S137 PolarHBondContact OD1-OG 3.01Å; N112-S137 VanDerWaalsContact OD1-OG 3.09Å; A134-S137 WeakPolarHBondContact O-CA 3.43Å; A134-S137 WeakPolarHBondContact O-CB 3.27Å; A134-S137 PolarHBondContact O-N 3.39Å; H135-S137 PolarHBondContact O-N 3.04Å; S137-Q139 VanDerWaalsContact C-N 3.3Å; S137-Q139 PolarHBondContact O-N 3.44Å; S137-R140 PolarHBondContact O-N 3.37Å; S137-R140 PolarHBondContact OG-NH2 3.07Å; S137-R140 VanDerWaalsContact OG-NH2 3.08Å; S137-V141 PolarHBondContact O-N 3.22Å
138	M	91.3	Very high	89.2	Confident	6 Å²	6	49.8 Å²	49.8	3%	0.03	23%	0.232	C	C	.	.	H	α-helix	trans	-52.6	-46.8	-175	-177.9	-176.7	73.5	0	0	112	A134 H135 R140 V141 L142 F159 V174 N177 L178	A134-M138 PolarHBondContact O-N 3.25Å; H135-M138 VanDerWaalsContact O-CB 3.3Å; H135-M138 WeakPolarHBondContact O-CB 3.09Å; H135-M138 PolarHBondContact O-N 3.22Å; M138-R140 VanDerWaalsContact C-N 3.33Å; M138-R140 PolarHBondContact O-N 3.19Å; M138-V141 PolarHBondContact O-N 3.31Å; M138-L142 HydrophobicContact CE-CD1 4.48Å; M138-L142 HydrophobicContact CG-CD1 3.83Å; M138-L142 HydrophobicContact CG-CG 4.24Å; M138-L142 WeakPolarHBondContact O-CB 3.43Å; M138-L142 VanDerWaalsContact O-CG 3.23Å; M138-L142 WeakPolarHBondContact O-CG 3.44Å; M138-L142 PolarHBondContact O-N 3.12Å; M138-L142 HydrophobicContact SD-CD1 4.43Å; M138-F159 HydrophobicContact CB-CE1 4.38Å; M138-F159 HydrophobicContact CG-CE1 4.2Å; M138-V174 HydrophobicContact CE-CG2 4.24Å; M138-V174 HydrophobicContact SD-CB 4.33Å; M138-V174 HydrophobicContact SD-CG1 3.81Å; M138-V174 HydrophobicContact SD-CG2 4.37Å; M138-N177 HydrophobicContact CE-CB 3.72Å; M138-N177 HydrophobicContact SD-CB 3.9Å; M138-L178 HydrophobicContact SD-CD2 4.19Å; M138-L178 HydrophobicContact SD-CG 4.29Å
139	Q	90.4	Very high	88.3	Confident	96 Å²	96	53.7 Å²	53.7	45%	0.449	25%	0.251	S	S	.	.	H	α-helix	trans	-64.9	-35.7	-178.5	-67	-60.8	-28.1	0	0	112.8	S137 R143	S137-Q139 VanDerWaalsContact C-N 3.3Å; S137-Q139 PolarHBondContact O-N 3.44Å; Q139-R143 VanDerWaalsContact O-CG 3.26Å; Q139-R143 WeakPolarHBondContact O-CG 3.45Å; Q139-R143 PolarHBondContact O-N 2.93Å; Q139-R143 VanDerWaalsContact O-N 3.1Å
140	R	90.8	Very high	87.1	Confident	108 Å²	108	59 Å²	59	41%	0.408	28%	0.278	S	S	.	.	H	α-helix	trans	-69.6	-44	176.2	-67.3	-165.7	-60.5	-85.1	-6	111.2	D113 S137 M138 L142 R143 S144	D113-R140 HydrophobicContact CB-CB 3.98Å; D113-R140 IonicContact OD1-CZ 3.67Å; D113-R140 IonicContact OD1-NE 3.35Å; D113-R140 PolarHBondContact OD1-NE 3.43Å; D113-R140 IonicContact OD1-NH2 3.68Å; D113-R140 PolarHBondContact OD1-NH2 2.81Å; D113-R140 WeakPolarHBondContact OD2-CB 3.23Å; D113-R140 WeakPolarHBondContact OD2-CD 3.04Å; D113-R140 IonicContact OD2-CZ 3.33Å; D113-R140 IonicContact OD2-NE 2.97Å; D113-R140 PolarHBondContact OD2-NE 3.23Å; S137-R140 PolarHBondContact O-N 3.37Å; S137-R140 PolarHBondContact OG-NH2 3.07Å; S137-R140 VanDerWaalsContact OG-NH2 3.08Å; M138-R140 VanDerWaalsContact C-N 3.33Å; M138-R140 PolarHBondContact O-N 3.19Å; R140-L142 VanDerWaalsContact C-N 3.33Å; R140-L142 PolarHBondContact O-N 3.27Å; R140-R143 PolarHBondContact O-N 3.41Å; R140-S144 PolarHBondContact O-N 3.33Å; R140-S144 PolarHBondContact O-OG 2.88Å
141	V	88.8	Confident	86.1	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.03	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-43.6	174.7	174.7	0	0	0	0	111.6	N112 D113 I133 S137 M138 R143 S144 L148	N112-V141 WeakPolarHBondContact O-CG2 3.27Å; D113-V141 HydrophobicContact CB-CG2 3.97Å; I133-V141 HydrophobicContact CD1-CG1 4.05Å; I133-V141 HydrophobicContact CD1-CG2 4.23Å; I133-V141 HydrophobicContact CG1-CG2 4.37Å; I133-V141 HydrophobicContact CG2-CG2 3.95Å; S137-V141 PolarHBondContact O-N 3.22Å; M138-V141 PolarHBondContact O-N 3.31Å; V141-R143 VanDerWaalsContact C-N 3.32Å; V141-R143 PolarHBondContact O-N 2.93Å; V141-S144 PolarHBondContact O-N 3.22Å; V141-L148 HydrophobicContact CG1-CD1 4.25Å; V141-L148 HydrophobicContact CG1-CD2 3.89Å; V141-L148 HydrophobicContact CG1-CG 4.25Å
142	L	84.4	Confident	85	Confident	41 Å²	41	62.9 Å²	62.9	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-29.9	178.5	-71.5	175.9	0	0	0	113.5	M138 R140 R145 L148 M181	M138-L142 HydrophobicContact CE-CD1 4.48Å; M138-L142 HydrophobicContact CG-CD1 3.83Å; M138-L142 HydrophobicContact CG-CG 4.24Å; M138-L142 WeakPolarHBondContact O-CB 3.43Å; M138-L142 VanDerWaalsContact O-CG 3.23Å; M138-L142 WeakPolarHBondContact O-CG 3.44Å; M138-L142 PolarHBondContact O-N 3.12Å; M138-L142 HydrophobicContact SD-CD1 4.43Å; R140-L142 VanDerWaalsContact C-N 3.33Å; R140-L142 PolarHBondContact O-N 3.27Å; L142-R145 VanDerWaalsContact O-CG 3.24Å; L142-R145 WeakPolarHBondContact O-CG 3.3Å; L142-L148 HydrophobicContact CD2-CD1 4.18Å; L142-M181 HydrophobicContact CD2-CG 4.07Å; L142-M181 HydrophobicContact CD2-SD 3.36Å; L142-M181 WeakPolarHBondContact CD2-SD 3.38Å
143	R	85	Confident	84	Confident	198 Å²	198	68.7 Å²	68.7	75%	0.747	34%	0.335	S	S	*	.	H	α-helix	trans	-70.3	-34.6	174.2	-75.4	172.8	-171.9	-173.2	1.9	111.5	Q139 R140 V141 R145	Q139-R143 VanDerWaalsContact O-CG 3.26Å; Q139-R143 WeakPolarHBondContact O-CG 3.45Å; Q139-R143 PolarHBondContact O-N 2.93Å; Q139-R143 VanDerWaalsContact O-N 3.1Å; R140-R143 PolarHBondContact O-N 3.41Å; V141-R143 VanDerWaalsContact C-N 3.32Å; V141-R143 PolarHBondContact O-N 2.93Å; R143-R145 PolarHBondContact O-N 2.76Å
144	S	79.6	Confident	83.4	Confident	49 Å²	49	73.9 Å²	73.9	34%	0.343	36%	0.363	S	S	.	.			trans	-76.3	54.5	173.5	-59.9	0	0	0	0	111.9	R140 V141 H146 E147 L148	R140-S144 PolarHBondContact O-N 3.33Å; R140-S144 PolarHBondContact O-OG 2.88Å; V141-S144 PolarHBondContact O-N 3.22Å; S144-H146 PolarHBondContact O-N 3.38Å; S144-H146 VanDerWaalsContact O-N 3.11Å; S144-E147 WeakPolarHBondContact O-CB 3.36Å; S144-E147 PolarHBondContact O-N 2.82Å; S144-L148 PolarHBondContact O-N 2.84Å
145	R	71.7	Confident	83.3	Confident	181 Å²	181	74 Å²	74	68%	0.683	36%	0.363	S	S	*	.	H	α-helix	trans	-53.3	-36.8	-176.5	-65.9	-175.7	-179.6	-170.3	0.5	112.6	L142 R143 E147 L148 L149	L142-R145 VanDerWaalsContact O-CG 3.24Å; L142-R145 WeakPolarHBondContact O-CG 3.3Å; R143-R145 PolarHBondContact O-N 2.76Å; R145-E147 VanDerWaalsContact C-N 3.32Å; R145-E147 PolarHBondContact O-N 2.99Å; R145-L148 PolarHBondContact O-N 2.91Å; R145-L149 HydrophobicContact CB-CD1 4.43Å; R145-L149 WeakPolarHBondContact O-CB 3.14Å; R145-L149 VanDerWaalsContact O-CG 3.22Å; R145-L149 WeakPolarHBondContact O-CG 3.31Å; R145-L149 PolarHBondContact O-N 3.49Å
146	H	72.3	Confident	83.3	Confident	145 Å²	145	72.2 Å²	72.2	67%	0.671	36%	0.355	S	S	*	.	H	α-helix	trans	-60.2	-39.5	177.5	-67.6	-69.1	0	0	0	112.7	S144 L148 L149 N150	S144-H146 PolarHBondContact O-N 3.38Å; S144-H146 VanDerWaalsContact O-N 3.11Å; H146-L148 VanDerWaalsContact C-N 3.34Å; H146-L148 PolarHBondContact O-N 2.82Å; H146-L149 PolarHBondContact O-N 3.1Å; H146-N150 WeakPolarHBondContact O-CB 3.32Å; H146-N150 PolarHBondContact O-N 3.46Å; H146-N150 PolarHBondContact O-ND2 2.75Å
147	E	74.8	Confident	83.4	Confident	31 Å²	31	68.6 Å²	68.6	15%	0.145	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-35.9	177	-73.8	-86.2	157.1	0	0	111.9	T116 A117 R131 S144 R145 A151	T116-E147 PolarHBondContact N-OE1 2.89Å; T116-E147 VanDerWaalsContact N-OE1 3.11Å; A117-E147 PolarHBondContact N-OE1 2.92Å; R131-E147 IonicContact CZ-OE2 2.77Å; R131-E147 IonicContact NH1-OE2 3.72Å; R131-E147 PolarHBondContact NH1-OE2 3.14Å; R131-E147 IonicContact NH2-OE2 2.67Å; R131-E147 PolarHBondContact NH2-OE2 2.81Å; S144-E147 WeakPolarHBondContact O-CB 3.36Å; S144-E147 PolarHBondContact O-N 2.82Å; R145-E147 VanDerWaalsContact C-N 3.32Å; R145-E147 PolarHBondContact O-N 2.99Å; E147-A151 PolarHBondContact O-N 3.05Å
148	L	76.5	Confident	83.5	Confident	9 Å²	9	68.4 Å²	68.4	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-74.1	-38	176.1	-68.9	174.4	0	0	0	112.6	V141 L142 S144 R145 H146 A151 F157 M181	V141-L148 HydrophobicContact CG1-CD1 4.25Å; V141-L148 HydrophobicContact CG1-CD2 3.89Å; V141-L148 HydrophobicContact CG1-CG 4.25Å; L142-L148 HydrophobicContact CD2-CD1 4.18Å; S144-L148 PolarHBondContact O-N 2.84Å; R145-L148 PolarHBondContact O-N 2.91Å; H146-L148 VanDerWaalsContact C-N 3.34Å; H146-L148 PolarHBondContact O-N 2.82Å; L148-A151 WeakPolarHBondContact O-CB 3.16Å; L148-F157 HydrophobicContact CD2-CD1 4.24Å; L148-F157 HydrophobicContact CD2-CE1 3.59Å; L148-F157 HydrophobicContact CD2-CZ 3.82Å; L148-M181 HydrophobicContact CD1-SD 4.44Å
149	L	75.8	Confident	83.8	Confident	104 Å²	104	68.3 Å²	68.3	55%	0.545	33%	0.328	S	S	.	.	H	α-helix	trans	-76.8	-33.5	-179.7	-69	172.2	0	0	0	112.4	R145 H146 A151 L185	R145-L149 HydrophobicContact CB-CD1 4.43Å; R145-L149 WeakPolarHBondContact O-CB 3.14Å; R145-L149 VanDerWaalsContact O-CG 3.22Å; R145-L149 WeakPolarHBondContact O-CG 3.31Å; R145-L149 PolarHBondContact O-N 3.49Å; H146-L149 PolarHBondContact O-N 3.1Å; L149-A151 VanDerWaalsContact C-N 3.3Å; L149-L185 HydrophobicContact CD2-CD1 4.42Å; L149-L185 HydrophobicContact CD2-CD2 3.78Å
150	N	73.1	Confident	84.2	Confident	131 Å²	131	64.1 Å²	64.1	70%	0.701	31%	0.308	S	S	*	.	S	Bend	trans	-85.4	-6.3	176.2	-64	-16.1	0	0	0	112.5	H146 S152	H146-N150 WeakPolarHBondContact O-CB 3.32Å; H146-N150 PolarHBondContact O-N 3.46Å; H146-N150 PolarHBondContact O-ND2 2.75Å; N150-S152 PolarHBondContact O-N 3.29Å
151	A	76.9	Confident	84.4	Confident	24 Å²	24	59.2 Å²	59.2	20%	0.198	29%	0.291	C	S	.	.	S	Bend	trans	-57.7	140.1	171.5	0	0	0	0	0	109.3	E147 L148 L149 T155 F157	E147-A151 PolarHBondContact O-N 3.05Å; L148-A151 WeakPolarHBondContact O-CB 3.16Å; L149-A151 VanDerWaalsContact C-N 3.3Å; A151-T155 HydrophobicContact CB-CG2 4.35Å; A151-F157 HydrophobicContact CB-CE2 4.24Å; A151-F157 HydrophobicContact CB-CZ 3.78Å
152	S	74.8	Confident	84.7	Confident	66 Å²	66	60 Å²	60	46%	0.462	30%	0.296	S	S	.	.			trans	-56.7	148.6	170.8	174.6	0	0	0	0	108.8	N150 D154 T155	N150-S152 PolarHBondContact O-N 3.29Å; S152-D154 PolarHBondContact O-N 3.29Å; S152-D154 PolarHBondContact OG-N 3.39Å; S152-T155 PolarHBondContact N-OG1 3.04Å; S152-T155 WeakPolarHBondContact O-CB 3.34Å; S152-T155 PolarHBondContact O-N 3.23Å; S152-T155 PolarHBondContact O-OG1 3.25Å
153	Q	76.2	Confident	85.1	Confident	122 Å²	122	60.7 Å²	60.7	57%	0.57	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-19	170.9	-66.5	179.9	5.2	0	0	111.7	K187 K189	Q153-K187 HydrophobicContact CG-CD 4.19Å; Q153-K189 WeakPolarHBondContact O-CE 3.35Å
154	D	87.1	Confident	85.6	Confident	109 Å²	109	53.8 Å²	53.8	58%	0.583	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-6.6	177.1	-66.8	-48.2	0	0	0	115.4	S152 V156 K189	S152-D154 PolarHBondContact O-N 3.29Å; S152-D154 PolarHBondContact OG-N 3.39Å; D154-V156 PolarHBondContact O-N 3.14Å; D154-K189 IonicContact OD1-NZ 3.39Å; D154-K189 PolarHBondContact OD1-NZ 2.84Å
155	T	94.1	Very high	86.3	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.025	29%	0.29	C	S	.	.			trans	-65.6	126.1	178.4	-58.3	0	0	0	0	110.7	T128 S129 A151 S152 F157	T128-T155 HydrophobicContact CG2-CG2 4.05Å; T128-T155 PolarHBondContact O-OG1 2.01Å; S129-T155 WeakPolarHBondContact O-CA 3.3Å; A151-T155 HydrophobicContact CB-CG2 4.35Å; S152-T155 PolarHBondContact N-OG1 3.04Å; S152-T155 WeakPolarHBondContact O-CB 3.34Å; S152-T155 PolarHBondContact O-N 3.23Å; S152-T155 PolarHBondContact O-OG1 3.25Å; T155-F157 HydrophobicContact CG2-CD2 4.33Å; T155-F157 HydrophobicContact CG2-CE1 4.25Å; T155-F157 HydrophobicContact CG2-CE2 3.67Å; T155-F157 HydrophobicContact CG2-CZ 3.64Å
156	V	96.1	Very high	87.4	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.042	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.3	177.2	179.1	0	0	0	0	110	L77 M79 S129 L130 R131 D154 I158 K189 Y191	L77-V156 HydrophobicContact CD1-CG1 3.92Å; L77-V156 HydrophobicContact CD1-CG2 4.21Å; L77-V156 HydrophobicContact CD2-CG1 4.19Å; M79-V156 HydrophobicContact SD-CG2 4.2Å; S129-V156 PolarHBondContact O-N 3.03Å; L130-V156 CarbonylContact C-O 3.15Å; L130-V156 WeakPolarHBondContact CA-O 3.29Å; L130-V156 HydrophobicContact CD1-CB 3.89Å; L130-V156 HydrophobicContact CD1-CG1 3.74Å; R131-V156 PolarHBondContact N-O 3.07Å; D154-V156 PolarHBondContact O-N 3.14Å; V156-I158 HydrophobicContact CG1-CG1 4.13Å; V156-K189 HydrophobicContact CG2-CB 4.28Å; V156-K189 HydrophobicContact CG2-CD 4.21Å; V156-Y191 HydrophobicContact CG1-CD2 3.73Å; V156-Y191 HydrophobicContact CG1-CE2 4.05Å
157	F	96.6	Very high	88.5	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117.2	176	-61.5	-92.2	0	0	0	109.7	R131 I133 L148 A151 T155 F159 L188 K189 Y191	R131-F157 HydrophobicContact CB-CD1 3.96Å; R131-F157 HydrophobicContact CB-CE1 4.22Å; R131-F157 WeakPolarHBondContact O-CA 3.29Å; I133-F157 HydrophobicContact CD1-CB 4.49Å; I133-F157 HydrophobicContact CD1-CD1 3.83Å; L148-F157 HydrophobicContact CD2-CD1 4.24Å; L148-F157 HydrophobicContact CD2-CE1 3.59Å; L148-F157 HydrophobicContact CD2-CZ 3.82Å; A151-F157 HydrophobicContact CB-CE2 4.24Å; A151-F157 HydrophobicContact CB-CZ 3.78Å; T155-F157 HydrophobicContact CG2-CD2 4.33Å; T155-F157 HydrophobicContact CG2-CE1 4.25Å; T155-F157 HydrophobicContact CG2-CE2 3.67Å; T155-F157 HydrophobicContact CG2-CZ 3.64Å; F157-F159 HydrophobicContact CB-CD2 4.46Å; F157-F159 HydrophobicContact CB-CE2 3.87Å; F157-L188 HydrophobicContact CD2-CD2 4.46Å; F157-L188 HydrophobicContact CE2-CD2 3.79Å; F157-L188 HydrophobicContact CZ-CD2 4.47Å; F157-K189 PolarHBondContact N-O 2.93Å; F157-Y191 PolarHBondContact O-N 2.79Å
158	I	97.9	Very high	89.3	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.4	177.4	-60.9	177.7	0	0	0	109.1	Y68 L77 L130 R131 V132 I133 V156 Y191 I193 I229	Y68-I158 HydrophobicContact CD1-CD1 3.94Å; Y68-I158 HydrophobicContact CD1-CG2 4.08Å; Y68-I158 HydrophobicContact CE1-CD1 4.42Å; L77-I158 HydrophobicContact CD2-CD1 3.8Å; L130-I158 HydrophobicContact CD1-CD1 3.59Å; L130-I158 HydrophobicContact CD1-CG1 3.72Å; L130-I158 HydrophobicContact CD2-CD1 4.45Å; R131-I158 PolarHBondContact O-N 3.43Å; V132-I158 CarbonylContact C-O 3.57Å; V132-I158 WeakPolarHBondContact CA-O 3.4Å; I133-I158 PolarHBondContact N-O 2.93Å; V156-I158 HydrophobicContact CG1-CG1 4.13Å; I158-Y191 WeakPolarHBondContact CA-O 3.43Å; I158-I193 HydrophobicContact CG2-CD1 3.96Å; I158-I193 HydrophobicContact CG2-CG1 3.55Å; I158-I229 HydrophobicContact CD1-CD1 4.4Å; I158-I229 HydrophobicContact CD1-CG2 4.48Å
159	F	97.8	Very high	90.1	Very high	3 Å²	3	55 Å²	55	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.4	176.6	-70.8	-98	0	0	0	111.8	I133 M138 F157 M166 L178 M181 V190 Y191 I192 I193	I133-F159 HydrophobicContact CB-CD1 3.78Å; I133-F159 HydrophobicContact CB-CE1 3.76Å; I133-F159 HydrophobicContact CB-CG 4.33Å; I133-F159 HydrophobicContact CB-CZ 4.3Å; I133-F159 HydrophobicContact CD1-CE1 3.8Å; I133-F159 HydrophobicContact CD1-CE2 3.94Å; I133-F159 HydrophobicContact CD1-CZ 3.48Å; I133-F159 VanDerWaalsContact CD1-CZ 3.48Å; I133-F159 HydrophobicContact CG1-CE1 4.39Å; I133-F159 HydrophobicContact CG1-CZ 4.49Å; I133-F159 HydrophobicContact CG2-CD1 3.69Å; I133-F159 HydrophobicContact CG2-CE1 3.45Å; I133-F159 VanDerWaalsContact CG2-CE1 3.45Å; I133-F159 HydrophobicContact CG2-CZ 4.29Å; I133-F159 WeakPolarHBondContact O-CA 3.5Å; M138-F159 HydrophobicContact CB-CE1 4.38Å; M138-F159 HydrophobicContact CG-CE1 4.2Å; F157-F159 HydrophobicContact CB-CD2 4.46Å; F157-F159 HydrophobicContact CB-CE2 3.87Å; F159-M166 HydrophobicContact CB-CE 4.27Å; F159-L178 HydrophobicContact CB-CD1 3.66Å; F159-L178 HydrophobicContact CD1-CD1 4.1Å; F159-L178 HydrophobicContact CD1-CD2 3.82Å; F159-L178 HydrophobicContact CD2-CD1 3.91Å; F159-L178 HydrophobicContact CD2-CD2 3.7Å; F159-L178 HydrophobicContact CD2-CG 4.47Å; F159-L178 HydrophobicContact CE1-CD2 3.65Å; F159-L178 HydrophobicContact CE2-CD2 3.53Å; F159-L178 HydrophobicContact CG-CD1 3.62Å; F159-L178 HydrophobicContact CG-CD2 3.84Å; F159-L178 HydrophobicContact CG-CG 4.39Å; F159-L178 HydrophobicContact CZ-CD2 3.5Å; F159-L178 VanDerWaalsContact CZ-CD2 3.5Å; F159-M181 HydrophobicContact CE2-CE 4.47Å; F159-V190 HydrophobicContact CD2-CG1 4Å; F159-V190 HydrophobicContact CE2-CG1 4.05Å; F159-Y191 PolarHBondContact N-O 2.89Å; F159-I192 HydrophobicContact CB-CG2 4.45Å; F159-I192 WeakPolarHBondContact O-CA 3.46Å; F159-I193 PolarHBondContact O-N 3.11Å
160	W	97.8	Very high	91	Very high	8 Å²	8	52.4 Å²	52.4	3%	0.03	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.2	176	72.6	-92.7	0	0	0	111.5	I133 A134 H135 I193 M198 W219 L220 T222 F225	I133-W160 VanDerWaalsContact O-CD1 3.29Å; I133-W160 PolarHBondContact O-N 3.31Å; A134-W160 CarbonylContact C-O 3.59Å; A134-W160 HydrophobicContact CB-CD2 4.42Å; A134-W160 HydrophobicContact CB-CH2 4.26Å; A134-W160 HydrophobicContact CB-CZ2 3.48Å; A134-W160 VanDerWaalsContact CB-CZ2 3.48Å; H135-W160 WeakPolarHBondContact CB-O 3.46Å; H135-W160 PolarHBondContact N-O 2.86Å; W160-I193 HydrophobicContact CB-CB 4.27Å; W160-I193 HydrophobicContact CB-CD1 3.6Å; W160-I193 HydrophobicContact CB-CG1 3.96Å; W160-I193 HydrophobicContact CG-CD1 4.46Å; W160-M198 HydrophobicContact CB-SD 4.22Å; W160-M198 HydrophobicContact CE3-CE 4.06Å; W160-W219 HydrophobicContact CZ3-CE3 4.34Å; W160-L220 WeakPolarHBondContact CH2-O 3.32Å; W160-T222 PolarHBondContact NE1-OG1 3.2Å; W160-F225 AromaticContact CD2-CD2 3.61Å; W160-F225 HydrophobicContact CD2-CD2 3.61Å; W160-F225 AromaticContact CD2-CE2 3.47Å; W160-F225 HydrophobicContact CD2-CE2 3.47Å; W160-F225 VanDerWaalsContact CD2-CE2 3.47Å; W160-F225 HydrophobicContact CD2-CG 4.26Å; W160-F225 AromaticContact CD2-CZ 4Å; W160-F225 HydrophobicContact CD2-CZ 4Å; W160-F225 AromaticContact CE2-CD2 3.4Å; W160-F225 VanDerWaalsContact CE2-CD2 3.4Å; W160-F225 AromaticContact CE2-CE2 3.55Å; W160-F225 HydrophobicContact CE3-CD2 4.03Å; W160-F225 HydrophobicContact CE3-CE1 4.47Å; W160-F225 AromaticContact CE3-CE2 3.38Å; W160-F225 HydrophobicContact CE3-CE2 3.38Å; W160-F225 AromaticContact CE3-CZ 3.64Å; W160-F225 HydrophobicContact CE3-CZ 3.64Å; W160-F225 HydrophobicContact CG-CD2 4.07Å; W160-F225 HydrophobicContact CG-CE2 4.28Å; W160-F225 HydrophobicContact CG-CG 4.27Å; W160-F225 HydrophobicContact CH2-CD2 4.1Å; W160-F225 AromaticContact CH2-CE2 3.49Å; W160-F225 HydrophobicContact CH2-CE2 3.49Å; W160-F225 VanDerWaalsContact CH2-CE2 3.49Å; W160-F225 HydrophobicContact CH2-CZ 4.4Å; W160-F225 AromaticContact CZ2-CD2 3.67Å; W160-F225 HydrophobicContact CZ2-CD2 3.67Å; W160-F225 AromaticContact CZ2-CE2 3.57Å; W160-F225 HydrophobicContact CZ2-CE2 3.57Å; W160-F225 HydrophobicContact CZ3-CD2 4.27Å; W160-F225 AromaticContact CZ3-CE2 3.4Å; W160-F225 HydrophobicContact CZ3-CE2 3.4Å; W160-F225 AromaticContact CZ3-CZ 3.87Å; W160-F225 HydrophobicContact CZ3-CZ 3.87Å; W160-F225 AromaticContact NE1-CD2 3.73Å
161	G	95.8	Very high	92.1	Very high	5 Å²	5	53.9 Å²	53.9	5%	0.052	28%	0.283	C	S	.	.			trans	178.2	179.3	179	0	0	0	0	0	113.7
162	P	93.8	Very high	93	Very high	23 Å²	23	52.8 Å²	52.8	15%	0.149	27%	0.273	C	S	.	.			trans	-59.4	143.3	176.9	-13.3	22.4	0	0	0	111.2	H135 S164 Y165 M166 W219	H135-P162 WeakPolarHBondContact CE1-CD 3.17Å; H135-P162 WeakPolarHBondContact ND1-CD 3.5Å; P162-S164 PolarHBondContact O-N 2.91Å; P162-S164 VanDerWaalsContact O-N 3.12Å; P162-Y165 HydrophobicContact CB-CD2 4.11Å; P162-Y165 HydrophobicContact CG-CD2 4Å; P162-Y165 PolarHBondContact O-N 3.25Å; P162-M166 WeakPolarHBondContact O-CG 3.33Å; P162-M166 PolarHBondContact O-N 3.05Å; P162-M166 VanDerWaalsContact O-N 3.16Å; P162-W219 HydrophobicContact CB-CH2 4.03Å; P162-W219 HydrophobicContact CG-CH2 3.64Å; P162-W219 HydrophobicContact CG-CZ2 4.39Å; P162-W219 HydrophobicContact CG-CZ3 4.16Å
163	S	93.2	Very high	93.9	Very high	54 Å²	54	54.6 Å²	54.6	38%	0.378	28%	0.277	S	S	.	.	H	α-helix	trans	-56.5	-31.7	-179.8	53.2	0	0	0	0	113.5	Y165 M166 R167 W195	S163-Y165 VanDerWaalsContact C-N 3.25Å; S163-Y165 PolarHBondContact O-N 3.17Å; S163-M166 PolarHBondContact O-N 2.91Å; S163-R167 WeakPolarHBondContact O-CB 3.34Å; S163-R167 WeakPolarHBondContact O-CG 3.44Å; S163-R167 PolarHBondContact O-N 2.92Å; S163-W195 VanDerWaalsContact CB-CE3 3.5Å
164	S	94.7	Very high	94.9	Very high	54 Å²	54	49 Å²	49	38%	0.378	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-29.1	175.6	54.8	0	0	0	0	113.8	P162 R167	P162-S164 PolarHBondContact O-N 2.91Å; P162-S164 VanDerWaalsContact O-N 3.12Å; S164-R167 WeakPolarHBondContact O-CD 3.23Å; S164-R167 WeakPolarHBondContact O-CG 3.47Å
165	Y	95.6	Very high	95.3	Very high	106 Å²	106	44.4 Å²	44.4	42%	0.416	23%	0.226	S	C	.	.	H	α-helix	trans	-93.2	-23.1	177.4	-73.2	-95.8	0	0	0	112.8	P162 S163 G172 L173 V174 Y175	P162-Y165 HydrophobicContact CB-CD2 4.11Å; P162-Y165 HydrophobicContact CG-CD2 4Å; P162-Y165 PolarHBondContact O-N 3.25Å; S163-Y165 VanDerWaalsContact C-N 3.25Å; S163-Y165 PolarHBondContact O-N 3.17Å; Y165-G172 CarbonylContact O-C 3.53Å; Y165-G172 VanDerWaalsContact O-CA 3.26Å; Y165-G172 WeakPolarHBondContact O-CA 3.43Å; Y165-L173 HydrophobicContact CD1-CB 4.33Å; Y165-L173 PolarHBondContact O-N 3.04Å; Y165-V174 HydrophobicContact CD1-CG2 4.02Å; Y165-V174 HydrophobicContact CG-CG2 4.41Å; Y165-V174 WeakPolarHBondContact O-CB 3.43Å; Y165-V174 PolarHBondContact O-N 2.86Å; Y165-V174 VanDerWaalsContact O-N 3.07Å; Y165-Y175 PolarHBondContact O-N 2.91Å
166	M	95.4	Very high	95.4	Very high	16 Å²	16	46.9 Å²	46.9	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-101.3	-2.4	-174.1	-57.9	-59	-70	0	0	114.2	F159 P162 S163 V174 L178 I192	F159-M166 HydrophobicContact CB-CE 4.27Å; P162-M166 WeakPolarHBondContact O-CG 3.33Å; P162-M166 PolarHBondContact O-N 3.05Å; P162-M166 VanDerWaalsContact O-N 3.16Å; S163-M166 PolarHBondContact O-N 2.91Å; M166-V174 HydrophobicContact CE-CG1 4.4Å; M166-V174 HydrophobicContact SD-CB 3.87Å; M166-V174 HydrophobicContact SD-CG1 3.44Å; M166-V174 WeakPolarHBondContact SD-CG1 3.49Å; M166-L178 HydrophobicContact CE-CD1 4.38Å; M166-I192 HydrophobicContact CE-CB 3.66Å; M166-I192 HydrophobicContact CE-CG2 3.42Å; M166-I192 VanDerWaalsContact CE-CG2 3.42Å
167	R	93.9	Very high	95.3	Very high	112 Å²	112	49 Å²	49	42%	0.423	25%	0.25	S	S	.	.			trans	-63.7	149.6	178.9	48.6	172.6	30.3	135.7	-1.9	113.1	S163 S164 D169 G172 Y175	S163-R167 WeakPolarHBondContact O-CB 3.34Å; S163-R167 WeakPolarHBondContact O-CG 3.44Å; S163-R167 PolarHBondContact O-N 2.92Å; S164-R167 WeakPolarHBondContact O-CD 3.23Å; S164-R167 WeakPolarHBondContact O-CG 3.47Å; R167-D169 VanDerWaalsContact CD-OD1 3.26Å; R167-D169 WeakPolarHBondContact CD-OD1 3.29Å; R167-D169 WeakPolarHBondContact CD-OD2 3.26Å; R167-D169 WeakPolarHBondContact CG-OD1 3.44Å; R167-D169 IonicContact NE-OD1 3.09Å; R167-D169 IonicContact NE-OD2 2.81Å; R167-D169 PolarHBondContact NE-OD2 2.78Å; R167-G172 VanDerWaalsContact O-CA 3.29Å; R167-G172 WeakPolarHBondContact O-CA 3.49Å; R167-G172 PolarHBondContact O-N 2.84Å; R167-Y175 WeakPolarHBondContact O-CB 3.26Å
168	R	93.1	Very high	95.1	Very high	113 Å²	113	49 Å²	49	43%	0.426	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-1.7	-170.5	-40.7	179.5	87.7	171.8	20.2	113.8	H74 G170 Y175	H74-R168 PolarHBondContact CE1-NH2 2.8Å; H74-R168 VanDerWaalsContact CG-NH2 3.31Å; H74-R168 PolarHBondContact ND1-NH2 3.25Å; H74-R168 PolarHBondContact NE2-NH2 3.33Å; R168-G170 PolarHBondContact O-N 3.09Å; R168-Y175 HydrophobicContact CB-CE1 4.14Å; R168-Y175 HydrophobicContact CB-CE2 4.4Å; R168-Y175 HydrophobicContact CG-CD2 4.09Å; R168-Y175 HydrophobicContact CG-CE1 4.34Å; R168-Y175 HydrophobicContact CG-CE2 3.71Å; R168-Y175 PolarHBondContact NE-OH 3.09Å; R168-Y175 PolarHBondContact NH2-OH 3.11Å
169	D	93.5	Very high	95	Very high	94 Å²	94	55.3 Å²	55.3	50%	0.503	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	18.2	-178.5	62.6	-1.7	0	0	0	113.5	R167 K171	R167-D169 VanDerWaalsContact CD-OD1 3.26Å; R167-D169 WeakPolarHBondContact CD-OD1 3.29Å; R167-D169 WeakPolarHBondContact CD-OD2 3.26Å; R167-D169 WeakPolarHBondContact CG-OD1 3.44Å; R167-D169 IonicContact NE-OD1 3.09Å; R167-D169 IonicContact NE-OD2 2.81Å; R167-D169 PolarHBondContact NE-OD2 2.78Å; D169-K171 PolarHBondContact O-N 2.95Å; D169-K171 WeakPolarHBondContact OD1-CB 3.34Å; D169-K171 PolarHBondContact OD1-N 3.29Å
170	G	93.4	Very high	94.7	Very high	48 Å²	48	59.9 Å²	59.9	50%	0.495	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-6.7	-174.5	0	0	0	0	0	114.9	R168 N176	R168-G170 PolarHBondContact O-N 3.09Å; G170-N176 PolarHBondContact O-ND2 3.36Å
171	K	95.5	Very high	94.3	Very high	163 Å²	163	60.4 Å²	60.4	71%	0.709	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-6.5	179.5	-59.7	177.5	-179	177.2	0	113.7	D169 L173	D169-K171 PolarHBondContact O-N 2.95Å; D169-K171 WeakPolarHBondContact OD1-CB 3.34Å; D169-K171 PolarHBondContact OD1-N 3.29Å; K171-L173 PolarHBondContact O-N 2.81Å
172	G	95.9	Very high	94	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.303	C	S	.	.			trans	-81.1	96.4	179.4	0	0	0	0	0	111.4	Y165 R167 V174 Y175 N176	Y165-G172 CarbonylContact O-C 3.53Å; Y165-G172 VanDerWaalsContact O-CA 3.26Å; Y165-G172 WeakPolarHBondContact O-CA 3.43Å; R167-G172 VanDerWaalsContact O-CA 3.29Å; R167-G172 WeakPolarHBondContact O-CA 3.49Å; R167-G172 PolarHBondContact O-N 2.84Å; G172-V174 VanDerWaalsContact C-N 3.28Å; G172-V174 PolarHBondContact O-N 2.81Å; G172-Y175 PolarHBondContact O-N 2.95Å; G172-N176 WeakPolarHBondContact O-CB 3.27Å; G172-N176 PolarHBondContact O-N 3.11Å; G172-N176 PolarHBondContact O-ND2 2.86Å
173	L	95.4	Very high	93.9	Very high	104 Å²	104	65.3 Å²	65.3	55%	0.545	32%	0.321	S	S	.	.	H	α-helix	trans	-53.1	-44.9	-175.7	-178	64.6	0	0	0	112.5	Y165 K171 N177	Y165-L173 HydrophobicContact CD1-CB 4.33Å; Y165-L173 PolarHBondContact O-N 3.04Å; K171-L173 PolarHBondContact O-N 2.81Å; L173-N177 PolarHBondContact O-N 2.77Å; L173-N177 VanDerWaalsContact O-N 3.12Å; L173-N177 PolarHBondContact O-ND2 2.98Å
174	V	95.3	Very high	93.6	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.03	33%	0.333	C	S	.	.	H	α-helix	trans	-71.7	-46	-178.7	172	0	0	0	0	110.2	H135 M138 Y165 M166 G172 N176 N177 L178	H135-V174 HydrophobicContact CB-CG1 4.28Å; H135-V174 HydrophobicContact CB-CG2 4.04Å; M138-V174 HydrophobicContact CE-CG2 4.24Å; M138-V174 HydrophobicContact SD-CB 4.33Å; M138-V174 HydrophobicContact SD-CG1 3.81Å; M138-V174 HydrophobicContact SD-CG2 4.37Å; Y165-V174 HydrophobicContact CD1-CG2 4.02Å; Y165-V174 HydrophobicContact CG-CG2 4.41Å; Y165-V174 WeakPolarHBondContact O-CB 3.43Å; Y165-V174 PolarHBondContact O-N 2.86Å; Y165-V174 VanDerWaalsContact O-N 3.07Å; M166-V174 HydrophobicContact CE-CG1 4.4Å; M166-V174 HydrophobicContact SD-CB 3.87Å; M166-V174 HydrophobicContact SD-CG1 3.44Å; M166-V174 WeakPolarHBondContact SD-CG1 3.49Å; G172-V174 VanDerWaalsContact C-N 3.28Å; G172-V174 PolarHBondContact O-N 2.81Å; V174-N176 VanDerWaalsContact C-N 3.31Å; V174-N176 PolarHBondContact O-N 3.08Å; V174-N177 PolarHBondContact O-N 3.11Å; V174-L178 HydrophobicContact CG1-CD1 3.93Å; V174-L178 HydrophobicContact CG1-CG 4.29Å; V174-L178 VanDerWaalsContact O-CG 3.28Å; V174-L178 WeakPolarHBondContact O-CG 3.46Å; V174-L178 PolarHBondContact O-N 3Å
175	Y	96.1	Very high	93.3	Very high	13 Å²	13	67.4 Å²	67.4	5%	0.051	33%	0.327	C	S	.	.	H	α-helix	trans	-54.3	-47.4	175.9	-175.6	-87.2	0	0	0	112.2	I71 Y165 R167 R168 G172 L178 R179 I192	I71-Y175 HydrophobicContact CD1-CD2 3.51Å; I71-Y175 HydrophobicContact CD1-CE1 4.41Å; I71-Y175 HydrophobicContact CD1-CE2 3.26Å; I71-Y175 HydrophobicContact CD1-CG 4.17Å; I71-Y175 HydrophobicContact CG1-CE2 4.4Å; Y165-Y175 PolarHBondContact O-N 2.91Å; R167-Y175 WeakPolarHBondContact O-CB 3.26Å; R168-Y175 HydrophobicContact CB-CE1 4.14Å; R168-Y175 HydrophobicContact CB-CE2 4.4Å; R168-Y175 HydrophobicContact CG-CD2 4.09Å; R168-Y175 HydrophobicContact CG-CE1 4.34Å; R168-Y175 HydrophobicContact CG-CE2 3.71Å; R168-Y175 PolarHBondContact NE-OH 3.09Å; R168-Y175 PolarHBondContact NH2-OH 3.11Å; G172-Y175 PolarHBondContact O-N 2.95Å; Y175-L178 PolarHBondContact O-N 2.98Å; Y175-R179 WeakPolarHBondContact O-CB 3.41Å; Y175-R179 PolarHBondContact O-N 2.95Å; Y175-I192 HydrophobicContact CD2-CD1 3.76Å; Y175-I192 HydrophobicContact CE2-CD1 3.72Å
176	N	95.6	Very high	92.9	Very high	56 Å²	56	67.1 Å²	67.1	30%	0.299	34%	0.338	S	S	.	.	H	α-helix	trans	-63.7	-42.9	-179.6	-66.6	-16.7	0	0	0	111.9	G170 G172 V174 R179 L180	G170-N176 PolarHBondContact O-ND2 3.36Å; G172-N176 WeakPolarHBondContact O-CB 3.27Å; G172-N176 PolarHBondContact O-N 3.11Å; G172-N176 PolarHBondContact O-ND2 2.86Å; V174-N176 VanDerWaalsContact C-N 3.31Å; V174-N176 PolarHBondContact O-N 3.08Å; N176-R179 PolarHBondContact O-N 3.32Å; N176-L180 PolarHBondContact O-N 2.84Å
177	N	94.3	Very high	92.5	Very high	52 Å²	52	73 Å²	73	28%	0.278	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.3	-85.5	-89.4	0	0	0	111.8	M138 L173 V174 L180 M181	M138-N177 HydrophobicContact CE-CB 3.72Å; M138-N177 HydrophobicContact SD-CB 3.9Å; L173-N177 PolarHBondContact O-N 2.77Å; L173-N177 VanDerWaalsContact O-N 3.12Å; L173-N177 PolarHBondContact O-ND2 2.98Å; V174-N177 PolarHBondContact O-N 3.11Å; N177-L180 PolarHBondContact O-N 2.77Å; N177-M181 WeakPolarHBondContact O-CB 3.41Å; N177-M181 PolarHBondContact O-N 2.99Å
178	L	94.2	Very high	92.2	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-39.9	176.9	-67.5	175.6	0	0	0	112	I71 M138 F159 M166 V174 Y175 M181 N182 V190 I192	I71-L178 HydrophobicContact CD1-CB 4.18Å; I71-L178 HydrophobicContact CG1-CB 4.27Å; M138-L178 HydrophobicContact SD-CD2 4.19Å; M138-L178 HydrophobicContact SD-CG 4.29Å; F159-L178 HydrophobicContact CB-CD1 3.66Å; F159-L178 HydrophobicContact CD1-CD1 4.1Å; F159-L178 HydrophobicContact CD1-CD2 3.82Å; F159-L178 HydrophobicContact CD2-CD1 3.91Å; F159-L178 HydrophobicContact CD2-CD2 3.7Å; F159-L178 HydrophobicContact CD2-CG 4.47Å; F159-L178 HydrophobicContact CE1-CD2 3.65Å; F159-L178 HydrophobicContact CE2-CD2 3.53Å; F159-L178 HydrophobicContact CG-CD1 3.62Å; F159-L178 HydrophobicContact CG-CD2 3.84Å; F159-L178 HydrophobicContact CG-CG 4.39Å; F159-L178 HydrophobicContact CZ-CD2 3.5Å; F159-L178 VanDerWaalsContact CZ-CD2 3.5Å; M166-L178 HydrophobicContact CE-CD1 4.38Å; V174-L178 HydrophobicContact CG1-CD1 3.93Å; V174-L178 HydrophobicContact CG1-CG 4.29Å; V174-L178 VanDerWaalsContact O-CG 3.28Å; V174-L178 WeakPolarHBondContact O-CG 3.46Å; V174-L178 PolarHBondContact O-N 3Å; Y175-L178 PolarHBondContact O-N 2.98Å; L178-M181 HydrophobicContact CD2-CE 4.05Å; L178-M181 PolarHBondContact O-N 3.28Å; L178-N182 WeakPolarHBondContact O-CB 3.4Å; L178-N182 PolarHBondContact O-N 3.45Å; L178-V190 HydrophobicContact CB-CG1 4.42Å; L178-V190 HydrophobicContact CD2-CG1 4.37Å; L178-I192 HydrophobicContact CD1-CG2 3.96Å
179	R	94.6	Very high	92.3	Very high	131 Å²	131	67 Å²	67	49%	0.494	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-46.6	175	-173.1	-178.7	179.3	-158.6	-0.3	111.1	I71 I72 Y175 N176 N182 Q183	I71-R179 HydrophobicContact CG1-CB 4.33Å; I72-R179 HydrophobicContact CD1-CG 4.19Å; Y175-R179 WeakPolarHBondContact O-CB 3.41Å; Y175-R179 PolarHBondContact O-N 2.95Å; N176-R179 PolarHBondContact O-N 3.32Å; R179-N182 PolarHBondContact O-N 3.2Å; R179-Q183 WeakPolarHBondContact O-CG 3.05Å; R179-Q183 PolarHBondContact O-N 3.45Å; R179-Q183 VanDerWaalsContact O-N 3.07Å
180	L	92.6	Very high	92.4	Very high	100 Å²	100	62.7 Å²	62.7	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-44.8	176.4	179.8	62.3	0	0	0	111.7	N176 N177 N182 Q183 V184	N176-L180 PolarHBondContact O-N 2.84Å; N177-L180 PolarHBondContact O-N 2.77Å; L180-N182 VanDerWaalsContact C-N 3.29Å; L180-N182 PolarHBondContact O-N 3.19Å; L180-Q183 WeakPolarHBondContact O-CB 3.39Å; L180-Q183 PolarHBondContact O-N 3.18Å; L180-Q183 VanDerWaalsContact O-N 3.13Å; L180-V184 WeakPolarHBondContact O-CG2 3.23Å; L180-V184 PolarHBondContact O-N 2.98Å; L180-V184 VanDerWaalsContact O-N 3.09Å
181	M	89.1	Confident	92.5	Very high	19 Å²	19	61.9 Å²	61.9	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-44.4	176.4	-179.4	-170.2	74.5	0	0	111.4	L142 L148 F159 N177 L178 Q183 V184 L185 L188 V190	L142-M181 HydrophobicContact CD2-CG 4.07Å; L142-M181 HydrophobicContact CD2-SD 3.36Å; L142-M181 WeakPolarHBondContact CD2-SD 3.38Å; L148-M181 HydrophobicContact CD1-SD 4.44Å; F159-M181 HydrophobicContact CE2-CE 4.47Å; N177-M181 WeakPolarHBondContact O-CB 3.41Å; N177-M181 PolarHBondContact O-N 2.99Å; L178-M181 HydrophobicContact CD2-CE 4.05Å; L178-M181 PolarHBondContact O-N 3.28Å; M181-Q183 VanDerWaalsContact C-N 3.3Å; M181-Q183 PolarHBondContact O-N 3.16Å; M181-V184 PolarHBondContact O-N 3.32Å; M181-L185 PolarHBondContact O-N 3.05Å; M181-L188 HydrophobicContact CE-CD1 4.18Å; M181-L188 HydrophobicContact SD-CD1 4.43Å; M181-V190 HydrophobicContact CE-CG1 4.28Å; M181-V190 HydrophobicContact CE-CG2 3.51Å
182	N	89.6	Confident	92.7	Very high	15 Å²	15	54.5 Å²	54.5	8%	0.08	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-31.1	179.3	-158.1	-87.9	0	0	0	112.1	I71 I72 L178 R179 L180 V184 L185 P186 L188 V190	I71-N182 HydrophobicContact CG2-CB 3.77Å; I72-N182 HydrophobicContact CD1-CB 4.22Å; I72-N182 HydrophobicContact CG1-CB 4.18Å; I72-N182 WeakPolarHBondContact CG1-OD1 3.43Å; L178-N182 WeakPolarHBondContact O-CB 3.4Å; L178-N182 PolarHBondContact O-N 3.45Å; R179-N182 PolarHBondContact O-N 3.2Å; L180-N182 VanDerWaalsContact C-N 3.29Å; L180-N182 PolarHBondContact O-N 3.19Å; N182-V184 VanDerWaalsContact C-N 3.35Å; N182-L185 CarbonylContact O-C 3.59Å; N182-L185 PolarHBondContact O-N 2.67Å; N182-P186 WeakPolarHBondContact O-CA 3.29Å; N182-P186 VanDerWaalsContact O-N 3.08Å; N182-L188 PolarHBondContact ND2-O 3.03Å; N182-V190 VanDerWaalsContact ND2-CG2 3.29Å; N182-V190 WeakPolarHBondContact ND2-CG2 2.97Å
183	Q	90.4	Very high	92.8	Very high	116 Å²	116	54.8 Å²	54.8	54%	0.542	27%	0.273	S	S	.	.	H	α-helix	trans	-65.5	-37.1	171.4	-70.5	170.9	-27	0	0	112.6	R179 L180 M181	R179-Q183 WeakPolarHBondContact O-CG 3.05Å; R179-Q183 PolarHBondContact O-N 3.45Å; R179-Q183 VanDerWaalsContact O-N 3.07Å; L180-Q183 WeakPolarHBondContact O-CB 3.39Å; L180-Q183 PolarHBondContact O-N 3.18Å; L180-Q183 VanDerWaalsContact O-N 3.13Å; M181-Q183 VanDerWaalsContact C-N 3.3Å; M181-Q183 PolarHBondContact O-N 3.16Å
184	V	88.4	Confident	92.8	Very high	104 Å²	104	50.4 Å²	50.4	63%	0.63	25%	0.252	S	S	*	.	H	α-helix	trans	-75.4	-36.3	177.3	177.4	0	0	0	0	111.5	L180 M181 N182 P186	L180-V184 WeakPolarHBondContact O-CG2 3.23Å; L180-V184 PolarHBondContact O-N 2.98Å; L180-V184 VanDerWaalsContact O-N 3.09Å; M181-V184 PolarHBondContact O-N 3.32Å; N182-V184 VanDerWaalsContact C-N 3.35Å; V184-P186 VanDerWaalsContact C-CD 3.45Å; V184-P186 WeakPolarHBondContact O-CD 3.26Å
185	L	87.8	Confident	92.8	Very high	48 Å²	48	56.4 Å²	56.4	25%	0.251	27%	0.274	S	S	.	.	S	Bend	trans	-122.1	71.4	-179.2	-59.9	175.4	0	0	0	109.8	L149 M181 N182 K187 L188	L149-L185 HydrophobicContact CD2-CD1 4.42Å; L149-L185 HydrophobicContact CD2-CD2 3.78Å; M181-L185 PolarHBondContact O-N 3.05Å; N182-L185 CarbonylContact O-C 3.59Å; N182-L185 PolarHBondContact O-N 2.67Å; L185-K187 PolarHBondContact O-N 3.17Å; L185-L188 HydrophobicContact CB-CD1 3.61Å; L185-L188 HydrophobicContact CB-CG 3.75Å; L185-L188 HydrophobicContact CD1-CD1 3.61Å; L185-L188 HydrophobicContact CD1-CG 4.4Å; L185-L188 HydrophobicContact CG-CD1 4.26Å; L185-L188 WeakPolarHBondContact O-CB 3.45Å; L185-L188 PolarHBondContact O-N 3.04Å
186	P	87	Confident	92.8	Very high	99 Å²	99	61.7 Å²	61.7	64%	0.643	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-14	-170.5	26.7	-36.3	0	0	0	114.2	N182 V184 L188	N182-P186 WeakPolarHBondContact O-CA 3.29Å; N182-P186 VanDerWaalsContact O-N 3.08Å; V184-P186 VanDerWaalsContact C-CD 3.45Å; V184-P186 WeakPolarHBondContact O-CD 3.26Å; P186-L188 VanDerWaalsContact C-N 3.34Å
187	K	86.3	Confident	92.9	Very high	140 Å²	140	59.8 Å²	59.8	61%	0.609	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-13.9	174.9	-61.8	-171.8	177.9	-176.1	0	113.1	Q153 L185 K189	Q153-K187 HydrophobicContact CG-CD 4.19Å; L185-K187 PolarHBondContact O-N 3.17Å; K187-K189 PolarHBondContact O-N 2.77Å
188	L	88.9	Confident	93	Very high	21 Å²	21	58.1 Å²	58.1	11%	0.11	28%	0.279	C	S	.	.	S	Bend	trans	-72.6	130.3	179.1	-66.7	-178.1	0	0	0	110.8	F157 M181 N182 L185 P186 V190	F157-L188 HydrophobicContact CD2-CD2 4.46Å; F157-L188 HydrophobicContact CE2-CD2 3.79Å; F157-L188 HydrophobicContact CZ-CD2 4.47Å; M181-L188 HydrophobicContact CE-CD1 4.18Å; M181-L188 HydrophobicContact SD-CD1 4.43Å; N182-L188 PolarHBondContact ND2-O 3.03Å; L185-L188 HydrophobicContact CB-CD1 3.61Å; L185-L188 HydrophobicContact CB-CG 3.75Å; L185-L188 HydrophobicContact CD1-CD1 3.61Å; L185-L188 HydrophobicContact CD1-CG 4.4Å; L185-L188 HydrophobicContact CG-CD1 4.26Å; L185-L188 WeakPolarHBondContact O-CB 3.45Å; L185-L188 PolarHBondContact O-N 3.04Å; P186-L188 VanDerWaalsContact C-N 3.34Å; L188-V190 HydrophobicContact CB-CG2 3.86Å; L188-V190 PolarHBondContact O-N 2.88Å
189	K	93.9	Very high	93.1	Very high	78 Å²	78	60.6 Å²	60.6	34%	0.339	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	91.4	173.3	-63.6	-178.8	-170.2	173.8	0	109.4	Q153 D154 V156 F157 K187 Y191	Q153-K189 WeakPolarHBondContact O-CE 3.35Å; D154-K189 IonicContact OD1-NZ 3.39Å; D154-K189 PolarHBondContact OD1-NZ 2.84Å; V156-K189 HydrophobicContact CG2-CB 4.28Å; V156-K189 HydrophobicContact CG2-CD 4.21Å; F157-K189 PolarHBondContact N-O 2.93Å; K187-K189 PolarHBondContact O-N 2.77Å; K189-Y191 HydrophobicContact CB-CE2 4.14Å
190	V	95.2	Very high	93.2	Very high	4 Å²	4	59.7 Å²	59.7	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.2	-175.2	-177.8	0	0	0	0	110.8	I71 F159 L178 M181 N182 L188	I71-V190 HydrophobicContact CB-CB 4.49Å; I71-V190 HydrophobicContact CB-CG1 4.28Å; I71-V190 HydrophobicContact CG2-CB 3.88Å; I71-V190 HydrophobicContact CG2-CG1 4.1Å; I71-V190 PolarHBondContact N-O 2.81Å; F159-V190 HydrophobicContact CD2-CG1 4Å; F159-V190 HydrophobicContact CE2-CG1 4.05Å; L178-V190 HydrophobicContact CB-CG1 4.42Å; L178-V190 HydrophobicContact CD2-CG1 4.37Å; M181-V190 HydrophobicContact CE-CG1 4.28Å; M181-V190 HydrophobicContact CE-CG2 3.51Å; N182-V190 VanDerWaalsContact ND2-CG2 3.29Å; N182-V190 WeakPolarHBondContact ND2-CG2 2.97Å; L188-V190 HydrophobicContact CB-CG2 3.86Å; L188-V190 PolarHBondContact O-N 2.88Å
191	Y	97.6	Very high	93.5	Very high	30 Å²	30	55.1 Å²	55.1	12%	0.118	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	154.8	179.8	-69	-98	0	0	0	110.8	I69 G70 L77 V156 F157 I158 F159 K189	I69-Y191 VanDerWaalsContact C-CD1 3.49Å; I69-Y191 CarbonylContact O-C 3.54Å; I69-Y191 WeakPolarHBondContact O-CA 3.3Å; G70-Y191 VanDerWaalsContact N-CD1 3.3Å; L77-Y191 HydrophobicContact CB-CD1 3.91Å; L77-Y191 HydrophobicContact CB-CE1 3.74Å; L77-Y191 HydrophobicContact CD1-CD2 4.28Å; L77-Y191 HydrophobicContact CD1-CE1 4.16Å; L77-Y191 HydrophobicContact CD1-CE2 3.77Å; V156-Y191 HydrophobicContact CG1-CD2 3.73Å; V156-Y191 HydrophobicContact CG1-CE2 4.05Å; F157-Y191 PolarHBondContact O-N 2.79Å; I158-Y191 WeakPolarHBondContact CA-O 3.43Å; F159-Y191 PolarHBondContact N-O 2.89Å; K189-Y191 HydrophobicContact CB-CE2 4.14Å
192	I	97.8	Very high	93.8	Very high	9 Å²	9	54.9 Å²	54.9	5%	0.046	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.8	170.9	63.3	170.2	0	0	0	110.4	Y68 I69 I71 F159 M166 Y175 L178	Y68-I192 WeakPolarHBondContact CA-O 3.5Å; I69-I192 HydrophobicContact CB-CG1 4.36Å; I69-I192 PolarHBondContact N-O 2.79Å; I69-I192 PolarHBondContact O-N 2.74Å; I71-I192 HydrophobicContact CD1-CG2 3.88Å; F159-I192 HydrophobicContact CB-CG2 4.45Å; F159-I192 WeakPolarHBondContact O-CA 3.46Å; M166-I192 HydrophobicContact CE-CB 3.66Å; M166-I192 HydrophobicContact CE-CG2 3.42Å; M166-I192 VanDerWaalsContact CE-CG2 3.42Å; Y175-I192 HydrophobicContact CD2-CD1 3.76Å; Y175-I192 HydrophobicContact CE2-CD1 3.72Å; L178-I192 HydrophobicContact CD1-CG2 3.96Å
193	I	98.1	Very high	94.2	Very high	6 Å²	6	59.2 Å²	59.2	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	125	169	-53.8	-169.5	0	0	0	108.5	Y68 I158 F159 W160 K197 M198 F201 F225 I229	Y68-I193 HydrophobicContact CD1-CG1 4.12Å; Y68-I193 HydrophobicContact CE1-CD1 4.28Å; Y68-I193 HydrophobicContact CE1-CG1 4.28Å; I158-I193 HydrophobicContact CG2-CD1 3.96Å; I158-I193 HydrophobicContact CG2-CG1 3.55Å; F159-I193 PolarHBondContact O-N 3.11Å; W160-I193 HydrophobicContact CB-CB 4.27Å; W160-I193 HydrophobicContact CB-CD1 3.6Å; W160-I193 HydrophobicContact CB-CG1 3.96Å; W160-I193 HydrophobicContact CG-CD1 4.46Å; I193-K197 HydrophobicContact CG2-CB 3.73Å; I193-K197 HydrophobicContact CG2-CG 3.69Å; I193-M198 HydrophobicContact CB-CG 4.41Å; I193-M198 HydrophobicContact CB-SD 4.21Å; I193-M198 HydrophobicContact CG2-CG 3.82Å; I193-M198 HydrophobicContact CG2-SD 3.82Å; I193-F201 HydrophobicContact CD1-CE2 3.78Å; I193-F201 HydrophobicContact CG2-CD2 4.22Å; I193-F201 HydrophobicContact CG2-CE2 3.72Å; I193-F225 HydrophobicContact CD1-CD1 4.19Å; I193-I229 HydrophobicContact CD1-CD1 4.29Å
194	S	96.2	Very high	94.6	Very high	12 Å²	12	55.9 Å²	55.9	8%	0.084	27%	0.274	C	S	.	.			trans	-66.1	158.3	178.8	79.4	0	0	0	0	111.6	G67 Q196 K197 M198	G67-S194 WeakPolarHBondContact O-CB 3.1Å; G67-S194 PolarHBondContact O-N 3.49Å; S194-Q196 VanDerWaalsContact C-N 3.27Å; S194-Q196 PolarHBondContact O-N 2.88Å; S194-K197 PolarHBondContact O-N 2.02Å; S194-K197 WeakPolarHBondContact OG-CB 3.43Å; S194-K197 PolarHBondContact OG-N 3.37Å; S194-K197 VanDerWaalsContact OG-N 3.1Å; S194-M198 WeakPolarHBondContact O-CG 3.37Å; S194-M198 PolarHBondContact O-N 3.06Å
195	W	95.4	Very high	95	Very high	131 Å²	131	51 Å²	51	50%	0.496	24%	0.244	S	C	.	.	H	α-helix	trans	-57.7	-42	175.4	168.8	-110	0	0	0	112.2	S163 K197 M198 L199	S163-W195 VanDerWaalsContact CB-CE3 3.5Å; W195-K197 PolarHBondContact O-N 3.35Å; W195-M198 WeakPolarHBondContact O-CB 3.32Å; W195-M198 PolarHBondContact O-N 3.31Å; W195-L199 HydrophobicContact CD2-CG 4.46Å; W195-L199 HydrophobicContact CH2-CD2 4.15Å; W195-L199 HydrophobicContact CZ2-CD1 4.12Å; W195-L199 HydrophobicContact CZ2-CD2 3.87Å; W195-L199 HydrophobicContact CZ2-CG 4.18Å; W195-L199 PolarHBondContact O-N 2.82Å
196	Q	96.1	Very high	95.5	Very high	123 Å²	123	52.8 Å²	52.8	58%	0.575	25%	0.25	S	C	*	.	H	α-helix	trans	-62.8	-43	178.3	-63.9	82.3	-6.1	0	0	111.1	S194 L199 Q200	S194-Q196 VanDerWaalsContact C-N 3.27Å; S194-Q196 PolarHBondContact O-N 2.88Å; Q196-L199 WeakPolarHBondContact O-CB 3.11Å; Q196-L199 PolarHBondContact O-N 2.84Å; Q196-Q200 WeakPolarHBondContact O-CG 2.91Å; Q196-Q200 PolarHBondContact O-N 3.49Å
197	K	97.4	Very high	96	Very high	16 Å²	16	55.3 Å²	55.3	7%	0.07	25%	0.25	C	S	.	.	H	α-helix	trans	-67.6	-36	177.5	-171.4	61.4	166.8	-175.7	0	112.2	Y68 I193 S194 W195 L199 Q200 F201 E232	Y68-K197 WeakPolarHBondContact OH-CE 3.37Å; I193-K197 HydrophobicContact CG2-CB 3.73Å; I193-K197 HydrophobicContact CG2-CG 3.69Å; S194-K197 PolarHBondContact O-N 2.02Å; S194-K197 WeakPolarHBondContact OG-CB 3.43Å; S194-K197 PolarHBondContact OG-N 3.37Å; S194-K197 VanDerWaalsContact OG-N 3.1Å; W195-K197 PolarHBondContact O-N 3.35Å; K197-L199 VanDerWaalsContact C-N 3.32Å; K197-L199 PolarHBondContact O-N 2.89Å; K197-Q200 WeakPolarHBondContact O-CB 3.47Å; K197-Q200 PolarHBondContact O-N 3.14Å; K197-F201 HydrophobicContact CD-CE1 4.47Å; K197-F201 HydrophobicContact CD-CE2 4.36Å; K197-F201 HydrophobicContact CD-CZ 4.14Å; K197-F201 HydrophobicContact CG-CD2 4.34Å; K197-F201 HydrophobicContact CG-CE2 3.73Å; K197-F201 HydrophobicContact CG-CZ 3.94Å; K197-F201 VanDerWaalsContact O-CD2 3.24Å; K197-F201 WeakPolarHBondContact O-CD2 3.47Å; K197-F201 WeakPolarHBondContact O-CG 3.48Å; K197-F201 PolarHBondContact O-N 2.77Å; K197-E232 WeakPolarHBondContact CE-OE1 3.48Å; K197-E232 IonicContact NZ-OE1 2.76Å; K197-E232 PolarHBondContact NZ-OE1 2.91Å; K197-E232 IonicContact NZ-OE2 3.94Å; K197-E232 PolarHBondContact NZ-OE2 3.26Å
198	M	97.1	Very high	96.6	Very high	18 Å²	18	51.4 Å²	51.4	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-40.6	170.5	-72.3	-65.5	-61.7	0	0	112.2	W160 I193 S194 W195 F201 D202 F225	W160-M198 HydrophobicContact CB-SD 4.22Å; W160-M198 HydrophobicContact CE3-CE 4.06Å; I193-M198 HydrophobicContact CB-CG 4.41Å; I193-M198 HydrophobicContact CB-SD 4.21Å; I193-M198 HydrophobicContact CG2-CG 3.82Å; I193-M198 HydrophobicContact CG2-SD 3.82Å; S194-M198 WeakPolarHBondContact O-CG 3.37Å; S194-M198 PolarHBondContact O-N 3.06Å; W195-M198 WeakPolarHBondContact O-CB 3.32Å; W195-M198 PolarHBondContact O-N 3.31Å; M198-F201 PolarHBondContact O-N 3.39Å; M198-F201 HydrophobicContact SD-CD2 4.5Å; M198-D202 PolarHBondContact O-N 2.65Å; M198-D202 VanDerWaalsContact O-N 3.09Å; M198-F225 HydrophobicContact CE-CE1 3.78Å; M198-F225 HydrophobicContact CE-CZ 3.59Å; M198-F225 HydrophobicContact SD-CD1 4.46Å; M198-F225 HydrophobicContact SD-CE1 3.58Å; M198-F225 VanDerWaalsContact SD-CE1 3.58Å; M198-F225 HydrophobicContact SD-CZ 3.99Å
199	L	95.9	Very high	96.9	Very high	52 Å²	52	51.9 Å²	51.9	27%	0.272	24%	0.238	S	C	.	.	H	α-helix	trans	-66.3	-39	174.7	-66.9	172.8	0	0	0	111.9	W195 Q196 K197 F201 D202 E203	W195-L199 HydrophobicContact CD2-CG 4.46Å; W195-L199 HydrophobicContact CH2-CD2 4.15Å; W195-L199 HydrophobicContact CZ2-CD1 4.12Å; W195-L199 HydrophobicContact CZ2-CD2 3.87Å; W195-L199 HydrophobicContact CZ2-CG 4.18Å; W195-L199 PolarHBondContact O-N 2.82Å; Q196-L199 WeakPolarHBondContact O-CB 3.11Å; Q196-L199 PolarHBondContact O-N 2.84Å; K197-L199 VanDerWaalsContact C-N 3.32Å; K197-L199 PolarHBondContact O-N 2.89Å; L199-F201 VanDerWaalsContact C-N 3.3Å; L199-F201 PolarHBondContact O-N 2.59Å; L199-D202 WeakPolarHBondContact O-CB 3.47Å; L199-D202 PolarHBondContact O-N 3.4Å; L199-E203 PolarHBondContact O-N 2.78Å
200	Q	97.4	Very high	97	Very high	113 Å²	113	51.6 Å²	51.6	53%	0.528	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-39	174.9	-69.9	172.7	-23.4	0	0	111.9	Q196 K197 E203 L204	Q196-Q200 WeakPolarHBondContact O-CG 2.91Å; Q196-Q200 PolarHBondContact O-N 3.49Å; K197-Q200 WeakPolarHBondContact O-CB 3.47Å; K197-Q200 PolarHBondContact O-N 3.14Å; Q200-E203 PolarHBondContact O-N 3.35Å; Q200-L204 WeakPolarHBondContact O-CB 3.48Å; Q200-L204 PolarHBondContact O-N 2.65Å
201	F	97.6	Very high	96.9	Very high	3 Å²	3	55.5 Å²	55.5	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-37.3	173.7	-65.8	-43.3	0	0	0	113.1	Y68 I193 K197 M198 L199 F205 L220 F225 T228 I229	Y68-F201 HydrophobicContact CE1-CZ 4.28Å; Y68-F201 WeakPolarHBondContact OH-CZ 3.38Å; I193-F201 HydrophobicContact CD1-CE2 3.78Å; I193-F201 HydrophobicContact CG2-CD2 4.22Å; I193-F201 HydrophobicContact CG2-CE2 3.72Å; K197-F201 HydrophobicContact CD-CE1 4.47Å; K197-F201 HydrophobicContact CD-CE2 4.36Å; K197-F201 HydrophobicContact CD-CZ 4.14Å; K197-F201 HydrophobicContact CG-CD2 4.34Å; K197-F201 HydrophobicContact CG-CE2 3.73Å; K197-F201 HydrophobicContact CG-CZ 3.94Å; K197-F201 VanDerWaalsContact O-CD2 3.24Å; K197-F201 WeakPolarHBondContact O-CD2 3.47Å; K197-F201 WeakPolarHBondContact O-CG 3.48Å; K197-F201 PolarHBondContact O-N 2.77Å; M198-F201 PolarHBondContact O-N 3.39Å; M198-F201 HydrophobicContact SD-CD2 4.5Å; L199-F201 VanDerWaalsContact C-N 3.3Å; L199-F201 PolarHBondContact O-N 2.59Å; F201-F205 WeakPolarHBondContact O-CB 3.35Å; F201-F205 PolarHBondContact O-N 2.54Å; F201-L220 HydrophobicContact CB-CD1 4.12Å; F201-F225 HydrophobicContact CB-CD1 4.44Å; F201-F225 HydrophobicContact CB-CE1 4.02Å; F201-F225 AromaticContact CD2-CD1 3.45Å; F201-F225 HydrophobicContact CD2-CD1 3.45Å; F201-F225 VanDerWaalsContact CD2-CD1 3.45Å; F201-F225 AromaticContact CD2-CE1 3.48Å; F201-F225 HydrophobicContact CD2-CE1 3.48Å; F201-F225 VanDerWaalsContact CD2-CE1 3.48Å; F201-F225 AromaticContact CE2-CD1 3.73Å; F201-F225 HydrophobicContact CE2-CD1 3.73Å; F201-F225 HydrophobicContact CE2-CE1 4.19Å; F201-F225 HydrophobicContact CG-CD1 4.03Å; F201-F225 HydrophobicContact CG-CE1 4.03Å; F201-T228 HydrophobicContact CD1-CG2 3.72Å; F201-T228 HydrophobicContact CE1-CG2 3.45Å; F201-T228 VanDerWaalsContact CE1-CG2 3.45Å; F201-I229 HydrophobicContact CZ-CG1 4.39Å
202	D	96.3	Very high	96.7	Very high	15 Å²	15	55.7 Å²	55.7	8%	0.08	28%	0.277	C	S	.	.	H	α-helix	trans	-61.9	-45.5	173.3	-80.7	-4.6	0	0	0	111	M198 L199 F205 K206 R213	M198-D202 PolarHBondContact O-N 2.65Å; M198-D202 VanDerWaalsContact O-N 3.09Å; L199-D202 WeakPolarHBondContact O-CB 3.47Å; L199-D202 PolarHBondContact O-N 3.4Å; D202-F205 PolarHBondContact O-N 2.84Å; D202-K206 PolarHBondContact O-N 3.47Å; D202-R213 WeakPolarHBondContact OD1-CD 3.34Å; D202-R213 IonicContact OD1-CZ 3.41Å; D202-R213 IonicContact OD1-NE 3.05Å; D202-R213 PolarHBondContact OD1-NE 2.89Å; D202-R213 IonicContact OD1-NH2 2.85Å; D202-R213 IonicContact OD2-CZ 3.86Å; D202-R213 IonicContact OD2-NE 3.95Å; D202-R213 PolarHBondContact OD2-NE 3.33Å; D202-R213 IonicContact OD2-NH2 2.8Å; D202-R213 PolarHBondContact OD2-NH2 2.97Å
203	E	97.6	Very high	96.4	Very high	106 Å²	106	57.1 Å²	57.1	50%	0.495	28%	0.281	S	S	.	.	H	α-helix	trans	-69	-39.4	178.9	-68.3	-51.8	135	0	0	112.6	L199 Q200 F205 K206 K207	L199-E203 PolarHBondContact O-N 2.78Å; Q200-E203 PolarHBondContact O-N 3.35Å; E203-F205 VanDerWaalsContact C-N 3.34Å; E203-F205 PolarHBondContact O-N 2.98Å; E203-K206 PolarHBondContact O-N 3.32Å; E203-K207 WeakPolarHBondContact O-CB 3.31Å; E203-K207 PolarHBondContact O-N 3.01Å
204	L	98.1	Very high	95.9	Very high	46 Å²	46	62 Å²	62	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-46.9	173	-178.1	65.5	0	0	0	110.4	Q200 K206 K207 E208 W224 T228 W296	Q200-L204 WeakPolarHBondContact O-CB 3.48Å; Q200-L204 PolarHBondContact O-N 2.65Å; L204-K206 VanDerWaalsContact C-N 3.28Å; L204-K206 PolarHBondContact O-N 2.58Å; L204-K207 PolarHBondContact O-N 2.93Å; L204-E208 HydrophobicContact CD1-CG 3.76Å; L204-E208 HydrophobicContact CG-CG 4.1Å; L204-E208 WeakPolarHBondContact O-CB 3.33Å; L204-E208 WeakPolarHBondContact O-CG 3.49Å; L204-E208 PolarHBondContact O-N 3.02Å; L204-W224 HydrophobicContact CB-CZ2 4.43Å; L204-W224 HydrophobicContact CD2-CZ2 4.24Å; L204-W224 HydrophobicContact CG-CZ2 4.04Å; L204-T228 HydrophobicContact CD2-CG2 3.44Å; L204-T228 VanDerWaalsContact CD2-CG2 3.44Å; L204-W296 HydrophobicContact CD2-CH2 4.38Å; L204-W296 HydrophobicContact CD2-CZ2 4.19Å; L204-W296 HydrophobicContact CG-CZ2 4.45Å
205	F	97.9	Very high	95.4	Very high	1 Å²	1	68.3 Å²	68.3	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-57.8	-44.3	177.2	178	-97	0	0	0	111.6	F201 D202 E203 E208 T209 K211 R213 L220 W224 R285 T288 E289	F201-F205 WeakPolarHBondContact O-CB 3.35Å; F201-F205 PolarHBondContact O-N 2.54Å; D202-F205 PolarHBondContact O-N 2.84Å; E203-F205 VanDerWaalsContact C-N 3.34Å; E203-F205 PolarHBondContact O-N 2.98Å; F205-E208 PolarHBondContact O-N 3.03Å; F205-T209 HydrophobicContact CD2-CG2 3.87Å; F205-T209 HydrophobicContact CE2-CG2 3.74Å; F205-T209 HydrophobicContact CG-CG2 4.42Å; F205-T209 HydrophobicContact CZ-CG2 4.19Å; F205-T209 VanDerWaalsContact O-CB 3.29Å; F205-T209 WeakPolarHBondContact O-CB 3.35Å; F205-T209 VanDerWaalsContact O-CG2 3.29Å; F205-T209 WeakPolarHBondContact O-CG2 3.22Å; F205-T209 PolarHBondContact O-N 3.18Å; F205-T209 PolarHBondContact O-OG1 3.41Å; F205-K211 WeakPolarHBondContact CD1-O 3.46Å; F205-K211 HydrophobicContact CE1-CB 3.89Å; F205-K211 VanDerWaalsContact CE1-O 3.27Å; F205-K211 WeakPolarHBondContact CE1-O 3.12Å; F205-K211 HydrophobicContact CZ-CB 4.39Å; F205-R213 HydrophobicContact CD1-CB 4.45Å; F205-L220 HydrophobicContact CB-CD1 4.42Å; F205-L220 HydrophobicContact CB-CD2 3.71Å; F205-L220 HydrophobicContact CD1-CD2 3.82Å; F205-L220 HydrophobicContact CD2-CD2 3.47Å; F205-L220 VanDerWaalsContact CD2-CD2 3.47Å; F205-L220 HydrophobicContact CE1-CD2 4.31Å; F205-L220 HydrophobicContact CE2-CD2 4Å; F205-L220 HydrophobicContact CG-CD2 3.37Å; F205-L220 HydrophobicContact CZ-CD2 4.39Å; F205-W224 HydrophobicContact CB-CH2 4.15Å; F205-W224 HydrophobicContact CB-CZ2 3.59Å; F205-W224 HydrophobicContact CD2-CD2 4.01Å; F205-W224 AromaticContact CD2-CE3 3.91Å; F205-W224 HydrophobicContact CD2-CE3 3.91Å; F205-W224 AromaticContact CD2-CH2 3.88Å; F205-W224 HydrophobicContact CD2-CH2 3.88Å; F205-W224 AromaticContact CD2-CZ2 4Å; F205-W224 HydrophobicContact CD2-CZ2 4Å; F205-W224 AromaticContact CD2-CZ3 3.81Å; F205-W224 HydrophobicContact CD2-CZ3 3.81Å; F205-W224 HydrophobicContact CE2-CZ3 4.49Å; F205-W224 HydrophobicContact CG-CH2 4.47Å; F205-W224 HydrophobicContact CG-CZ2 4.3Å; F205-R285 HydrophobicContact CZ-CB 4.1Å; F205-R285 HydrophobicContact CZ-CG 4.27Å; F205-T288 HydrophobicContact CE2-CG2 4.29Å; F205-T288 HydrophobicContact CZ-CG2 4.13Å; F205-E289 HydrophobicContact CD2-CG 4.38Å; F205-E289 HydrophobicContact CE2-CG 3.81Å
206	K	97.8	Very high	94.9	Very high	86 Å²	86	63.3 Å²	63.3	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-45	176.8	-176.3	177.4	-179.1	168.7	0	112.4	D202 E203 L204 G210 K211 D212	D202-K206 PolarHBondContact O-N 3.47Å; E203-K206 PolarHBondContact O-N 3.32Å; L204-K206 VanDerWaalsContact C-N 3.28Å; L204-K206 PolarHBondContact O-N 2.58Å; K206-G210 VanDerWaalsContact O-CA 3.23Å; K206-G210 WeakPolarHBondContact O-CA 3.4Å; K206-G210 PolarHBondContact O-N 2.81Å; K206-K211 VanDerWaalsContact CA-O 3.3Å; K206-K211 WeakPolarHBondContact CA-O 3.48Å; K206-D212 HydrophobicContact CD-CB 4.33Å; K206-D212 IonicContact NZ-OD2 3.15Å; K206-D212 PolarHBondContact NZ-OD2 3.12Å; K206-D212 VanDerWaalsContact NZ-OD2 3.15Å
207	K	97.8	Very high	94.5	Very high	152 Å²	152	61.5 Å²	61.5	66%	0.661	31%	0.313	S	S	*	.	H	α-helix	trans	-61.3	-46.3	178.1	-177.9	-175.3	174.3	-171.9	0	111.9	E203 L204	E203-K207 WeakPolarHBondContact O-CB 3.31Å; E203-K207 PolarHBondContact O-N 3.01Å; L204-K207 PolarHBondContact O-N 2.93Å
208	E	97.5	Very high	94.2	Very high	58 Å²	58	60.8 Å²	60.8	27%	0.271	31%	0.31	S	S	.	.	H	α-helix	trans	-78.9	-24.9	-173.2	-63.3	-64.3	138.9	0	0	113.3	L204 F205 W224 A292 W296	L204-E208 HydrophobicContact CD1-CG 3.76Å; L204-E208 HydrophobicContact CG-CG 4.1Å; L204-E208 WeakPolarHBondContact O-CB 3.33Å; L204-E208 WeakPolarHBondContact O-CG 3.49Å; L204-E208 PolarHBondContact O-N 3.02Å; F205-E208 PolarHBondContact O-N 3.03Å; E208-W224 HydrophobicContact CB-CH2 4.16Å; E208-W224 HydrophobicContact CG-CH2 4.43Å; E208-A292 HydrophobicContact CB-CB 4.14Å; E208-W296 HydrophobicContact CG-CZ2 3.99Å; E208-W296 PolarHBondContact OE2-NE1 2.64Å
209	T	96.1	Very high	94.1	Very high	31 Å²	31	63.8 Å²	63.8	19%	0.19	32%	0.321	C	S	.	.	H	α-helix	trans	-118.3	-12.5	-171.5	73.9	0	0	0	0	114.4	F205 K211 T288 A292	F205-T209 HydrophobicContact CD2-CG2 3.87Å; F205-T209 HydrophobicContact CE2-CG2 3.74Å; F205-T209 HydrophobicContact CG-CG2 4.42Å; F205-T209 HydrophobicContact CZ-CG2 4.19Å; F205-T209 VanDerWaalsContact O-CB 3.29Å; F205-T209 WeakPolarHBondContact O-CB 3.35Å; F205-T209 VanDerWaalsContact O-CG2 3.29Å; F205-T209 WeakPolarHBondContact O-CG2 3.22Å; F205-T209 PolarHBondContact O-N 3.18Å; F205-T209 PolarHBondContact O-OG1 3.41Å; T209-K211 PolarHBondContact O-N 3.49Å; T209-K211 PolarHBondContact OG1-N 2.88Å; T209-K211 VanDerWaalsContact OG1-N 3.14Å; T209-T288 VanDerWaalsContact CB-CG2 3.5Å; T209-T288 HydrophobicContact CG2-CG2 3.56Å; T209-A292 HydrophobicContact CG2-CB 4.28Å
210	G	96.1	Very high	94.1	Very high	71 Å²	71	61.3 Å²	61.3	73%	0.732	31%	0.308	S	S	*	.	S	Bend	trans	67.1	6.3	-170.1	0	0	0	0	0	114.1	K206	K206-G210 VanDerWaalsContact O-CA 3.23Å; K206-G210 WeakPolarHBondContact O-CA 3.4Å; K206-G210 PolarHBondContact O-N 2.81Å
211	K	93.4	Very high	94.1	Very high	86 Å²	86	56.3 Å²	56.3	37%	0.374	29%	0.285	S	S	.	.			trans	-109.6	130.8	-178.6	-67.9	177.9	-174	-80.2	0	111	F205 K206 T209 T288	F205-K211 WeakPolarHBondContact CD1-O 3.46Å; F205-K211 HydrophobicContact CE1-CB 3.89Å; F205-K211 VanDerWaalsContact CE1-O 3.27Å; F205-K211 WeakPolarHBondContact CE1-O 3.12Å; F205-K211 HydrophobicContact CZ-CB 4.39Å; K206-K211 VanDerWaalsContact CA-O 3.3Å; K206-K211 WeakPolarHBondContact CA-O 3.48Å; T209-K211 PolarHBondContact O-N 3.49Å; T209-K211 PolarHBondContact OG1-N 2.88Å; T209-K211 VanDerWaalsContact OG1-N 3.14Å; K211-T288 HydrophobicContact CD-CG2 3.92Å
212	D	92.9	Very high	94.1	Very high	35 Å²	35	56.9 Å²	56.9	19%	0.187	29%	0.289	C	S	.	.			trans	-87.2	123.7	172.1	-172.7	-59.8	0	0	0	110.2	K206 K214 I215 S216	K206-D212 HydrophobicContact CD-CB 4.33Å; K206-D212 IonicContact NZ-OD2 3.15Å; K206-D212 PolarHBondContact NZ-OD2 3.12Å; K206-D212 VanDerWaalsContact NZ-OD2 3.15Å; D212-K214 VanDerWaalsContact C-N 3.35Å; D212-K214 PolarHBondContact O-N 2.93Å; D212-K214 WeakPolarHBondContact OD1-CA 3.4Å; D212-K214 WeakPolarHBondContact OD1-CB 3.4Å; D212-K214 PolarHBondContact OD1-N 3.19Å; D212-I215 HydrophobicContact CB-CB 3.94Å; D212-I215 HydrophobicContact CB-CD1 3.74Å; D212-I215 HydrophobicContact CB-CG1 3.88Å; D212-I215 PolarHBondContact OD1-N 3.35Å; D212-S216 WeakPolarHBondContact O-CB 3.36Å; D212-S216 PolarHBondContact O-N 3.42Å; D212-S216 PolarHBondContact O-OG 3.1Å
213	R	91.2	Very high	94.2	Very high	38 Å²	38	56.7 Å²	56.7	14%	0.143	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-44.7	-179.4	-177.5	-163.8	66	72	-2.8	112.1	D202 F205 S216 N217 S218 L220	D202-R213 WeakPolarHBondContact OD1-CD 3.34Å; D202-R213 IonicContact OD1-CZ 3.41Å; D202-R213 IonicContact OD1-NE 3.05Å; D202-R213 PolarHBondContact OD1-NE 2.89Å; D202-R213 IonicContact OD1-NH2 2.85Å; D202-R213 IonicContact OD2-CZ 3.86Å; D202-R213 IonicContact OD2-NE 3.95Å; D202-R213 PolarHBondContact OD2-NE 3.33Å; D202-R213 IonicContact OD2-NH2 2.8Å; D202-R213 PolarHBondContact OD2-NH2 2.97Å; F205-R213 HydrophobicContact CD1-CB 4.45Å; R213-S216 PolarHBondContact O-N 3.32Å; R213-S216 PolarHBondContact O-OG 3.33Å; R213-N217 PolarHBondContact O-N 2.94Å; R213-S218 WeakPolarHBondContact CG-O 3.39Å; R213-S218 PolarHBondContact NH1-O 2.88Å; R213-S218 PolarHBondContact O-N 2.92Å; R213-S218 VanDerWaalsContact O-N 3.07Å; R213-S218 PolarHBondContact O-OG 2.7Å; R213-L220 HydrophobicContact CB-CD2 4.48Å; R213-L220 HydrophobicContact CG-CD2 4.34Å; R213-L220 HydrophobicContact CG-CG 4.48Å
214	K	87.3	Confident	94.3	Very high	109 Å²	109	51.6 Å²	51.6	47%	0.474	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-46.3	-176	-66.2	175.1	-175.4	167.4	0	110.2	D212 S216 N217	D212-K214 VanDerWaalsContact C-N 3.35Å; D212-K214 PolarHBondContact O-N 2.93Å; D212-K214 WeakPolarHBondContact OD1-CA 3.4Å; D212-K214 WeakPolarHBondContact OD1-CB 3.4Å; D212-K214 PolarHBondContact OD1-N 3.19Å; K214-S216 VanDerWaalsContact C-N 3.29Å; K214-S216 PolarHBondContact O-N 3.49Å; K214-N217 PolarHBondContact O-N 3.2Å; K214-N217 VanDerWaalsContact O-N 3.13Å
215	I	86.9	Confident	94.3	Very high	145 Å²	145	49.5 Å²	49.5	74%	0.744	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-39.8	178	-60	176.8	0	0	0	110.5	D212 N217	D212-I215 HydrophobicContact CB-CB 3.94Å; D212-I215 HydrophobicContact CB-CD1 3.74Å; D212-I215 HydrophobicContact CB-CG1 3.88Å; D212-I215 PolarHBondContact OD1-N 3.35Å; I215-N217 PolarHBondContact O-N 3.5Å
216	S	84.1	Confident	94.3	Very high	26 Å²	26	49.5 Å²	49.5	18%	0.182	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	3.6	178.9	67.4	0	0	0	0	114.6	D212 R213 K214 S218 R285	D212-S216 WeakPolarHBondContact O-CB 3.36Å; D212-S216 PolarHBondContact O-N 3.42Å; D212-S216 PolarHBondContact O-OG 3.1Å; R213-S216 PolarHBondContact O-N 3.32Å; R213-S216 PolarHBondContact O-OG 3.33Å; K214-S216 VanDerWaalsContact C-N 3.29Å; K214-S216 PolarHBondContact O-N 3.49Å; S216-S218 PolarHBondContact O-N 2.88Å; S216-S218 VanDerWaalsContact O-N 3.14Å; S216-S218 PolarHBondContact OG-OG 3.08Å; S216-R285 PolarHBondContact O-NH2 3.09Å
217	N	88.6	Confident	94.4	Very high	85 Å²	85	45.4 Å²	45.4	46%	0.455	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	40.8	-176.9	-165.4	24.4	0	0	0	113.5	R213 K214 I215 G281	R213-N217 PolarHBondContact O-N 2.94Å; K214-N217 PolarHBondContact O-N 3.2Å; K214-N217 VanDerWaalsContact O-N 3.13Å; I215-N217 PolarHBondContact O-N 3.5Å; N217-G281 PolarHBondContact ND2-N 3.41Å
218	S	91.3	Very high	94.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	21%	0.208	C	C	.	.			trans	-110.8	172	-177.5	63.8	0	0	0	0	112	R213 S216	R213-S218 WeakPolarHBondContact CG-O 3.39Å; R213-S218 PolarHBondContact NH1-O 2.88Å; R213-S218 PolarHBondContact O-N 2.92Å; R213-S218 VanDerWaalsContact O-N 3.07Å; R213-S218 PolarHBondContact O-OG 2.7Å; S216-S218 PolarHBondContact O-N 2.88Å; S216-S218 VanDerWaalsContact O-N 3.14Å; S216-S218 PolarHBondContact OG-OG 3.08Å
219	W	93.7	Very high	94.5	Very high	80 Å²	80	35.6 Å²	35.6	30%	0.303	20%	0.195	S	C	.	.			trans	-118.7	141.7	168.8	-72.5	90.3	0	0	0	110	W160 P162 H283 H284	W160-W219 HydrophobicContact CZ3-CE3 4.34Å; P162-W219 HydrophobicContact CB-CH2 4.03Å; P162-W219 HydrophobicContact CG-CH2 3.64Å; P162-W219 HydrophobicContact CG-CZ2 4.39Å; P162-W219 HydrophobicContact CG-CZ3 4.16Å; W219-H283 PolarHBondContact N-O 3.27Å; W219-H284 WeakPolarHBondContact O-CA 3.46Å; W219-H284 PolarHBondContact O-ND1 3.48Å
220	L	96.2	Very high	94.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.186	C	C	.	.			trans	-65.1	140.4	166	-51.8	177.8	0	0	0	108.4	W160 F201 F205 R213 W224 F225	W160-L220 WeakPolarHBondContact CH2-O 3.32Å; F201-L220 HydrophobicContact CB-CD1 4.12Å; F205-L220 HydrophobicContact CB-CD1 4.42Å; F205-L220 HydrophobicContact CB-CD2 3.71Å; F205-L220 HydrophobicContact CD1-CD2 3.82Å; F205-L220 HydrophobicContact CD2-CD2 3.47Å; F205-L220 VanDerWaalsContact CD2-CD2 3.47Å; F205-L220 HydrophobicContact CE1-CD2 4.31Å; F205-L220 HydrophobicContact CE2-CD2 4Å; F205-L220 HydrophobicContact CG-CD2 3.37Å; F205-L220 HydrophobicContact CZ-CD2 4.39Å; R213-L220 HydrophobicContact CB-CD2 4.48Å; R213-L220 HydrophobicContact CG-CD2 4.34Å; R213-L220 HydrophobicContact CG-CG 4.48Å; L220-W224 HydrophobicContact CB-CB 4.13Å; L220-W224 HydrophobicContact CB-CG 4.13Å; L220-W224 HydrophobicContact CD1-CG 4.38Å; L220-W224 HydrophobicContact CD2-CG 4.46Å; L220-F225 HydrophobicContact CB-CD2 4.44Å; L220-F225 HydrophobicContact CB-CE2 3.66Å; L220-F225 HydrophobicContact CB-CZ 3.85Å; L220-F225 HydrophobicContact CD1-CE1 4.34Å; L220-F225 HydrophobicContact CD1-CZ 4.02Å; L220-F225 HydrophobicContact CG-CZ 4.42Å
221	S	97.6	Very high	94.7	Very high	8 Å²	8	32.9 Å²	32.9	6%	0.056	16%	0.162	C	C	.	.			trans	-74.3	160.3	176.6	82	0	0	0	0	111.7	G223 W224 F225 E289	S221-G223 PolarHBondContact O-N 3.31Å; S221-G223 WeakPolarHBondContact OG-CA 3.42Å; S221-G223 PolarHBondContact OG-N 3.14Å; S221-W224 WeakPolarHBondContact O-CB 3.43Å; S221-W224 PolarHBondContact O-N 3.47Å; S221-W224 PolarHBondContact OG-N 3.34Å; S221-F225 WeakPolarHBondContact O-CD2 3.48Å; S221-F225 PolarHBondContact O-N 3.28Å; S221-E289 WeakPolarHBondContact CB-OE2 3.08Å; S221-E289 PolarHBondContact N-OE1 3.29Å; S221-E289 PolarHBondContact OG-OE2 3.13Å
222	T	98.3	Very high	94.8	Very high	14 Å²	14	32 Å²	32	9%	0.086	16%	0.159	C	C	.	.	H	α-helix	trans	-56	-29.9	166.3	-55.7	0	0	0	0	111.2	M111 N112 V132 W160 F225 T226	M111-T222 HydrophobicContact CB-CG2 3.85Å; M111-T222 HydrophobicContact CG-CG2 3.94Å; M111-T222 HydrophobicContact SD-CG2 4.12Å; N112-T222 PolarHBondContact ND2-OG1 3.19Å; N112-T222 PolarHBondContact OD1-OG1 2.7Å; V132-T222 HydrophobicContact CB-CG2 4.31Å; V132-T222 HydrophobicContact CG1-CG2 4.06Å; V132-T222 WeakPolarHBondContact O-CG2 3.17Å; W160-T222 PolarHBondContact NE1-OG1 3.2Å; T222-F225 PolarHBondContact O-N 3.16Å; T222-T226 WeakPolarHBondContact O-CB 3.44Å; T222-T226 PolarHBondContact O-N 3.37Å; T222-T226 PolarHBondContact O-OG1 3.39Å
223	G	98.3	Very high	95	Very high	11 Å²	11	30.4 Å²	30.4	11%	0.113	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-43.7	174.3	0	0	0	0	0	112.6	S221 T226 M227	S221-G223 PolarHBondContact O-N 3.31Å; S221-G223 WeakPolarHBondContact OG-CA 3.42Å; S221-G223 PolarHBondContact OG-N 3.14Å; G223-T226 PolarHBondContact O-N 3.19Å; G223-M227 WeakPolarHBondContact O-CB 3.25Å; G223-M227 WeakPolarHBondContact O-CG 3.23Å; G223-M227 PolarHBondContact O-N 3.4Å
224	W	98.6	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.5	-51.6	174.1	-178.5	-91.8	0	0	0	112.6	L204 F205 E208 L220 S221 T226 M227 T228 E289 A292 F293 W296	L204-W224 HydrophobicContact CB-CZ2 4.43Å; L204-W224 HydrophobicContact CD2-CZ2 4.24Å; L204-W224 HydrophobicContact CG-CZ2 4.04Å; F205-W224 HydrophobicContact CB-CH2 4.15Å; F205-W224 HydrophobicContact CB-CZ2 3.59Å; F205-W224 HydrophobicContact CD2-CD2 4.01Å; F205-W224 AromaticContact CD2-CE3 3.91Å; F205-W224 HydrophobicContact CD2-CE3 3.91Å; F205-W224 AromaticContact CD2-CH2 3.88Å; F205-W224 HydrophobicContact CD2-CH2 3.88Å; F205-W224 AromaticContact CD2-CZ2 4Å; F205-W224 HydrophobicContact CD2-CZ2 4Å; F205-W224 AromaticContact CD2-CZ3 3.81Å; F205-W224 HydrophobicContact CD2-CZ3 3.81Å; F205-W224 HydrophobicContact CE2-CZ3 4.49Å; F205-W224 HydrophobicContact CG-CH2 4.47Å; F205-W224 HydrophobicContact CG-CZ2 4.3Å; E208-W224 HydrophobicContact CB-CH2 4.16Å; E208-W224 HydrophobicContact CG-CH2 4.43Å; L220-W224 HydrophobicContact CB-CB 4.13Å; L220-W224 HydrophobicContact CB-CG 4.13Å; L220-W224 HydrophobicContact CD1-CG 4.38Å; L220-W224 HydrophobicContact CD2-CG 4.46Å; S221-W224 WeakPolarHBondContact O-CB 3.43Å; S221-W224 PolarHBondContact O-N 3.47Å; S221-W224 PolarHBondContact OG-N 3.34Å; W224-T226 VanDerWaalsContact C-N 3.3Å; W224-T226 PolarHBondContact O-N 3.41Å; W224-M227 PolarHBondContact O-N 3.03Å; W224-T228 WeakPolarHBondContact O-CB 3.35Å; W224-T228 PolarHBondContact O-N 2.89Å; W224-T228 PolarHBondContact O-OG1 3.46Å; W224-E289 HydrophobicContact CB-CG 4.39Å; W224-E289 HydrophobicContact CD2-CG 4.43Å; W224-E289 HydrophobicContact CE3-CB 3.96Å; W224-E289 HydrophobicContact CE3-CG 3.7Å; W224-E289 HydrophobicContact CZ3-CG 4.41Å; W224-A292 HydrophobicContact CH2-CB 4.13Å; W224-A292 HydrophobicContact CZ3-CB 3.72Å; W224-F293 HydrophobicContact CD2-CE1 4.45Å; W224-F293 AromaticContact CE3-CE1 3.59Å; W224-F293 HydrophobicContact CE3-CE1 3.59Å; W224-F293 AromaticContact CE3-CZ 3.99Å; W224-F293 HydrophobicContact CE3-CZ 3.99Å; W224-F293 AromaticContact CZ3-CE1 3.96Å; W224-F293 HydrophobicContact CZ3-CE1 3.96Å; W224-W296 HydrophobicContact CE3-CH2 4.39Å; W224-W296 AromaticContact CH2-CH2 3.71Å; W224-W296 HydrophobicContact CH2-CH2 3.71Å; W224-W296 AromaticContact CH2-CZ2 3.68Å; W224-W296 HydrophobicContact CH2-CZ2 3.68Å; W224-W296 HydrophobicContact CZ2-CH2 4Å; W224-W296 HydrophobicContact CZ2-CZ2 4.15Å; W224-W296 AromaticContact CZ3-CH2 3.93Å; W224-W296 HydrophobicContact CZ3-CH2 3.93Å; W224-W296 HydrophobicContact CZ3-CZ2 4.2Å
225	F	98.7	Very high	95.9	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.009	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-44.5	177.5	-66.9	-74	0	0	0	111.2	V132 W160 I193 M198 F201 L220 S221 T222 T228 I229	V132-F225 HydrophobicContact CG1-CB 4.29Å; W160-F225 AromaticContact CD2-CD2 3.61Å; W160-F225 HydrophobicContact CD2-CD2 3.61Å; W160-F225 AromaticContact CD2-CE2 3.47Å; W160-F225 HydrophobicContact CD2-CE2 3.47Å; W160-F225 VanDerWaalsContact CD2-CE2 3.47Å; W160-F225 HydrophobicContact CD2-CG 4.26Å; W160-F225 AromaticContact CD2-CZ 4Å; W160-F225 HydrophobicContact CD2-CZ 4Å; W160-F225 AromaticContact CE2-CD2 3.4Å; W160-F225 VanDerWaalsContact CE2-CD2 3.4Å; W160-F225 AromaticContact CE2-CE2 3.55Å; W160-F225 HydrophobicContact CE3-CD2 4.03Å; W160-F225 HydrophobicContact CE3-CE1 4.47Å; W160-F225 AromaticContact CE3-CE2 3.38Å; W160-F225 HydrophobicContact CE3-CE2 3.38Å; W160-F225 AromaticContact CE3-CZ 3.64Å; W160-F225 HydrophobicContact CE3-CZ 3.64Å; W160-F225 HydrophobicContact CG-CD2 4.07Å; W160-F225 HydrophobicContact CG-CE2 4.28Å; W160-F225 HydrophobicContact CG-CG 4.27Å; W160-F225 HydrophobicContact CH2-CD2 4.1Å; W160-F225 AromaticContact CH2-CE2 3.49Å; W160-F225 HydrophobicContact CH2-CE2 3.49Å; W160-F225 VanDerWaalsContact CH2-CE2 3.49Å; W160-F225 HydrophobicContact CH2-CZ 4.4Å; W160-F225 AromaticContact CZ2-CD2 3.67Å; W160-F225 HydrophobicContact CZ2-CD2 3.67Å; W160-F225 AromaticContact CZ2-CE2 3.57Å; W160-F225 HydrophobicContact CZ2-CE2 3.57Å; W160-F225 HydrophobicContact CZ3-CD2 4.27Å; W160-F225 AromaticContact CZ3-CE2 3.4Å; W160-F225 HydrophobicContact CZ3-CE2 3.4Å; W160-F225 AromaticContact CZ3-CZ 3.87Å; W160-F225 HydrophobicContact CZ3-CZ 3.87Å; W160-F225 AromaticContact NE1-CD2 3.73Å; I193-F225 HydrophobicContact CD1-CD1 4.19Å; M198-F225 HydrophobicContact CE-CE1 3.78Å; M198-F225 HydrophobicContact CE-CZ 3.59Å; M198-F225 HydrophobicContact SD-CD1 4.46Å; M198-F225 HydrophobicContact SD-CE1 3.58Å; M198-F225 VanDerWaalsContact SD-CE1 3.58Å; M198-F225 HydrophobicContact SD-CZ 3.99Å; F201-F225 HydrophobicContact CB-CD1 4.44Å; F201-F225 HydrophobicContact CB-CE1 4.02Å; F201-F225 AromaticContact CD2-CD1 3.45Å; F201-F225 HydrophobicContact CD2-CD1 3.45Å; F201-F225 VanDerWaalsContact CD2-CD1 3.45Å; F201-F225 AromaticContact CD2-CE1 3.48Å; F201-F225 HydrophobicContact CD2-CE1 3.48Å; F201-F225 VanDerWaalsContact CD2-CE1 3.48Å; F201-F225 AromaticContact CE2-CD1 3.73Å; F201-F225 HydrophobicContact CE2-CD1 3.73Å; F201-F225 HydrophobicContact CE2-CE1 4.19Å; F201-F225 HydrophobicContact CG-CD1 4.03Å; F201-F225 HydrophobicContact CG-CE1 4.03Å; L220-F225 HydrophobicContact CB-CD2 4.44Å; L220-F225 HydrophobicContact CB-CE2 3.66Å; L220-F225 HydrophobicContact CB-CZ 3.85Å; L220-F225 HydrophobicContact CD1-CE1 4.34Å; L220-F225 HydrophobicContact CD1-CZ 4.02Å; L220-F225 HydrophobicContact CG-CZ 4.42Å; S221-F225 WeakPolarHBondContact O-CD2 3.48Å; S221-F225 PolarHBondContact O-N 3.28Å; T222-F225 PolarHBondContact O-N 3.16Å; F225-T228 PolarHBondContact O-N 2.78Å; F225-I229 WeakPolarHBondContact O-CB 3.37Å; F225-I229 VanDerWaalsContact O-CD1 3.31Å; F225-I229 WeakPolarHBondContact O-CD1 3.5Å; F225-I229 WeakPolarHBondContact O-CG1 3.41Å; F225-I229 PolarHBondContact O-N 2.9Å
226	T	98.8	Very high	96.4	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-68.5	-42.7	-176.2	-49.7	0	0	0	0	112.1	L86 I109 M111 V132 T222 G223 W224 T228 I229 A230	L86-T226 HydrophobicContact CD1-CG2 3.64Å; L86-T226 HydrophobicContact CG-CG2 3.96Å; I109-T226 HydrophobicContact CG2-CG2 3.41Å; I109-T226 VanDerWaalsContact CG2-CG2 3.41Å; M111-T226 HydrophobicContact CE-CG2 3.91Å; M111-T226 HydrophobicContact CG-CG2 4.28Å; V132-T226 HydrophobicContact CB-CG2 4.49Å; V132-T226 WeakPolarHBondContact CB-OG1 3.31Å; V132-T226 HydrophobicContact CG2-CG2 4.03Å; T222-T226 WeakPolarHBondContact O-CB 3.44Å; T222-T226 PolarHBondContact O-N 3.37Å; T222-T226 PolarHBondContact O-OG1 3.39Å; G223-T226 PolarHBondContact O-N 3.19Å; W224-T226 VanDerWaalsContact C-N 3.3Å; W224-T226 PolarHBondContact O-N 3.41Å; T226-T228 VanDerWaalsContact C-N 3.34Å; T226-I229 PolarHBondContact O-N 2.88Å; T226-A230 WeakPolarHBondContact O-CB 3.38Å; T226-A230 PolarHBondContact O-N 2.78Å
227	M	98.8	Very high	97.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-41.9	175.4	-75.2	-62.9	-60.5	0	0	111.4	L86 G223 W224 A230 L231 V239 M242 F293 W296 I302	L86-M227 HydrophobicContact CD1-CG 4.39Å; L86-M227 HydrophobicContact CD1-SD 3.63Å; L86-M227 HydrophobicContact CD2-SD 4.29Å; G223-M227 WeakPolarHBondContact O-CB 3.25Å; G223-M227 WeakPolarHBondContact O-CG 3.23Å; G223-M227 PolarHBondContact O-N 3.4Å; W224-M227 PolarHBondContact O-N 3.03Å; M227-A230 PolarHBondContact O-N 3.49Å; M227-L231 PolarHBondContact O-N 3.41Å; M227-L231 VanDerWaalsContact O-N 3.08Å; M227-V239 HydrophobicContact CE-CG2 4.12Å; M227-V239 HydrophobicContact SD-CG2 3.82Å; M227-M242 HydrophobicContact SD-CE 4.48Å; M227-F293 HydrophobicContact CB-CD1 4.08Å; M227-F293 HydrophobicContact CB-CE1 3.73Å; M227-F293 HydrophobicContact CB-CZ 4.05Å; M227-F293 HydrophobicContact CE-CB 4.39Å; M227-F293 HydrophobicContact CE-CD1 4.49Å; M227-F293 HydrophobicContact CE-CG 4.34Å; M227-F293 HydrophobicContact CG-CD1 4.06Å; M227-F293 HydrophobicContact CG-CD2 4.11Å; M227-F293 HydrophobicContact CG-CE1 3.85Å; M227-F293 HydrophobicContact CG-CE2 3.91Å; M227-F293 HydrophobicContact CG-CG 4.19Å; M227-F293 HydrophobicContact CG-CZ 3.78Å; M227-W296 HydrophobicContact CB-CZ3 3.98Å; M227-I302 HydrophobicContact CE-CD1 4.17Å; M227-I302 HydrophobicContact CE-CG2 4.28Å
228	T	98.4	Very high	97.6	Very high	5 Å²	5	21.5 Å²	21.5	3%	0.031	10%	0.104	C	C	.	.	H	α-helix	trans	-67.5	-40.9	178.5	-46.3	0	0	0	0	111.6	F201 L204 W224 F225 T226 A230 L231 E232	F201-T228 HydrophobicContact CD1-CG2 3.72Å; F201-T228 HydrophobicContact CE1-CG2 3.45Å; F201-T228 VanDerWaalsContact CE1-CG2 3.45Å; L204-T228 HydrophobicContact CD2-CG2 3.44Å; L204-T228 VanDerWaalsContact CD2-CG2 3.44Å; W224-T228 WeakPolarHBondContact O-CB 3.35Å; W224-T228 PolarHBondContact O-N 2.89Å; W224-T228 PolarHBondContact O-OG1 3.46Å; F225-T228 PolarHBondContact O-N 2.78Å; T226-T228 VanDerWaalsContact C-N 3.34Å; T228-A230 VanDerWaalsContact C-N 3.31Å; T228-A230 PolarHBondContact O-N 2.94Å; T228-L231 PolarHBondContact O-N 2.64Å; T228-E232 PolarHBondContact O-N 3.44Å
229	I	98.6	Very high	98	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.5	-41.1	173.5	-69.4	161.1	0	0	0	110.8	Y68 L130 V132 I158 I193 F201 F225 T226 L231 E232 L233	Y68-I229 HydrophobicContact CE1-CD1 3.94Å; Y68-I229 HydrophobicContact CE1-CG1 3.62Å; Y68-I229 WeakPolarHBondContact OH-CG1 3.46Å; L130-I229 HydrophobicContact CD2-CG2 3.87Å; V132-I229 HydrophobicContact CG1-CD1 4.02Å; V132-I229 HydrophobicContact CG2-CD1 3.84Å; I158-I229 HydrophobicContact CD1-CD1 4.4Å; I158-I229 HydrophobicContact CD1-CG2 4.48Å; I193-I229 HydrophobicContact CD1-CD1 4.29Å; F201-I229 HydrophobicContact CZ-CG1 4.39Å; F225-I229 WeakPolarHBondContact O-CB 3.37Å; F225-I229 VanDerWaalsContact O-CD1 3.31Å; F225-I229 WeakPolarHBondContact O-CD1 3.5Å; F225-I229 WeakPolarHBondContact O-CG1 3.41Å; F225-I229 PolarHBondContact O-N 2.9Å; T226-I229 PolarHBondContact O-N 2.88Å; I229-L231 VanDerWaalsContact C-N 3.34Å; I229-L231 PolarHBondContact O-N 2.05Å; I229-E232 PolarHBondContact O-N 2.9Å; I229-E232 VanDerWaalsContact O-N 3.14Å; I229-L233 VanDerWaalsContact O-CB 3.3Å; I229-L233 WeakPolarHBondContact O-CB 3.2Å; I229-L233 PolarHBondContact O-N 2.52Å
230	A	98.6	Very high	98.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.9	-38	179.2	0	0	0	0	0	112.1	L86 I109 T226 M227 T228 E232 L233 C234 I237	L86-A230 HydrophobicContact CD1-CB 3.98Å; I109-A230 HydrophobicContact CD1-CB 4.01Å; T226-A230 WeakPolarHBondContact O-CB 3.38Å; T226-A230 PolarHBondContact O-N 2.78Å; M227-A230 PolarHBondContact O-N 3.49Å; T228-A230 VanDerWaalsContact C-N 3.31Å; T228-A230 PolarHBondContact O-N 2.94Å; A230-E232 PolarHBondContact O-N 3.3Å; A230-L233 PolarHBondContact O-N 2.9Å; A230-L233 VanDerWaalsContact O-N 3.16Å; A230-C234 VanDerWaalsContact O-CB 3.23Å; A230-C234 WeakPolarHBondContact O-CB 3.5Å; A230-C234 PolarHBondContact O-N 3.31Å; A230-C234 PolarHBondContact O-SG 3.45Å; A230-C234 VanDerWaalsContact O-SG 3.37Å; A230-I237 HydrophobicContact CB-CD1 3.71Å; A230-I237 HydrophobicContact CB-CG1 4.27Å; A230-I237 HydrophobicContact CB-CG2 4.36Å
231	L	98.1	Very high	98.3	Very high	45 Å²	45	17.7 Å²	17.7	24%	0.236	9%	0.09	C	C	.	.	H	α-helix	trans	-61.9	-28.4	173.5	-74.4	175.4	0	0	0	113.6	M227 T228 I229 I237 W296 F300 I302	M227-L231 PolarHBondContact O-N 3.41Å; M227-L231 VanDerWaalsContact O-N 3.08Å; T228-L231 PolarHBondContact O-N 2.64Å; I229-L231 VanDerWaalsContact C-N 3.34Å; I229-L231 PolarHBondContact O-N 2.05Å; L231-I237 HydrophobicContact CD2-CD1 4.03Å; L231-I237 HydrophobicContact CG-CD1 4.38Å; L231-W296 HydrophobicContact CD1-CD2 3.81Å; L231-W296 HydrophobicContact CD1-CE3 3.56Å; L231-W296 HydrophobicContact CD1-CG 4.35Å; L231-W296 HydrophobicContact CD1-CH2 4.37Å; L231-W296 HydrophobicContact CD1-CZ3 3.86Å; L231-F300 HydrophobicContact CD1-CE2 4.48Å; L231-F300 HydrophobicContact CD2-CB 4.02Å; L231-F300 HydrophobicContact CD2-CD1 4.1Å; L231-F300 HydrophobicContact CD2-CD2 3.74Å; L231-F300 HydrophobicContact CD2-CE2 4.2Å; L231-F300 HydrophobicContact CD2-CG 3.69Å; L231-I302 HydrophobicContact CD2-CD1 4.1Å
232	E	96.7	Very high	98.4	Very high	68 Å²	68	17.7 Å²	17.7	32%	0.318	9%	0.089	S	C	.	.	H	α-helix	trans	-84.5	-17.5	177.8	-64.9	174.5	-164	0	0	112.9	L65 Y68 K197 T228 I229 A230	L65-E232 HydrophobicContact CD2-CB 3.9Å; L65-E232 WeakPolarHBondContact CD2-O 3.43Å; Y68-E232 VanDerWaalsContact CE2-OE2 3.26Å; Y68-E232 WeakPolarHBondContact CE2-OE2 3.46Å; Y68-E232 PolarHBondContact OH-OE2 3.05Å; K197-E232 WeakPolarHBondContact CE-OE1 3.48Å; K197-E232 IonicContact NZ-OE1 2.76Å; K197-E232 PolarHBondContact NZ-OE1 2.91Å; K197-E232 IonicContact NZ-OE2 3.94Å; K197-E232 PolarHBondContact NZ-OE2 3.26Å; T228-E232 PolarHBondContact O-N 3.44Å; I229-E232 PolarHBondContact O-N 2.9Å; I229-E232 VanDerWaalsContact O-N 3.14Å; A230-E232 PolarHBondContact O-N 3.3Å
233	L	96.8	Very high	98.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-114.4	-25.7	-166.3	-174.1	151.8	0	0	0	113.4	L65 M79 H80 C81 L130 I229 A230	L65-L233 HydrophobicContact CD1-CD1 4.19Å; M79-L233 HydrophobicContact CB-CD1 4.09Å; M79-L233 HydrophobicContact CE-CD1 4.31Å; M79-L233 HydrophobicContact CE-CD2 4.38Å; M79-L233 HydrophobicContact CG-CD1 3.77Å; M79-L233 HydrophobicContact CG-CD2 4.44Å; M79-L233 HydrophobicContact CG-CG 4.16Å; M79-L233 HydrophobicContact SD-CD1 3.8Å; H80-L233 CarbonylContact C-O 3.47Å; H80-L233 WeakPolarHBondContact CA-O 3.26Å; H80-L233 PolarHBondContact ND1-O 3.07Å; C81-L233 HydrophobicContact CB-CD2 4.14Å; C81-L233 PolarHBondContact N-O 3.07Å; C81-L233 WeakPolarHBondContact SG-CD2 3.42Å; L130-L233 HydrophobicContact CD2-CD1 3.99Å; I229-L233 VanDerWaalsContact O-CB 3.3Å; I229-L233 WeakPolarHBondContact O-CB 3.2Å; I229-L233 PolarHBondContact O-N 2.52Å; A230-L233 PolarHBondContact O-N 2.9Å; A230-L233 VanDerWaalsContact O-N 3.16Å
234	C	98.3	Very high	98.3	Very high	13 Å²	13	17.7 Å²	17.7	9%	0.088	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.1	-165.4	-50.3	0	0	0	0	111.8	C81 C84 A230 I237	C81-C234 VanDerWaalsContact O-CA 3.26Å; C81-C234 WeakPolarHBondContact O-CA 3.47Å; C84-C234 HydrophobicContact CB-CB 3.74Å; C84-C234 WeakPolarHBondContact CB-SG 3.26Å; C84-C234 WeakPolarHBondContact SG-CB 3.41Å; C84-C234 CovalentContact SG-SG 2.02Å; C84-C234 PolarHBondContact SG-SG 3.21Å; A230-C234 VanDerWaalsContact O-CB 3.23Å; A230-C234 WeakPolarHBondContact O-CB 3.5Å; A230-C234 PolarHBondContact O-N 3.31Å; A230-C234 PolarHBondContact O-SG 3.45Å; A230-C234 VanDerWaalsContact O-SG 3.37Å; C234-I237 HydrophobicContact CB-CD1 4.43Å; C234-I237 HydrophobicContact CB-CG1 3.73Å
235	D	98.3	Very high	98.2	Very high	90 Å²	90	18.5 Å²	18.5	48%	0.481	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	-40.2	169.7	-58.3	-36.9	0	0	0	111	H80 C81 H82	H80-D235 IonicContact CE1-OD1 3.76Å; H80-D235 PolarHBondContact CE1-OD1 2.99Å; H80-D235 IonicContact CE1-OD2 2.94Å; H80-D235 IonicContact NE2-OD1 3.8Å; H80-D235 PolarHBondContact NE2-OD1 2.98Å; H80-D235 IonicContact NE2-OD2 2.64Å; H80-D235 PolarHBondContact NE2-OD2 3.49Å; H80-D235 VanDerWaalsContact NE2-OD2 3.09Å; C81-D235 PolarHBondContact O-N 2.83Å; C81-D235 VanDerWaalsContact O-N 3.14Å; H82-D235 IonicContact CE1-OD2 3.99Å; H82-D235 IonicContact CG-OD2 3.32Å; H82-D235 IonicContact ND1-OD2 3.85Å; H82-D235 PolarHBondContact ND1-OD2 3.28Å
236	R	98.7	Very high	98.1	Very high	96 Å²	96	22 Å²	22	36%	0.362	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	137.4	176.5	-179.9	171.3	-167	-154.5	-1.6	112.2	H82 C84 D301 H303	H82-R236 PolarHBondContact O-N 3.12Å; C84-R236 PolarHBondContact N-O 3.36Å; R236-D301 HydrophobicContact CB-CB 4.44Å; R236-D301 VanDerWaalsContact CD-OD2 3.25Å; R236-D301 WeakPolarHBondContact CD-OD2 3.4Å; R236-D301 HydrophobicContact CG-CB 4.39Å; R236-D301 WeakPolarHBondContact CG-OD2 3.29Å; R236-D301 IonicContact NE-OD1 3.91Å; R236-D301 PolarHBondContact NE-OD1 3.28Å; R236-D301 IonicContact NE-OD2 3.7Å; R236-H303 PolarHBondContact NE-CD2 2.73Å; R236-H303 PolarHBondContact NE-NE2 3.44Å; R236-H303 PolarHBondContact NH2-CD2 2.93Å; R236-H303 PolarHBondContact NH2-NE2 3.02Å
237	I	98.9	Very high	98	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.015	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	112.7	-176.1	-51.5	170.8	0	0	0	110.5	L86 A230 L231 C234 V239 D301 I302 H303	L86-I237 HydrophobicContact CB-CG2 4.27Å; A230-I237 HydrophobicContact CB-CD1 3.71Å; A230-I237 HydrophobicContact CB-CG1 4.27Å; A230-I237 HydrophobicContact CB-CG2 4.36Å; L231-I237 HydrophobicContact CD2-CD1 4.03Å; L231-I237 HydrophobicContact CG-CD1 4.38Å; C234-I237 HydrophobicContact CB-CD1 4.43Å; C234-I237 HydrophobicContact CB-CG1 3.73Å; I237-V239 HydrophobicContact CG2-CG2 3.74Å; I237-D301 PolarHBondContact N-O 2.86Å; I237-I302 HydrophobicContact CB-CG1 4.32Å; I237-I302 HydrophobicContact CB-CG2 4.48Å; I237-I302 HydrophobicContact CD1-CG1 4.27Å; I237-I302 CarbonylContact O-C 3.56Å; I237-I302 VanDerWaalsContact O-CA 3.31Å; I237-I302 WeakPolarHBondContact O-CA 3.02Å; I237-H303 PolarHBondContact O-N 3.03Å
238	N	98.9	Very high	97.9	Very high	15 Å²	15	23.8 Å²	23.8	8%	0.08	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	113.8	168.4	-63.8	-46.7	0	0	0	109	C84 S85 L86 Y240 F305	C84-N238 PolarHBondContact O-N 3.02Å; S85-N238 CarbonylContact C-O 3.56Å; S85-N238 WeakPolarHBondContact CA-O 3.28Å; L86-N238 PolarHBondContact N-O 3.5Å; N238-Y240 HydrophobicContact CB-CD2 4.43Å; N238-Y240 HydrophobicContact CB-CE2 3.59Å; N238-Y240 WeakPolarHBondContact O-CD2 3.45Å; N238-F305 HydrophobicContact CB-CD2 4.28Å; N238-F305 HydrophobicContact CB-CE2 3.73Å
239	V	98.9	Very high	97.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.2	-177.9	-179.4	0	0	0	0	109.8	L86 T88 M227 I237 M242 I302 H303 F304 F305	L86-V239 HydrophobicContact CB-CG2 4.48Å; L86-V239 HydrophobicContact CD2-CG1 4.12Å; L86-V239 CarbonylContact O-C 3.58Å; L86-V239 WeakPolarHBondContact O-CA 3.42Å; T88-V239 HydrophobicContact CG2-CG1 4.39Å; M227-V239 HydrophobicContact CE-CG2 4.12Å; M227-V239 HydrophobicContact SD-CG2 3.82Å; I237-V239 HydrophobicContact CG2-CG2 3.74Å; V239-M242 HydrophobicContact CG1-CB 3.76Å; V239-M242 HydrophobicContact CG1-CE 3.86Å; V239-M242 HydrophobicContact CG1-SD 4.15Å; V239-I302 HydrophobicContact CG2-CG2 3.9Å; V239-H303 PolarHBondContact N-O 2.9Å; V239-F304 HydrophobicContact CB-CD1 3.6Å; V239-F304 HydrophobicContact CB-CE1 3.91Å; V239-F304 HydrophobicContact CB-CG 4.46Å; V239-F304 HydrophobicContact CG1-CD1 3.68Å; V239-F304 HydrophobicContact CG1-CE1 3.92Å; V239-F304 HydrophobicContact CG2-CD1 4.16Å; V239-F304 HydrophobicContact CG2-CE1 3.97Å; V239-F304 CarbonylContact O-C 3.57Å; V239-F304 WeakPolarHBondContact O-CA 3.04Å; V239-F305 PolarHBondContact O-N 3.43Å
240	Y	98.9	Very high	97.4	Very high	2 Å²	2	36 Å²	36	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.7	-177.7	-63.1	-104.2	0	0	0	110.9	L86 I87 T88 R98 I102 N238 F305	L86-Y240 PolarHBondContact O-N 2.83Å; I87-Y240 HydrophobicContact CG1-CD2 4.49Å; T88-Y240 WeakPolarHBondContact CG2-O 3.37Å; T88-Y240 PolarHBondContact N-O 3.3Å; T88-Y240 PolarHBondContact OG1-O 2.92Å; R98-Y240 HydrophobicContact CB-CE1 4.35Å; I102-Y240 HydrophobicContact CD1-CD1 3.91Å; I102-Y240 HydrophobicContact CD1-CE1 4.18Å; I102-Y240 HydrophobicContact CD1-CG 4.15Å; I102-Y240 HydrophobicContact CG1-CD1 3.75Å; I102-Y240 HydrophobicContact CG1-CD2 4.09Å; I102-Y240 HydrophobicContact CG1-CE1 3.56Å; I102-Y240 HydrophobicContact CG1-CE2 3.94Å; I102-Y240 HydrophobicContact CG1-CG 4.01Å; N238-Y240 HydrophobicContact CB-CD2 4.43Å; N238-Y240 HydrophobicContact CB-CE2 3.59Å; N238-Y240 WeakPolarHBondContact O-CD2 3.45Å; Y240-F305 HydrophobicContact CD1-CB 4.04Å; Y240-F305 HydrophobicContact CD1-CD2 4.49Å; Y240-F305 HydrophobicContact CE1-CB 4.38Å; Y240-F305 HydrophobicContact CE1-CD2 4.29Å; Y240-F305 HydrophobicContact CE1-CG 4.42Å; Y240-F305 HydrophobicContact CE2-CD2 4.41Å; Y240-F305 HydrophobicContact CG-CB 4.5Å
241	G	98.3	Very high	96.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	79.5	38.5	176.9	0	0	0	0	0	112.4	T88 S90 F305 Q306	T88-G241 WeakPolarHBondContact CB-O 3.21Å; T88-G241 WeakPolarHBondContact CG2-O 3.37Å; T88-G241 VanDerWaalsContact OG1-C 3.3Å; T88-G241 PolarHBondContact OG1-O 3.49Å; S90-G241 WeakPolarHBondContact CB-O 3.41Å; G241-F305 PolarHBondContact N-O 3.15Å; G241-Q306 VanDerWaalsContact CA-O 3.29Å; G241-Q306 WeakPolarHBondContact CA-O 3.2Å
242	M	98.4	Very high	96.2	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.039	25%	0.245	C	C	.	.			trans	-129	116.6	177.9	-170.3	174.3	-65.7	0	0	109	T88 M227 V239 K290 F293 F304 W309	T88-M242 HydrophobicContact CG2-CB 4.03Å; T88-M242 HydrophobicContact CG2-CE 3.62Å; M227-M242 HydrophobicContact SD-CE 4.48Å; V239-M242 HydrophobicContact CG1-CB 3.76Å; V239-M242 HydrophobicContact CG1-CE 3.86Å; V239-M242 HydrophobicContact CG1-SD 4.15Å; M242-K290 HydrophobicContact SD-CG 4.41Å; M242-F293 HydrophobicContact CE-CD2 4.14Å; M242-F293 HydrophobicContact CE-CE2 4.17Å; M242-F293 HydrophobicContact SD-CD2 3.63Å; M242-F293 HydrophobicContact SD-CE2 4.2Å; M242-F304 HydrophobicContact CB-CD1 4.16Å; M242-F304 HydrophobicContact CG-CD1 4.43Å; M242-F304 HydrophobicContact SD-CD1 4.17Å; M242-F304 HydrophobicContact SD-CE1 3.72Å; M242-W309 PolarHBondContact O-NE1 2.86Å
243	V	98.1	Very high	95.9	Very high	1 Å²	1	49 Å²	49	1%	0.006	24%	0.243	C	C	.	.			trans	-75.3	155.3	174.3	-60.5	0	0	0	0	111.9	H92 F247 Y272 K290 P307	H92-V243 WeakPolarHBondContact CD2-CG1 3.29Å; H92-V243 VanDerWaalsContact NE2-CG1 3.32Å; H92-V243 WeakPolarHBondContact NE2-CG1 3.11Å; V243-F247 HydrophobicContact CB-CB 3.77Å; V243-F247 HydrophobicContact CB-CD1 3.71Å; V243-F247 HydrophobicContact CB-CD2 4.32Å; V243-F247 HydrophobicContact CB-CE1 4.36Å; V243-F247 HydrophobicContact CB-CG 3.68Å; V243-F247 HydrophobicContact CG1-CD1 3.62Å; V243-F247 HydrophobicContact CG1-CD2 4.4Å; V243-F247 HydrophobicContact CG1-CE1 3.77Å; V243-F247 HydrophobicContact CG1-CG 3.96Å; V243-F247 HydrophobicContact CG1-CZ 4.22Å; V243-F247 HydrophobicContact CG2-CB 4.09Å; V243-F247 HydrophobicContact CG2-CD1 4.03Å; V243-F247 HydrophobicContact CG2-CG 4.27Å; V243-Y272 HydrophobicContact CG2-CD2 4.4Å; V243-Y272 HydrophobicContact CG2-CE2 3.86Å; V243-K290 WeakPolarHBondContact O-CD 3.13Å; V243-K290 WeakPolarHBondContact O-CE 3.39Å; V243-P307 HydrophobicContact CG1-CG 4.09Å
244	A	97.7	Very high	95.8	Very high	23 Å²	23	55.1 Å²	55.1	19%	0.19	27%	0.271	C	S	.	.			trans	-61.3	157.4	173.4	0	0	0	0	0	111.8	D246 F247 W309	A244-D246 VanDerWaalsContact C-N 3.26Å; A244-D246 PolarHBondContact O-N 3.21Å; A244-F247 VanDerWaalsContact O-CB 3.28Å; A244-F247 WeakPolarHBondContact O-CB 3.46Å; A244-F247 PolarHBondContact O-N 3.06Å; A244-W309 HydrophobicContact CB-CD2 3.74Å; A244-W309 HydrophobicContact CB-CE3 4.03Å; A244-W309 HydrophobicContact CB-CG 3.95Å
245	P	96.6	Very high	95.7	Very high	17 Å²	17	58.5 Å²	58.5	11%	0.11	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33	-175.6	-23.3	31.7	0	0	0	114.9	I287 K290 R291 A294	P245-I287 WeakPolarHBondContact O-CG2 3.24Å; P245-K290 HydrophobicContact CB-CB 4.23Å; P245-K290 HydrophobicContact CG-CB 4.01Å; P245-R291 HydrophobicContact CB-CG 3.64Å; P245-R291 HydrophobicContact CG-CG 4.03Å; P245-A294 HydrophobicContact CG-CB 4.06Å
246	D	95.3	Very high	95.6	Very high	77 Å²	77	54.9 Å²	54.9	41%	0.412	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	0.9	-176.3	-63.6	-48.6	0	0	0	113.5	A244 C248 R249 R291	A244-D246 VanDerWaalsContact C-N 3.26Å; A244-D246 PolarHBondContact O-N 3.21Å; D246-C248 VanDerWaalsContact C-N 3.34Å; D246-C248 PolarHBondContact O-N 2.61Å; D246-R249 WeakPolarHBondContact O-CB 3.46Å; D246-R249 PolarHBondContact O-N 2.96Å; D246-R249 IonicContact OD1-CZ 3.92Å; D246-R249 IonicContact OD1-NH1 3.19Å; D246-R249 PolarHBondContact OD1-NH1 3.1Å; D246-R291 IonicContact OD1-NH2 3.46Å; D246-R291 PolarHBondContact OD1-NH2 3.35Å
247	F	96.8	Very high	95.6	Very high	22 Å²	22	51.5 Å²	51.5	10%	0.096	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-51.1	-47.9	-177.7	-179.2	-98	0	0	0	113.2	H92 V243 A244 R249 E250 H253 P307	H92-F247 AromaticContact CE1-CE1 3.96Å; H92-F247 AromaticContact CE1-CZ 3.62Å; H92-F247 AromaticContact NE2-CE1 3.55Å; H92-F247 AromaticContact NE2-CZ 3.7Å; V243-F247 HydrophobicContact CB-CB 3.77Å; V243-F247 HydrophobicContact CB-CD1 3.71Å; V243-F247 HydrophobicContact CB-CD2 4.32Å; V243-F247 HydrophobicContact CB-CE1 4.36Å; V243-F247 HydrophobicContact CB-CG 3.68Å; V243-F247 HydrophobicContact CG1-CD1 3.62Å; V243-F247 HydrophobicContact CG1-CD2 4.4Å; V243-F247 HydrophobicContact CG1-CE1 3.77Å; V243-F247 HydrophobicContact CG1-CG 3.96Å; V243-F247 HydrophobicContact CG1-CZ 4.22Å; V243-F247 HydrophobicContact CG2-CB 4.09Å; V243-F247 HydrophobicContact CG2-CD1 4.03Å; V243-F247 HydrophobicContact CG2-CG 4.27Å; A244-F247 VanDerWaalsContact O-CB 3.28Å; A244-F247 WeakPolarHBondContact O-CB 3.46Å; A244-F247 PolarHBondContact O-N 3.06Å; F247-R249 PolarHBondContact O-N 3.21Å; F247-E250 WeakPolarHBondContact O-CB 3.15Å; F247-E250 PolarHBondContact O-N 2.88Å; F247-H253 HydrophobicContact CD1-CB 4.18Å; F247-H253 HydrophobicContact CE1-CB 3.8Å; F247-H253 HydrophobicContact CE2-CB 4.34Å; F247-H253 HydrophobicContact CZ-CB 3.89Å; F247-P307 HydrophobicContact CE2-CG 4.42Å
248	C	96.3	Very high	95.6	Very high	14 Å²	14	53.4 Å²	53.4	10%	0.095	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-71.9	2.2	-179.5	-62.1	0	0	0	0	114.7	D246 C269 I273	D246-C248 VanDerWaalsContact C-N 3.34Å; D246-C248 PolarHBondContact O-N 2.61Å; C248-C269 WeakPolarHBondContact CA-SG 3.38Å; C248-C269 HydrophobicContact CB-CB 3.62Å; C248-C269 WeakPolarHBondContact CB-SG 3.3Å; C248-C269 WeakPolarHBondContact SG-CA 3.38Å; C248-C269 WeakPolarHBondContact SG-CB 3.27Å; C248-C269 CovalentContact SG-SG 2.05Å; C248-C269 PolarHBondContact SG-SG 3.48Å; C248-I273 HydrophobicContact CB-CD1 4.16Å; C248-I273 HydrophobicContact CB-CG1 4.38Å
249	R	94	Very high	95.5	Very high	167 Å²	167	54.1 Å²	54.1	63%	0.63	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-102.2	-11.3	171.6	-61.5	175.8	172.7	175.4	-10.3	112	D246 F247	D246-R249 WeakPolarHBondContact O-CB 3.46Å; D246-R249 PolarHBondContact O-N 2.96Å; D246-R249 IonicContact OD1-CZ 3.92Å; D246-R249 IonicContact OD1-NH1 3.19Å; D246-R249 PolarHBondContact OD1-NH1 3.1Å; F247-R249 PolarHBondContact O-N 3.21Å
250	E	93.1	Very high	95.5	Very high	95 Å²	95	54.5 Å²	54.5	44%	0.444	28%	0.279	S	S	.	.	S	Bend	trans	-71.8	133.5	-178.6	-65.6	172.6	-159.4	0	0	110.3	F247 Q252 H253	F247-E250 WeakPolarHBondContact O-CB 3.15Å; F247-E250 PolarHBondContact O-N 2.88Å; E250-Q252 PolarHBondContact O-N 3.4Å; E250-Q252 VanDerWaalsContact O-N 3.08Å; E250-H253 HydrophobicContact CB-CB 4.47Å; E250-H253 PolarHBondContact O-CD2 2.89Å; E250-H253 PolarHBondContact O-N 3.39Å
251	P	85.1	Confident	95.3	Very high	134 Å²	134	55.9 Å²	55.9	87%	0.87	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.1	-173.4	-26.4	34.4	0	0	0	115.9
252	Q	85.4	Confident	95.2	Very high	192 Å²	192	59.7 Å²	59.7	90%	0.897	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	30.4	-173.8	-64.4	-178.4	-0.4	0	0	112.5	E250	E250-Q252 PolarHBondContact O-N 3.4Å; E250-Q252 VanDerWaalsContact O-N 3.08Å
253	H	91.5	Very high	94.9	Very high	60 Å²	60	64.1 Å²	64.1	28%	0.278	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-63.7	145.4	178.3	72.7	73.9	0	0	0	111.6	F247 E250 S255	F247-H253 HydrophobicContact CD1-CB 4.18Å; F247-H253 HydrophobicContact CE1-CB 3.8Å; F247-H253 HydrophobicContact CE2-CB 4.34Å; F247-H253 HydrophobicContact CZ-CB 3.89Å; E250-H253 HydrophobicContact CB-CB 4.47Å; E250-H253 PolarHBondContact O-CD2 2.89Å; E250-H253 PolarHBondContact O-N 3.39Å; H253-S255 PolarHBondContact O-N 2.94Å
254	Q	93.6	Very high	94.8	Very high	128 Å²	128	75.9 Å²	75.9	60%	0.598	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-67	134.2	173.3	-173.7	-178.1	6.2	0	0	109.8	V256	Q254-V256 HydrophobicContact CG-CG1 4.02Å
255	S	96.1	Very high	94.7	Very high	85 Å²	85	76.1 Å²	76.1	59%	0.594	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-88.5	130.9	169.6	173.5	0	0	0	0	109.6	H253 D267	H253-S255 PolarHBondContact O-N 2.94Å; S255-D267 WeakPolarHBondContact CB-OD2 3.41Å; S255-D267 PolarHBondContact OG-OD2 3.02Å
256	V	97.8	Very high	94.7	Very high	13 Å²	13	78.2 Å²	78.2	8%	0.079	39%	0.394	C	S	.	.			trans	-140.3	154.8	178.8	-61.1	0	0	0	0	109.4	H92 Q254 E268	H92-V256 VanDerWaalsContact CD2-CG2 3.47Å; H92-V256 WeakPolarHBondContact CD2-CG2 3.18Å; Q254-V256 HydrophobicContact CG-CG1 4.02Å; V256-E268 HydrophobicContact CG2-CB 3.92Å; V256-E268 PolarHBondContact O-N 3.04Å
257	P	98.3	Very high	94.9	Very high	26 Å²	26	76.7 Å²	76.7	17%	0.169	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-61.4	147.5	171.6	27.1	-35.5	0	0	0	110.9	G91 I94 H259 E262	G91-P257 WeakPolarHBondContact CA-O 3.43Å; G91-P257 PolarHBondContact N-O 3.17Å; I94-P257 HydrophobicContact CD1-CG 3.78Å; P257-H259 PolarHBondContact O-N 3.29Å; P257-E262 WeakPolarHBondContact CB-O 3.4Å
258	Y	98.2	Very high	94.9	Very high	42 Å²	42	75.7 Å²	75.7	17%	0.165	38%	0.381	C	S	.	.	S	Bend	trans	-57.8	-35.7	177.5	179.4	-112.6	0	0	0	112.4	P266 E268 M271 Y272 F286	Y258-P266 VanDerWaalsContact CB-O 3.29Å; Y258-P266 WeakPolarHBondContact CB-O 3.47Å; Y258-P266 PolarHBondContact N-O 3.18Å; Y258-E268 HydrophobicContact CD2-CG 4.1Å; Y258-M271 HydrophobicContact CD1-CE 4.38Å; Y258-M271 HydrophobicContact CD1-CG 4.4Å; Y258-M271 HydrophobicContact CD2-CB 3.54Å; Y258-M271 HydrophobicContact CD2-CG 3.89Å; Y258-M271 HydrophobicContact CE1-CE 4.35Å; Y258-M271 HydrophobicContact CE2-CB 3.92Å; Y258-M271 HydrophobicContact CG-CB 4.03Å; Y258-M271 HydrophobicContact CG-CG 3.83Å; Y258-Y272 HydrophobicContact CD2-CE1 4.21Å; Y258-Y272 HydrophobicContact CE2-CD1 4.02Å; Y258-Y272 AromaticContact CE2-CE1 3.59Å; Y258-Y272 HydrophobicContact CE2-CE1 3.59Å; Y258-F286 WeakPolarHBondContact OH-CZ 3.37Å
259	H	98.1	Very high	95	Very high	31 Å²	31	75.2 Å²	75.2	14%	0.144	38%	0.378	C	S	.	.	S	Bend	trans	-120.5	133.5	173.9	-65.4	151.7	0	0	0	112.5	S89 P257 Y261 E262	S89-H259 WeakPolarHBondContact CB-CD2 3.38Å; S89-H259 CarbonylContact O-C 3.55Å; S89-H259 WeakPolarHBondContact O-CA 3.43Å; P257-H259 PolarHBondContact O-N 3.29Å; H259-Y261 HydrophobicContact CB-CD1 4.19Å; H259-Y261 HydrophobicContact CB-CD2 4.34Å; H259-Y261 HydrophobicContact CB-CE1 3.92Å; H259-Y261 HydrophobicContact CB-CE2 4.05Å; H259-Y261 HydrophobicContact CB-CG 4.41Å; H259-Y261 AromaticContact CG-CZ 3.75Å; H259-Y261 AromaticContact ND1-CZ 3.89Å; H259-Y261 PolarHBondContact O-N 3.03Å; H259-Y261 VanDerWaalsContact O-N 3.14Å; H259-E262 HydrophobicContact CB-CB 4.06Å; H259-E262 HydrophobicContact CB-CG 4.07Å; H259-E262 IonicContact CE1-OE2 3.26Å; H259-E262 IonicContact CG-OE2 3.63Å; H259-E262 IonicContact ND1-OE2 3.43Å; H259-E262 PolarHBondContact ND1-OE2 3.46Å; H259-E262 CarbonylContact O-C 3.58Å; H259-E262 PolarHBondContact O-N 2.9Å
260	Y	97.9	Very high	95.1	Very high	7 Å²	7	69.9 Å²	69.9	3%	0.027	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.4	178.4	66.9	-99.5	0	0	0	113.8	S89 L93 A114 P115 F120 V124	S89-Y260 VanDerWaalsContact O-CD1 3.32Å; S89-Y260 WeakPolarHBondContact O-CD1 3.34Å; S89-Y260 PolarHBondContact O-N 3.08Å; L93-Y260 HydrophobicContact CB-CD1 4.42Å; L93-Y260 HydrophobicContact CD1-CD1 3.65Å; L93-Y260 HydrophobicContact CD1-CE1 3.93Å; A114-Y260 HydrophobicContact CB-CE1 4.32Å; A114-Y260 WeakPolarHBondContact CB-OH 3.48Å; P115-Y260 HydrophobicContact CG-CE2 4.32Å; P115-Y260 PolarHBondContact O-OH 3.03Å; F120-Y260 HydrophobicContact CB-CE2 4.09Å; F120-Y260 AromaticContact CD1-CD2 3.64Å; F120-Y260 HydrophobicContact CD1-CD2 3.64Å; F120-Y260 AromaticContact CD1-CE2 3.88Å; F120-Y260 HydrophobicContact CD1-CE2 3.88Å; F120-Y260 HydrophobicContact CE1-CD2 4.08Å; F120-Y260 HydrophobicContact CE1-CE2 4.49Å; F120-Y260 HydrophobicContact CG-CD2 4.2Å; F120-Y260 AromaticContact CG-CE2 3.94Å; F120-Y260 HydrophobicContact CG-CE2 3.94Å; V124-Y260 HydrophobicContact CG1-CD1 4.39Å; V124-Y260 HydrophobicContact CG1-CD2 4.35Å; V124-Y260 HydrophobicContact CG1-CE1 4.15Å; V124-Y260 HydrophobicContact CG1-CE2 4.13Å; V124-Y260 HydrophobicContact CG1-CG 4.49Å; V124-Y260 HydrophobicContact CG2-CE2 4.25Å
261	Y	95.7	Very high	95.3	Very high	32 Å²	32	67.4 Å²	67.4	13%	0.125	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	2.9	-179.8	51	-87.5	0	0	0	113	A114 P115 H259	A114-Y261 HydrophobicContact CB-CD1 4.47Å; A114-Y261 HydrophobicContact CB-CE1 3.78Å; P115-Y261 VanDerWaalsContact CD-CD1 3.41Å; P115-Y261 VanDerWaalsContact CD-CG 3.4Å; P115-Y261 HydrophobicContact CG-CD1 4.29Å; P115-Y261 HydrophobicContact CG-CG 3.91Å; H259-Y261 HydrophobicContact CB-CD1 4.19Å; H259-Y261 HydrophobicContact CB-CD2 4.34Å; H259-Y261 HydrophobicContact CB-CE1 3.92Å; H259-Y261 HydrophobicContact CB-CE2 4.05Å; H259-Y261 HydrophobicContact CB-CG 4.41Å; H259-Y261 AromaticContact CG-CZ 3.75Å; H259-Y261 AromaticContact ND1-CZ 3.89Å; H259-Y261 PolarHBondContact O-N 3.03Å; H259-Y261 VanDerWaalsContact O-N 3.14Å
262	E	95.8	Very high	95.9	Very high	79 Å²	79	61.8 Å²	61.8	37%	0.369	32%	0.32	S	S	.	.			trans	-127.7	72	176.1	-57.8	-179.9	145.9	0	0	109.4	P257 H259 R264 G265	P257-E262 WeakPolarHBondContact CB-O 3.4Å; H259-E262 HydrophobicContact CB-CB 4.06Å; H259-E262 HydrophobicContact CB-CG 4.07Å; H259-E262 IonicContact CE1-OE2 3.26Å; H259-E262 IonicContact CG-OE2 3.63Å; H259-E262 IonicContact ND1-OE2 3.43Å; H259-E262 PolarHBondContact ND1-OE2 3.46Å; H259-E262 CarbonylContact O-C 3.58Å; H259-E262 PolarHBondContact O-N 2.9Å; E262-R264 PolarHBondContact O-N 3.2Å; E262-G265 WeakPolarHBondContact O-CA 3.44Å; E262-G265 PolarHBondContact O-N 3.23Å
263	P	91.7	Very high	96.4	Very high	101 Å²	101	54.9 Å²	54.9	66%	0.656	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.3	-174.9	25.7	-35.6	0	0	0	114.1
264	R	95.3	Very high	96.7	Very high	249 Å²	249	55.8 Å²	55.8	94%	0.94	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	10.2	172.2	-56.4	-176.8	-168.7	159.3	2.5	112.7	E262	E262-R264 PolarHBondContact O-N 3.2Å
265	G	95.9	Very high	96.8	Very high	28 Å²	28	51.4 Å²	51.4	29%	0.289	28%	0.282	S	S	.	.	S	Bend	trans	-72	177.1	176.8	0	0	0	0	0	112.1	E262	E262-G265 WeakPolarHBondContact O-CA 3.44Å; E262-G265 PolarHBondContact O-N 3.23Å
266	P	97.3	Very high	96.8	Very high	60 Å²	60	48.8 Å²	48.8	39%	0.39	26%	0.26	S	S	.	.			trans	-65.1	155.9	177.3	30.1	-35.9	0	0	0	111.3	Y258 M271	Y258-P266 VanDerWaalsContact CB-O 3.29Å; Y258-P266 WeakPolarHBondContact CB-O 3.47Å; Y258-P266 PolarHBondContact N-O 3.18Å; P266-M271 HydrophobicContact CB-CG 3.64Å; P266-M271 HydrophobicContact CB-SD 3.74Å; P266-M271 HydrophobicContact CG-CE 4.3Å; P266-M271 HydrophobicContact CG-CG 3.48Å; P266-M271 VanDerWaalsContact CG-CG 3.48Å; P266-M271 HydrophobicContact CG-SD 3.54Å; P266-M271 VanDerWaalsContact CG-SD 3.54Å
267	D	97.9	Very high	96.6	Very high	45 Å²	45	57.2 Å²	57.2	24%	0.241	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-62.3	139.4	171.8	172.2	-94.3	0	0	0	111.3	S255 C269 A270 M271	S255-D267 WeakPolarHBondContact CB-OD2 3.41Å; S255-D267 PolarHBondContact OG-OD2 3.02Å; D267-C269 WeakPolarHBondContact OD1-CA 3.36Å; D267-C269 PolarHBondContact OD1-N 3.39Å; D267-A270 HydrophobicContact CB-CB 3.97Å; D267-A270 PolarHBondContact O-N 3.26Å; D267-A270 PolarHBondContact OD1-N 3.08Å; D267-M271 WeakPolarHBondContact O-CG 3.47Å; D267-M271 PolarHBondContact O-N 3.47Å
268	E	98.1	Very high	96.4	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-48.3	-175.7	-171.5	-171.3	-134.4	0	0	112.4	S90 H92 V256 Y258 M271 Y272	S90-E268 WeakPolarHBondContact CB-OE1 3.28Å; S90-E268 VanDerWaalsContact OG-CD 3.29Å; S90-E268 PolarHBondContact OG-OE1 3.09Å; H92-E268 IonicContact CD2-OE2 3.93Å; H92-E268 PolarHBondContact CD2-OE2 2.73Å; H92-E268 IonicContact NE2-OE2 2.86Å; V256-E268 HydrophobicContact CG2-CB 3.92Å; V256-E268 PolarHBondContact O-N 3.04Å; Y258-E268 HydrophobicContact CD2-CG 4.1Å; E268-M271 WeakPolarHBondContact O-CB 3.45Å; E268-M271 PolarHBondContact O-N 3.28Å; E268-Y272 HydrophobicContact CG-CD2 3.93Å; E268-Y272 HydrophobicContact CG-CE1 4.21Å; E268-Y272 HydrophobicContact CG-CE2 3.31Å; E268-Y272 VanDerWaalsContact CG-CZ 3.44Å; E268-Y272 PolarHBondContact O-N 2.8Å; E268-Y272 WeakPolarHBondContact OE1-CE2 3.35Å; E268-Y272 VanDerWaalsContact OE1-CZ 3.3Å; E268-Y272 PolarHBondContact OE1-OH 2.99Å
269	C	97.8	Very high	95.7	Very high	4 Å²	4	63.4 Å²	63.4	3%	0.027	32%	0.319	C	S	.	.	H	α-helix	trans	-69.5	-37.6	-177.9	-81.4	0	0	0	0	111.9	C248 D267 M271 Y272 I273	C248-C269 WeakPolarHBondContact CA-SG 3.38Å; C248-C269 HydrophobicContact CB-CB 3.62Å; C248-C269 WeakPolarHBondContact CB-SG 3.3Å; C248-C269 WeakPolarHBondContact SG-CA 3.38Å; C248-C269 WeakPolarHBondContact SG-CB 3.27Å; C248-C269 CovalentContact SG-SG 2.05Å; C248-C269 PolarHBondContact SG-SG 3.48Å; D267-C269 WeakPolarHBondContact OD1-CA 3.36Å; D267-C269 PolarHBondContact OD1-N 3.39Å; C269-M271 VanDerWaalsContact C-N 3.32Å; C269-M271 PolarHBondContact O-N 3.15Å; C269-Y272 PolarHBondContact O-N 3.22Å; C269-I273 WeakPolarHBondContact O-CB 3.49Å; C269-I273 VanDerWaalsContact O-CG1 3.28Å; C269-I273 WeakPolarHBondContact O-CG1 3.34Å; C269-I273 PolarHBondContact O-N 2.89Å
270	A	96.8	Very high	94.8	Very high	55 Å²	55	72.6 Å²	72.6	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-58.1	-44.6	171.6	0	0	0	0	0	111.5	D267 S274	D267-A270 HydrophobicContact CB-CB 3.97Å; D267-A270 PolarHBondContact O-N 3.26Å; D267-A270 PolarHBondContact OD1-N 3.08Å; A270-S274 WeakPolarHBondContact O-CB 3.36Å; A270-S274 PolarHBondContact O-N 3.39Å
271	M	97.1	Very high	93.5	Very high	43 Å²	43	73.7 Å²	73.7	21%	0.212	37%	0.366	C	S	.	.	H	α-helix	trans	-62.5	-47.6	175.3	-74.4	-62.8	-70.7	0	0	112	Y258 P266 D267 E268 C269 I273 S274 H275	Y258-M271 HydrophobicContact CD1-CE 4.38Å; Y258-M271 HydrophobicContact CD1-CG 4.4Å; Y258-M271 HydrophobicContact CD2-CB 3.54Å; Y258-M271 HydrophobicContact CD2-CG 3.89Å; Y258-M271 HydrophobicContact CE1-CE 4.35Å; Y258-M271 HydrophobicContact CE2-CB 3.92Å; Y258-M271 HydrophobicContact CG-CB 4.03Å; Y258-M271 HydrophobicContact CG-CG 3.83Å; P266-M271 HydrophobicContact CB-CG 3.64Å; P266-M271 HydrophobicContact CB-SD 3.74Å; P266-M271 HydrophobicContact CG-CE 4.3Å; P266-M271 HydrophobicContact CG-CG 3.48Å; P266-M271 VanDerWaalsContact CG-CG 3.48Å; P266-M271 HydrophobicContact CG-SD 3.54Å; P266-M271 VanDerWaalsContact CG-SD 3.54Å; D267-M271 WeakPolarHBondContact O-CG 3.47Å; D267-M271 PolarHBondContact O-N 3.47Å; E268-M271 WeakPolarHBondContact O-CB 3.45Å; E268-M271 PolarHBondContact O-N 3.28Å; C269-M271 VanDerWaalsContact C-N 3.32Å; C269-M271 PolarHBondContact O-N 3.15Å; M271-I273 PolarHBondContact O-N 3.36Å; M271-S274 PolarHBondContact O-N 2.68Å; M271-H275 WeakPolarHBondContact O-CB 3.44Å; M271-H275 PolarHBondContact O-CD2 3.5Å; M271-H275 VanDerWaalsContact O-CD2 3.28Å; M271-H275 PolarHBondContact O-N 3.45Å
272	Y	97.5	Very high	92.9	Very high	16 Å²	16	77.1 Å²	77.1	6%	0.063	40%	0.395	C	S	.	.	H	α-helix	trans	-60.6	-47.4	179.3	-69.6	-21.4	0	0	0	112.5	V243 Y258 E268 C269 E276 F286 K290	V243-Y272 HydrophobicContact CG2-CD2 4.4Å; V243-Y272 HydrophobicContact CG2-CE2 3.86Å; Y258-Y272 HydrophobicContact CD2-CE1 4.21Å; Y258-Y272 HydrophobicContact CE2-CD1 4.02Å; Y258-Y272 AromaticContact CE2-CE1 3.59Å; Y258-Y272 HydrophobicContact CE2-CE1 3.59Å; E268-Y272 HydrophobicContact CG-CD2 3.93Å; E268-Y272 HydrophobicContact CG-CE1 4.21Å; E268-Y272 HydrophobicContact CG-CE2 3.31Å; E268-Y272 VanDerWaalsContact CG-CZ 3.44Å; E268-Y272 PolarHBondContact O-N 2.8Å; E268-Y272 WeakPolarHBondContact OE1-CE2 3.35Å; E268-Y272 VanDerWaalsContact OE1-CZ 3.3Å; E268-Y272 PolarHBondContact OE1-OH 2.99Å; C269-Y272 PolarHBondContact O-N 3.22Å; Y272-E276 WeakPolarHBondContact O-CB 3.48Å; Y272-E276 PolarHBondContact O-N 3.21Å; Y272-F286 HydrophobicContact CD1-CB 3.75Å; Y272-F286 HydrophobicContact CD1-CD1 4.49Å; Y272-F286 AromaticContact CD1-CD2 3.57Å; Y272-F286 HydrophobicContact CD1-CD2 3.57Å; Y272-F286 HydrophobicContact CD1-CE2 4.16Å; Y272-F286 AromaticContact CD1-CG 3.72Å; Y272-F286 HydrophobicContact CD1-CG 3.72Å; Y272-F286 HydrophobicContact CE1-CB 4.29Å; Y272-F286 HydrophobicContact CE1-CD2 4.28Å; Y272-F286 HydrophobicContact CE1-CG 4.15Å; Y272-F286 HydrophobicContact CG-CB 4.3Å; Y272-K290 VanDerWaalsContact CE2-NZ 3.29Å; Y272-K290 PolarHBondContact OH-NZ 3.43Å
273	I	96.8	Very high	92.7	Very high	47 Å²	47	73.9 Å²	73.9	24%	0.241	38%	0.379	C	S	.	.	H	α-helix	trans	-67.4	-43.5	-178.6	-67.3	167.5	0	0	0	111	C248 C269 M271 E276 R277 I287	C248-I273 HydrophobicContact CB-CD1 4.16Å; C248-I273 HydrophobicContact CB-CG1 4.38Å; C269-I273 WeakPolarHBondContact O-CB 3.49Å; C269-I273 VanDerWaalsContact O-CG1 3.28Å; C269-I273 WeakPolarHBondContact O-CG1 3.34Å; C269-I273 PolarHBondContact O-N 2.89Å; M271-I273 PolarHBondContact O-N 3.36Å; I273-E276 PolarHBondContact O-N 3.03Å; I273-R277 WeakPolarHBondContact O-CB 3.42Å; I273-R277 WeakPolarHBondContact O-CG 3.32Å; I273-R277 PolarHBondContact O-N 2.88Å; I273-I287 HydrophobicContact CG1-CD1 4.48Å
274	S	95.9	Very high	92.9	Very high	79 Å²	79	71 Å²	71	55%	0.552	36%	0.357	S	S	*	.	H	α-helix	trans	-58.9	-50.4	178.1	178.1	0	0	0	0	111.4	A270 M271 R277 G278	A270-S274 WeakPolarHBondContact O-CB 3.36Å; A270-S274 PolarHBondContact O-N 3.39Å; M271-S274 PolarHBondContact O-N 2.68Å; S274-R277 PolarHBondContact O-N 3.09Å; S274-G278 PolarHBondContact O-N 3.01Å
275	H	96.4	Very high	93	Very high	36 Å²	36	60.4 Å²	60.4	17%	0.167	32%	0.317	C	S	.	.	H	α-helix	trans	-66.6	-42.9	178.7	-81.7	-117	0	0	0	112.1	M271 R277 G278 H283 H284 F286	M271-H275 WeakPolarHBondContact O-CB 3.44Å; M271-H275 PolarHBondContact O-CD2 3.5Å; M271-H275 VanDerWaalsContact O-CD2 3.28Å; M271-H275 PolarHBondContact O-N 3.45Å; H275-R277 VanDerWaalsContact C-N 3.26Å; H275-R277 PolarHBondContact O-N 2.95Å; H275-G278 PolarHBondContact O-N 3.18Å; H275-H283 HydrophobicContact CB-CB 4.41Å; H275-H284 CarbonylContact C-O 3.1Å; H275-H284 AromaticContact ND1-CD2 3.63Å; H275-H284 PolarHBondContact ND1-N 2.89Å; H275-F286 HydrophobicContact CB-CD2 3.56Å; H275-F286 HydrophobicContact CB-CE2 3.52Å; H275-F286 AromaticContact CG-CE2 3.51Å; H275-F286 AromaticContact ND1-CE2 3.64Å
276	E	96.3	Very high	93.1	Very high	29 Å²	29	59.6 Å²	59.6	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-37.1	178.9	-175	66.1	-154.1	0	0	111.9	Y272 I273 G278 H284 R285 F286 I287 T288	Y272-E276 WeakPolarHBondContact O-CB 3.48Å; Y272-E276 PolarHBondContact O-N 3.21Å; I273-E276 PolarHBondContact O-N 3.03Å; E276-G278 VanDerWaalsContact C-N 3.33Å; E276-H284 PolarHBondContact N-O 2.76Å; E276-R285 PolarHBondContact O-NH1 3.18Å; E276-R285 VanDerWaalsContact OE2-CA 3.24Å; E276-R285 WeakPolarHBondContact OE2-CA 3.35Å; E276-F286 PolarHBondContact OE2-N 2.84Å; E276-I287 HydrophobicContact CB-CB 4.49Å; E276-I287 HydrophobicContact CB-CD1 4.08Å; E276-I287 HydrophobicContact CB-CG1 4.35Å; E276-I287 HydrophobicContact CG-CB 3.95Å; E276-I287 HydrophobicContact CG-CD1 4.06Å; E276-I287 HydrophobicContact CG-CG1 4.29Å; E276-I287 WeakPolarHBondContact OE2-CB 3.44Å; E276-I287 PolarHBondContact OE2-N 3.14Å; E276-T288 PolarHBondContact OE1-OG1 3.5Å; E276-T288 PolarHBondContact OE2-N 3.32Å; E276-T288 VanDerWaalsContact OE2-N 3.15Å
277	R	94.6	Very high	93.1	Very high	190 Å²	190	57.3 Å²	57.3	72%	0.717	29%	0.29	S	S	*	.	H	α-helix	trans	-85	-5.6	179.1	-68	177.5	179.2	174.4	2	113.7	I273 S274 H275	I273-R277 WeakPolarHBondContact O-CB 3.42Å; I273-R277 WeakPolarHBondContact O-CG 3.32Å; I273-R277 PolarHBondContact O-N 2.88Å; S274-R277 PolarHBondContact O-N 3.09Å; H275-R277 VanDerWaalsContact C-N 3.26Å; H275-R277 PolarHBondContact O-N 2.95Å
278	G	92.2	Very high	93.1	Very high	15 Å²	15	55.6 Å²	55.6	16%	0.155	28%	0.281	C	S	.	.			trans	-53.4	139.8	178.8	0	0	0	0	0	112.9	S274 H275 E276 H283 R285	S274-G278 PolarHBondContact O-N 3.01Å; H275-G278 PolarHBondContact O-N 3.18Å; E276-G278 VanDerWaalsContact C-N 3.33Å; G278-H283 VanDerWaalsContact C-CD2 3.5Å; G278-H283 PolarHBondContact O-CE1 3.43Å; G278-H283 VanDerWaalsContact O-CE1 3.31Å; G278-H283 PolarHBondContact O-NE2 3.36Å; G278-R285 PolarHBondContact O-NH1 3.18Å; G278-R285 PolarHBondContact O-NH2 3.07Å
279	K	85.1	Confident	93.1	Very high	183 Å²	183	55.7 Å²	55.7	80%	0.796	28%	0.282	S	S	*	.			trans	-120	-10	178.6	-63	-174.8	-179.9	-179.4	0	113.7	H283	K279-H283 PolarHBondContact N-NE2 2.77Å
280	R	78	Confident	93.1	Very high	225 Å²	225	56.1 Å²	56.1	85%	0.849	28%	0.283	S	S	*	.	S	Bend	trans	-146.3	120.1	-176.1	-67.9	-175.3	-179.5	169.4	0	111.1	H283	R280-H283 PolarHBondContact N-NE2 3.05Å
281	G	72.2	Confident	93.2	Very high	29 Å²	29	57.5 Å²	57.5	30%	0.299	28%	0.277	S	S	.	.	S	Bend	trans	59.8	176.9	166.6	0	0	0	0	0	115.1	N217 H283	N217-G281 PolarHBondContact ND2-N 3.41Å; G281-H283 WeakPolarHBondContact O-CB 3.4Å; G281-H283 PolarHBondContact O-CD2 3.37Å; G281-H283 VanDerWaalsContact O-CG 3.25Å; G281-H283 PolarHBondContact O-N 3.3Å
282	S	81.3	Confident	93.2	Very high	104 Å²	104	55.6 Å²	55.6	73%	0.727	27%	0.267	S	S	*	.	S	Bend	trans	14.8	37.3	172.3	-148.6	0	0	0	0	120.5
283	H	92.7	Very high	93.3	Very high	11 Å²	11	55 Å²	55	5%	0.051	27%	0.265	C	S	.	.			trans	-126.6	158.1	179.2	68.3	70.2	0	0	0	110.5	W219 H275 G278 K279 R280 G281 R285	W219-H283 PolarHBondContact N-O 3.27Å; H275-H283 HydrophobicContact CB-CB 4.41Å; G278-H283 VanDerWaalsContact C-CD2 3.5Å; G278-H283 PolarHBondContact O-CE1 3.43Å; G278-H283 VanDerWaalsContact O-CE1 3.31Å; G278-H283 PolarHBondContact O-NE2 3.36Å; K279-H283 PolarHBondContact N-NE2 2.77Å; R280-H283 PolarHBondContact N-NE2 3.05Å; G281-H283 WeakPolarHBondContact O-CB 3.4Å; G281-H283 PolarHBondContact O-CD2 3.37Å; G281-H283 VanDerWaalsContact O-CG 3.25Å; G281-H283 PolarHBondContact O-N 3.3Å; H283-R285 PolarHBondContact CE1-NH2 3.31Å
284	H	96.1	Very high	93.3	Very high	41 Å²	41	53.1 Å²	53.1	19%	0.19	26%	0.257	C	S	.	.			trans	-118.2	159.7	-177.5	-60	-65.5	0	0	0	109.4	W219 H275 E276 F286	W219-H284 WeakPolarHBondContact O-CA 3.46Å; W219-H284 PolarHBondContact O-ND1 3.48Å; H275-H284 CarbonylContact C-O 3.1Å; H275-H284 AromaticContact ND1-CD2 3.63Å; H275-H284 PolarHBondContact ND1-N 2.89Å; E276-H284 PolarHBondContact N-O 2.76Å; H284-F286 HydrophobicContact CB-CD1 3.74Å; H284-F286 HydrophobicContact CB-CD2 4.06Å; H284-F286 HydrophobicContact CB-CE1 3.51Å; H284-F286 HydrophobicContact CB-CE2 3.9Å; H284-F286 HydrophobicContact CB-CG 4.03Å; H284-F286 HydrophobicContact CB-CZ 3.62Å; H284-F286 AromaticContact CD2-CE1 3.76Å; H284-F286 AromaticContact CD2-CZ 3.37Å; H284-F286 WeakPolarHBondContact CD2-CZ 3.21Å; H284-F286 AromaticContact CG-CE1 3.77Å; H284-F286 AromaticContact CG-CZ 3.76Å; H284-F286 PolarHBondContact O-N 3.28Å
285	R	96.6	Very high	93.4	Very high	27 Å²	27	52.9 Å²	52.9	10%	0.102	25%	0.25	C	C	.	.			trans	-101.9	57.8	174.8	-58.9	-67.2	-172.7	-165.3	-9.2	109.5	F205 S216 E276 G278 H283 I287 T288 E289	F205-R285 HydrophobicContact CZ-CB 4.1Å; F205-R285 HydrophobicContact CZ-CG 4.27Å; S216-R285 PolarHBondContact O-NH2 3.09Å; E276-R285 PolarHBondContact O-NH1 3.18Å; E276-R285 VanDerWaalsContact OE2-CA 3.24Å; E276-R285 WeakPolarHBondContact OE2-CA 3.35Å; G278-R285 PolarHBondContact O-NH1 3.18Å; G278-R285 PolarHBondContact O-NH2 3.07Å; H283-R285 PolarHBondContact CE1-NH2 3.31Å; R285-I287 VanDerWaalsContact C-N 3.28Å; R285-I287 PolarHBondContact O-N 3.07Å; R285-T288 HydrophobicContact CB-CG2 4.46Å; R285-T288 CarbonylContact O-C 3.59Å; R285-T288 WeakPolarHBondContact O-CB 3.42Å; R285-T288 PolarHBondContact O-N 3.14Å; R285-T288 VanDerWaalsContact O-N 3.09Å; R285-E289 VanDerWaalsContact O-CG 3.32Å; R285-E289 WeakPolarHBondContact O-CG 3.24Å; R285-E289 PolarHBondContact O-N 3.17Å
286	F	97.4	Very high	93.5	Very high	11 Å²	11	51.8 Å²	51.8	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-55.7	-39.4	-169.8	-65	-56.8	0	0	0	114	Y258 Y272 H275 E276 H284 K290	Y258-F286 WeakPolarHBondContact OH-CZ 3.37Å; Y272-F286 HydrophobicContact CD1-CB 3.75Å; Y272-F286 HydrophobicContact CD1-CD1 4.49Å; Y272-F286 AromaticContact CD1-CD2 3.57Å; Y272-F286 HydrophobicContact CD1-CD2 3.57Å; Y272-F286 HydrophobicContact CD1-CE2 4.16Å; Y272-F286 AromaticContact CD1-CG 3.72Å; Y272-F286 HydrophobicContact CD1-CG 3.72Å; Y272-F286 HydrophobicContact CE1-CB 4.29Å; Y272-F286 HydrophobicContact CE1-CD2 4.28Å; Y272-F286 HydrophobicContact CE1-CG 4.15Å; Y272-F286 HydrophobicContact CG-CB 4.3Å; H275-F286 HydrophobicContact CB-CD2 3.56Å; H275-F286 HydrophobicContact CB-CE2 3.52Å; H275-F286 AromaticContact CG-CE2 3.51Å; H275-F286 AromaticContact ND1-CE2 3.64Å; E276-F286 PolarHBondContact OE2-N 2.84Å; H284-F286 HydrophobicContact CB-CD1 3.74Å; H284-F286 HydrophobicContact CB-CD2 4.06Å; H284-F286 HydrophobicContact CB-CE1 3.51Å; H284-F286 HydrophobicContact CB-CE2 3.9Å; H284-F286 HydrophobicContact CB-CG 4.03Å; H284-F286 HydrophobicContact CB-CZ 3.62Å; H284-F286 AromaticContact CD2-CE1 3.76Å; H284-F286 AromaticContact CD2-CZ 3.37Å; H284-F286 WeakPolarHBondContact CD2-CZ 3.21Å; H284-F286 AromaticContact CG-CE1 3.77Å; H284-F286 AromaticContact CG-CZ 3.76Å; H284-F286 PolarHBondContact O-N 3.28Å; F286-K290 WeakPolarHBondContact O-CB 3.26Å; F286-K290 VanDerWaalsContact O-CG 3.27Å; F286-K290 WeakPolarHBondContact O-CG 3.3Å; F286-K290 PolarHBondContact O-N 2.91Å; F286-K290 VanDerWaalsContact O-N 3.08Å
287	I	97.8	Very high	93.6	Very high	12 Å²	12	51.2 Å²	51.2	6%	0.062	24%	0.244	C	C	.	.	H	α-helix	trans	-75.6	-40.2	-179.9	-63.5	172.4	0	0	0	109.4	P245 I273 E276 R285 K290 R291	P245-I287 WeakPolarHBondContact O-CG2 3.24Å; I273-I287 HydrophobicContact CG1-CD1 4.48Å; E276-I287 HydrophobicContact CB-CB 4.49Å; E276-I287 HydrophobicContact CB-CD1 4.08Å; E276-I287 HydrophobicContact CB-CG1 4.35Å; E276-I287 HydrophobicContact CG-CB 3.95Å; E276-I287 HydrophobicContact CG-CD1 4.06Å; E276-I287 HydrophobicContact CG-CG1 4.29Å; E276-I287 WeakPolarHBondContact OE2-CB 3.44Å; E276-I287 PolarHBondContact OE2-N 3.14Å; R285-I287 VanDerWaalsContact C-N 3.28Å; R285-I287 PolarHBondContact O-N 3.07Å; I287-K290 PolarHBondContact O-N 3.09Å; I287-R291 WeakPolarHBondContact O-CG 3.37Å; I287-R291 PolarHBondContact O-N 2.74Å; I287-R291 VanDerWaalsContact O-N 3.08Å
288	T	97.8	Very high	93.6	Very high	9 Å²	9	45.8 Å²	45.8	6%	0.055	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-47.4	172.8	-64.1	0	0	0	0	111.5	F205 T209 K211 E276 R285 K290 R291 A292	F205-T288 HydrophobicContact CE2-CG2 4.29Å; F205-T288 HydrophobicContact CZ-CG2 4.13Å; T209-T288 VanDerWaalsContact CB-CG2 3.5Å; T209-T288 HydrophobicContact CG2-CG2 3.56Å; K211-T288 HydrophobicContact CD-CG2 3.92Å; E276-T288 PolarHBondContact OE1-OG1 3.5Å; E276-T288 PolarHBondContact OE2-N 3.32Å; E276-T288 VanDerWaalsContact OE2-N 3.15Å; R285-T288 HydrophobicContact CB-CG2 4.46Å; R285-T288 CarbonylContact O-C 3.59Å; R285-T288 WeakPolarHBondContact O-CB 3.42Å; R285-T288 PolarHBondContact O-N 3.14Å; R285-T288 VanDerWaalsContact O-N 3.09Å; T288-K290 PolarHBondContact O-N 3.1Å; T288-R291 WeakPolarHBondContact O-CB 3.4Å; T288-R291 PolarHBondContact O-N 3.19Å; T288-R291 VanDerWaalsContact O-N 3.16Å; T288-A292 PolarHBondContact O-N 3.4Å
289	E	98.4	Very high	93.8	Very high	3 Å²	3	50.3 Å²	50.3	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-45.9	177.8	-69.6	175.7	-171.1	0	0	111	F205 S221 W224 R285 R291 A292 F293	F205-E289 HydrophobicContact CD2-CG 4.38Å; F205-E289 HydrophobicContact CE2-CG 3.81Å; S221-E289 WeakPolarHBondContact CB-OE2 3.08Å; S221-E289 PolarHBondContact N-OE1 3.29Å; S221-E289 PolarHBondContact OG-OE2 3.13Å; W224-E289 HydrophobicContact CB-CG 4.39Å; W224-E289 HydrophobicContact CD2-CG 4.43Å; W224-E289 HydrophobicContact CE3-CB 3.96Å; W224-E289 HydrophobicContact CE3-CG 3.7Å; W224-E289 HydrophobicContact CZ3-CG 4.41Å; R285-E289 VanDerWaalsContact O-CG 3.32Å; R285-E289 WeakPolarHBondContact O-CG 3.24Å; R285-E289 PolarHBondContact O-N 3.17Å; E289-R291 VanDerWaalsContact C-N 3.27Å; E289-R291 PolarHBondContact O-N 2.85Å; E289-A292 WeakPolarHBondContact O-CB 3.46Å; E289-A292 PolarHBondContact O-N 3.05Å; E289-F293 HydrophobicContact CB-CE1 4.48Å; E289-F293 HydrophobicContact CB-CE2 4.12Å; E289-F293 HydrophobicContact CB-CZ 3.86Å; E289-F293 WeakPolarHBondContact O-CD1 3.39Å; E289-F293 VanDerWaalsContact O-CG 3.3Å; E289-F293 WeakPolarHBondContact O-CG 3.48Å; E289-F293 PolarHBondContact O-N 2.84Å
290	K	98.4	Very high	94.4	Very high	13 Å²	13	46.7 Å²	46.7	6%	0.057	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-34.7	175.9	-75.4	176.5	173.5	82.2	0	113.1	M242 V243 P245 Y272 F286 I287 T288 A292 F293 A294	M242-K290 HydrophobicContact SD-CG 4.41Å; V243-K290 WeakPolarHBondContact O-CD 3.13Å; V243-K290 WeakPolarHBondContact O-CE 3.39Å; P245-K290 HydrophobicContact CB-CB 4.23Å; P245-K290 HydrophobicContact CG-CB 4.01Å; Y272-K290 VanDerWaalsContact CE2-NZ 3.29Å; Y272-K290 PolarHBondContact OH-NZ 3.43Å; F286-K290 WeakPolarHBondContact O-CB 3.26Å; F286-K290 VanDerWaalsContact O-CG 3.27Å; F286-K290 WeakPolarHBondContact O-CG 3.3Å; F286-K290 PolarHBondContact O-N 2.91Å; F286-K290 VanDerWaalsContact O-N 3.08Å; I287-K290 PolarHBondContact O-N 3.09Å; T288-K290 PolarHBondContact O-N 3.1Å; K290-A292 VanDerWaalsContact C-N 3.35Å; K290-F293 HydrophobicContact CG-CD2 4.36Å; K290-F293 PolarHBondContact O-N 2.81Å; K290-A294 WeakPolarHBondContact O-CB 3.45Å; K290-A294 PolarHBondContact O-N 3.19Å
291	R	98.1	Very high	95.3	Very high	85 Å²	85	39.5 Å²	39.5	32%	0.321	21%	0.211	S	C	.	.	H	α-helix	trans	-63.8	-40.2	174	-70.8	-174.5	-177.4	108.9	10.2	112	P245 D246 I287 T288 E289 F293 A294 N295	P245-R291 HydrophobicContact CB-CG 3.64Å; P245-R291 HydrophobicContact CG-CG 4.03Å; D246-R291 IonicContact OD1-NH2 3.46Å; D246-R291 PolarHBondContact OD1-NH2 3.35Å; I287-R291 WeakPolarHBondContact O-CG 3.37Å; I287-R291 PolarHBondContact O-N 2.74Å; I287-R291 VanDerWaalsContact O-N 3.08Å; T288-R291 WeakPolarHBondContact O-CB 3.4Å; T288-R291 PolarHBondContact O-N 3.19Å; T288-R291 VanDerWaalsContact O-N 3.16Å; E289-R291 VanDerWaalsContact C-N 3.27Å; E289-R291 PolarHBondContact O-N 2.85Å; R291-F293 VanDerWaalsContact C-N 3.35Å; R291-A294 PolarHBondContact O-N 3.16Å; R291-N295 VanDerWaalsContact O-CG 3.29Å; R291-N295 PolarHBondContact O-N 3.28Å; R291-N295 PolarHBondContact O-OD1 2.65Å
292	A	98.3	Very high	96.6	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.017	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-42.7	173.2	0	0	0	0	0	111	E208 T209 W224 T288 E289 K290 A294 N295 W296	E208-A292 HydrophobicContact CB-CB 4.14Å; T209-A292 HydrophobicContact CG2-CB 4.28Å; W224-A292 HydrophobicContact CH2-CB 4.13Å; W224-A292 HydrophobicContact CZ3-CB 3.72Å; T288-A292 PolarHBondContact O-N 3.4Å; E289-A292 WeakPolarHBondContact O-CB 3.46Å; E289-A292 PolarHBondContact O-N 3.05Å; K290-A292 VanDerWaalsContact C-N 3.35Å; A292-A294 VanDerWaalsContact C-N 3.33Å; A292-A294 PolarHBondContact O-N 3.08Å; A292-N295 CarbonylContact O-C 3.58Å; A292-N295 WeakPolarHBondContact O-CA 3.48Å; A292-N295 WeakPolarHBondContact O-CB 3.45Å; A292-N295 PolarHBondContact O-N 2.88Å; A292-W296 HydrophobicContact CB-CZ2 4.49Å; A292-W296 VanDerWaalsContact O-CG 3.28Å; A292-W296 PolarHBondContact O-N 3.14Å
293	F	98.6	Very high	97.4	Very high	4 Å²	4	37 Å²	37	2%	0.018	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-39.8	177.1	-51.6	-23.5	0	0	0	112.3	W224 M227 M242 E289 K290 R291 N295 W296 A297 F304	W224-F293 HydrophobicContact CD2-CE1 4.45Å; W224-F293 AromaticContact CE3-CE1 3.59Å; W224-F293 HydrophobicContact CE3-CE1 3.59Å; W224-F293 AromaticContact CE3-CZ 3.99Å; W224-F293 HydrophobicContact CE3-CZ 3.99Å; W224-F293 AromaticContact CZ3-CE1 3.96Å; W224-F293 HydrophobicContact CZ3-CE1 3.96Å; M227-F293 HydrophobicContact CB-CD1 4.08Å; M227-F293 HydrophobicContact CB-CE1 3.73Å; M227-F293 HydrophobicContact CB-CZ 4.05Å; M227-F293 HydrophobicContact CE-CB 4.39Å; M227-F293 HydrophobicContact CE-CD1 4.49Å; M227-F293 HydrophobicContact CE-CG 4.34Å; M227-F293 HydrophobicContact CG-CD1 4.06Å; M227-F293 HydrophobicContact CG-CD2 4.11Å; M227-F293 HydrophobicContact CG-CE1 3.85Å; M227-F293 HydrophobicContact CG-CE2 3.91Å; M227-F293 HydrophobicContact CG-CG 4.19Å; M227-F293 HydrophobicContact CG-CZ 3.78Å; M242-F293 HydrophobicContact CE-CD2 4.14Å; M242-F293 HydrophobicContact CE-CE2 4.17Å; M242-F293 HydrophobicContact SD-CD2 3.63Å; M242-F293 HydrophobicContact SD-CE2 4.2Å; E289-F293 HydrophobicContact CB-CE1 4.48Å; E289-F293 HydrophobicContact CB-CE2 4.12Å; E289-F293 HydrophobicContact CB-CZ 3.86Å; E289-F293 WeakPolarHBondContact O-CD1 3.39Å; E289-F293 VanDerWaalsContact O-CG 3.3Å; E289-F293 WeakPolarHBondContact O-CG 3.48Å; E289-F293 PolarHBondContact O-N 2.84Å; K290-F293 HydrophobicContact CG-CD2 4.36Å; K290-F293 PolarHBondContact O-N 2.81Å; R291-F293 VanDerWaalsContact C-N 3.35Å; F293-N295 VanDerWaalsContact C-N 3.29Å; F293-N295 PolarHBondContact O-N 3.03Å; F293-W296 HydrophobicContact CD1-CD2 4.48Å; F293-W296 AromaticContact CD1-CE3 3.6Å; F293-W296 HydrophobicContact CD1-CE3 3.6Å; F293-W296 HydrophobicContact CD1-CH2 4.16Å; F293-W296 AromaticContact CD1-CZ3 3.41Å; F293-W296 HydrophobicContact CD1-CZ3 3.41Å; F293-W296 VanDerWaalsContact CD1-CZ3 3.41Å; F293-W296 HydrophobicContact CE1-CE3 4.26Å; F293-W296 HydrophobicContact CE1-CH2 4.08Å; F293-W296 AromaticContact CE1-CZ3 3.59Å; F293-W296 HydrophobicContact CE1-CZ3 3.59Å; F293-W296 PolarHBondContact O-N 2.99Å; F293-A297 WeakPolarHBondContact O-CB 3.43Å; F293-A297 PolarHBondContact O-N 3.46Å; F293-F304 HydrophobicContact CB-CZ 4.16Å
294	A	98.1	Very high	97.7	Very high	8 Å²	8	36.7 Å²	36.7	7%	0.066	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-34.8	172.8	0	0	0	0	0	112	P245 K290 R291 A292 R298 W309 P311	P245-A294 HydrophobicContact CG-CB 4.06Å; K290-A294 WeakPolarHBondContact O-CB 3.45Å; K290-A294 PolarHBondContact O-N 3.19Å; R291-A294 PolarHBondContact O-N 3.16Å; A292-A294 VanDerWaalsContact C-N 3.33Å; A292-A294 PolarHBondContact O-N 3.08Å; A294-R298 PolarHBondContact O-NH1 3.39Å; A294-W309 HydrophobicContact CB-CH2 4.21Å; A294-W309 HydrophobicContact CB-CZ3 3.94Å; A294-P311 HydrophobicContact CB-CB 4.34Å; A294-P311 VanDerWaalsContact O-CB 3.3Å; A294-P311 WeakPolarHBondContact O-CB 3.47Å; A294-P311 VanDerWaalsContact O-CG 3.26Å; A294-P311 WeakPolarHBondContact O-CG 3.23Å
295	N	97.3	Very high	97.8	Very high	74 Å²	74	36.1 Å²	36.1	40%	0.396	18%	0.176	S	C	.	.	H	α-helix	trans	-68.6	-43.8	172.6	-67.6	-13	0	0	0	111.7	R291 A292 F293 A297 R298	R291-N295 VanDerWaalsContact O-CG 3.29Å; R291-N295 PolarHBondContact O-N 3.28Å; R291-N295 PolarHBondContact O-OD1 2.65Å; A292-N295 CarbonylContact O-C 3.58Å; A292-N295 WeakPolarHBondContact O-CA 3.48Å; A292-N295 WeakPolarHBondContact O-CB 3.45Å; A292-N295 PolarHBondContact O-N 2.88Å; F293-N295 VanDerWaalsContact C-N 3.29Å; F293-N295 PolarHBondContact O-N 3.03Å; N295-A297 VanDerWaalsContact C-N 3.31Å; N295-A297 PolarHBondContact O-N 3.01Å; N295-R298 WeakPolarHBondContact O-CB 3.29Å; N295-R298 PolarHBondContact O-N 3.47Å; N295-R298 VanDerWaalsContact O-N 3.09Å; N295-R298 PolarHBondContact OD1-NH1 3.49Å
296	W	98	Very high	97.8	Very high	12 Å²	12	35.7 Å²	35.7	5%	0.045	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-39.7	176.5	-63.9	-14.5	0	0	0	112.2	L204 E208 W224 M227 L231 A292 F293 R298 T299 F300 I302	L204-W296 HydrophobicContact CD2-CH2 4.38Å; L204-W296 HydrophobicContact CD2-CZ2 4.19Å; L204-W296 HydrophobicContact CG-CZ2 4.45Å; E208-W296 HydrophobicContact CG-CZ2 3.99Å; E208-W296 PolarHBondContact OE2-NE1 2.64Å; W224-W296 HydrophobicContact CE3-CH2 4.39Å; W224-W296 AromaticContact CH2-CH2 3.71Å; W224-W296 HydrophobicContact CH2-CH2 3.71Å; W224-W296 AromaticContact CH2-CZ2 3.68Å; W224-W296 HydrophobicContact CH2-CZ2 3.68Å; W224-W296 HydrophobicContact CZ2-CH2 4Å; W224-W296 HydrophobicContact CZ2-CZ2 4.15Å; W224-W296 AromaticContact CZ3-CH2 3.93Å; W224-W296 HydrophobicContact CZ3-CH2 3.93Å; W224-W296 HydrophobicContact CZ3-CZ2 4.2Å; M227-W296 HydrophobicContact CB-CZ3 3.98Å; L231-W296 HydrophobicContact CD1-CD2 3.81Å; L231-W296 HydrophobicContact CD1-CE3 3.56Å; L231-W296 HydrophobicContact CD1-CG 4.35Å; L231-W296 HydrophobicContact CD1-CH2 4.37Å; L231-W296 HydrophobicContact CD1-CZ3 3.86Å; A292-W296 HydrophobicContact CB-CZ2 4.49Å; A292-W296 VanDerWaalsContact O-CG 3.28Å; A292-W296 PolarHBondContact O-N 3.14Å; F293-W296 HydrophobicContact CD1-CD2 4.48Å; F293-W296 AromaticContact CD1-CE3 3.6Å; F293-W296 HydrophobicContact CD1-CE3 3.6Å; F293-W296 HydrophobicContact CD1-CH2 4.16Å; F293-W296 AromaticContact CD1-CZ3 3.41Å; F293-W296 HydrophobicContact CD1-CZ3 3.41Å; F293-W296 VanDerWaalsContact CD1-CZ3 3.41Å; F293-W296 HydrophobicContact CE1-CE3 4.26Å; F293-W296 HydrophobicContact CE1-CH2 4.08Å; F293-W296 AromaticContact CE1-CZ3 3.59Å; F293-W296 HydrophobicContact CE1-CZ3 3.59Å; F293-W296 PolarHBondContact O-N 2.99Å; W296-R298 PolarHBondContact O-N 2.91Å; W296-R298 VanDerWaalsContact O-N 3.1Å; W296-T299 PolarHBondContact O-N 3.19Å; W296-F300 HydrophobicContact CB-CD2 3.95Å; W296-F300 HydrophobicContact CB-CE2 4.44Å; W296-F300 WeakPolarHBondContact O-CD2 3.21Å; W296-F300 PolarHBondContact O-N 3.34Å; W296-I302 HydrophobicContact CB-CD1 3.93Å
297	A	98.1	Very high	97.7	Very high	17 Å²	17	37 Å²	37	14%	0.14	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-6.5	177.2	0	0	0	0	0	114.6	F293 N295 I302 F304 P311	F293-A297 WeakPolarHBondContact O-CB 3.43Å; F293-A297 PolarHBondContact O-N 3.46Å; N295-A297 VanDerWaalsContact C-N 3.31Å; N295-A297 PolarHBondContact O-N 3.01Å; A297-I302 HydrophobicContact CB-CB 3.88Å; A297-I302 HydrophobicContact CB-CG2 4.34Å; A297-F304 HydrophobicContact CB-CE2 3.64Å; A297-F304 HydrophobicContact CB-CZ 4.34Å; A297-P311 HydrophobicContact CB-CG 3.94Å
298	R	96.3	Very high	97.7	Very high	77 Å²	77	42 Å²	42	29%	0.291	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-15.8	168	-62	-174.8	179.9	90.1	-9.9	113.1	A294 N295 W296 P311 P312	A294-R298 PolarHBondContact O-NH1 3.39Å; N295-R298 WeakPolarHBondContact O-CB 3.29Å; N295-R298 PolarHBondContact O-N 3.47Å; N295-R298 VanDerWaalsContact O-N 3.09Å; N295-R298 PolarHBondContact OD1-NH1 3.49Å; W296-R298 PolarHBondContact O-N 2.91Å; W296-R298 VanDerWaalsContact O-N 3.1Å; R298-P311 HydrophobicContact CG-CB 3.83Å; R298-P311 HydrophobicContact CG-CG 3.63Å; R298-P312 PolarHBondContact NE-O 3.21Å
299	T	95.1	Very high	97.7	Very high	110 Å²	110	43.5 Å²	43.5	68%	0.675	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118	-37.2	-173	-51.6	0	0	0	0	112.1	W296	W296-T299 PolarHBondContact O-N 3.19Å
300	F	97.4	Very high	97.6	Very high	106 Å²	106	48 Å²	48	47%	0.465	25%	0.248	S	C	.	.	S	Bend	trans	-107.1	156.4	-178.9	-57.4	-76.5	0	0	0	110.9	L231 W296 I302	L231-F300 HydrophobicContact CD1-CE2 4.48Å; L231-F300 HydrophobicContact CD2-CB 4.02Å; L231-F300 HydrophobicContact CD2-CD1 4.1Å; L231-F300 HydrophobicContact CD2-CD2 3.74Å; L231-F300 HydrophobicContact CD2-CE2 4.2Å; L231-F300 HydrophobicContact CD2-CG 3.69Å; W296-F300 HydrophobicContact CB-CD2 3.95Å; W296-F300 HydrophobicContact CB-CE2 4.44Å; W296-F300 WeakPolarHBondContact O-CD2 3.21Å; W296-F300 PolarHBondContact O-N 3.34Å; F300-I302 VanDerWaalsContact C-N 3.28Å; F300-I302 HydrophobicContact CB-CD1 4.08Å; F300-I302 HydrophobicContact CB-CG1 3.97Å; F300-I302 PolarHBondContact O-N 3.27Å
301	D	98.2	Very high	97.4	Very high	74 Å²	74	48.2 Å²	48.2	40%	0.396	25%	0.251	S	S	.	.			trans	-74.5	79.4	177.2	-170.8	-2	0	0	0	110.8	R236 I237 H303	R236-D301 HydrophobicContact CB-CB 4.44Å; R236-D301 VanDerWaalsContact CD-OD2 3.25Å; R236-D301 WeakPolarHBondContact CD-OD2 3.4Å; R236-D301 HydrophobicContact CG-CB 4.39Å; R236-D301 WeakPolarHBondContact CG-OD2 3.29Å; R236-D301 IonicContact NE-OD1 3.91Å; R236-D301 PolarHBondContact NE-OD1 3.28Å; R236-D301 IonicContact NE-OD2 3.7Å; I237-D301 PolarHBondContact N-O 2.86Å; D301-H303 IonicContact OD1-CD2 2.84Å; D301-H303 PolarHBondContact OD1-CD2 3.42Å; D301-H303 IonicContact OD1-CE1 3.59Å; D301-H303 IonicContact OD1-NE2 3.08Å; D301-H303 PolarHBondContact OD1-NE2 2.86Å
302	I	98.7	Very high	96.9	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.051	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.2	-179.9	-51.4	177.3	0	0	0	109.3	M227 L231 I237 V239 W296 A297 F300 F304	M227-I302 HydrophobicContact CE-CD1 4.17Å; M227-I302 HydrophobicContact CE-CG2 4.28Å; L231-I302 HydrophobicContact CD2-CD1 4.1Å; I237-I302 HydrophobicContact CB-CG1 4.32Å; I237-I302 HydrophobicContact CB-CG2 4.48Å; I237-I302 HydrophobicContact CD1-CG1 4.27Å; I237-I302 CarbonylContact O-C 3.56Å; I237-I302 VanDerWaalsContact O-CA 3.31Å; I237-I302 WeakPolarHBondContact O-CA 3.02Å; V239-I302 HydrophobicContact CG2-CG2 3.9Å; W296-I302 HydrophobicContact CB-CD1 3.93Å; A297-I302 HydrophobicContact CB-CB 3.88Å; A297-I302 HydrophobicContact CB-CG2 4.34Å; F300-I302 VanDerWaalsContact C-N 3.28Å; F300-I302 HydrophobicContact CB-CD1 4.08Å; F300-I302 HydrophobicContact CB-CG1 3.97Å; F300-I302 PolarHBondContact O-N 3.27Å; I302-F304 HydrophobicContact CG2-CE1 4.25Å; I302-F304 HydrophobicContact CG2-CE2 3.93Å; I302-F304 HydrophobicContact CG2-CZ 3.73Å
303	H	98.7	Very high	96.3	Very high	71 Å²	71	53.7 Å²	53.7	33%	0.329	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137	175.5	-59	-72.2	0	0	0	111.1	R236 I237 V239 D301 F305	R236-H303 PolarHBondContact NE-CD2 2.73Å; R236-H303 PolarHBondContact NE-NE2 3.44Å; R236-H303 PolarHBondContact NH2-CD2 2.93Å; R236-H303 PolarHBondContact NH2-NE2 3.02Å; I237-H303 PolarHBondContact O-N 3.03Å; V239-H303 PolarHBondContact N-O 2.9Å; D301-H303 IonicContact OD1-CD2 2.84Å; D301-H303 PolarHBondContact OD1-CD2 3.42Å; D301-H303 IonicContact OD1-CE1 3.59Å; D301-H303 IonicContact OD1-NE2 3.08Å; D301-H303 PolarHBondContact OD1-NE2 2.86Å; H303-F305 HydrophobicContact CB-CE2 3.67Å; H303-F305 HydrophobicContact CB-CZ 3.89Å
304	F	98.8	Very high	95.3	Very high	5 Å²	5	59 Å²	59	2%	0.022	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.6	178.3	-59.4	-85.3	0	0	0	111.1	V239 M242 F293 A297 I302 D308 W309	V239-F304 HydrophobicContact CB-CD1 3.6Å; V239-F304 HydrophobicContact CB-CE1 3.91Å; V239-F304 HydrophobicContact CB-CG 4.46Å; V239-F304 HydrophobicContact CG1-CD1 3.68Å; V239-F304 HydrophobicContact CG1-CE1 3.92Å; V239-F304 HydrophobicContact CG2-CD1 4.16Å; V239-F304 HydrophobicContact CG2-CE1 3.97Å; V239-F304 CarbonylContact O-C 3.57Å; V239-F304 WeakPolarHBondContact O-CA 3.04Å; M242-F304 HydrophobicContact CB-CD1 4.16Å; M242-F304 HydrophobicContact CG-CD1 4.43Å; M242-F304 HydrophobicContact SD-CD1 4.17Å; M242-F304 HydrophobicContact SD-CE1 3.72Å; F293-F304 HydrophobicContact CB-CZ 4.16Å; A297-F304 HydrophobicContact CB-CE2 3.64Å; A297-F304 HydrophobicContact CB-CZ 4.34Å; I302-F304 HydrophobicContact CG2-CE1 4.25Å; I302-F304 HydrophobicContact CG2-CE2 3.93Å; I302-F304 HydrophobicContact CG2-CZ 3.73Å; F304-D308 WeakPolarHBondContact O-CA 3.42Å; F304-W309 HydrophobicContact CB-CD2 3.97Å; F304-W309 VanDerWaalsContact CB-CE2 3.48Å; F304-W309 HydrophobicContact CB-CG 4.18Å; F304-W309 HydrophobicContact CB-CZ2 3.9Å; F304-W309 AromaticContact CD1-CE2 3.93Å; F304-W309 HydrophobicContact CD1-CH2 4.01Å; F304-W309 AromaticContact CD1-CZ2 3.41Å; F304-W309 HydrophobicContact CD1-CZ2 3.41Å; F304-W309 VanDerWaalsContact CD1-CZ2 3.41Å; F304-W309 HydrophobicContact CD2-CD2 4.01Å; F304-W309 AromaticContact CD2-CE2 3.75Å; F304-W309 AromaticContact CD2-CE3 3.97Å; F304-W309 HydrophobicContact CD2-CE3 3.97Å; F304-W309 AromaticContact CD2-CH2 3.46Å; F304-W309 HydrophobicContact CD2-CH2 3.46Å; F304-W309 VanDerWaalsContact CD2-CH2 3.46Å; F304-W309 AromaticContact CD2-CZ2 3.5Å; F304-W309 HydrophobicContact CD2-CZ2 3.5Å; F304-W309 VanDerWaalsContact CD2-CZ2 3.5Å; F304-W309 AromaticContact CD2-CZ3 3.7Å; F304-W309 HydrophobicContact CD2-CZ3 3.7Å; F304-W309 AromaticContact CE1-CH2 3.93Å; F304-W309 HydrophobicContact CE1-CH2 3.93Å; F304-W309 AromaticContact CE1-CZ2 3.72Å; F304-W309 HydrophobicContact CE1-CZ2 3.72Å; F304-W309 HydrophobicContact CE2-CE3 4.44Å; F304-W309 AromaticContact CE2-CH2 3.35Å; F304-W309 HydrophobicContact CE2-CH2 3.35Å; F304-W309 AromaticContact CE2-CZ2 3.78Å; F304-W309 HydrophobicContact CE2-CZ2 3.78Å; F304-W309 AromaticContact CE2-CZ3 3.73Å; F304-W309 HydrophobicContact CE2-CZ3 3.73Å; F304-W309 HydrophobicContact CG-CD2 4.08Å; F304-W309 AromaticContact CG-CE2 3.44Å; F304-W309 VanDerWaalsContact CG-CE2 3.44Å; F304-W309 HydrophobicContact CG-CE3 4.48Å; F304-W309 AromaticContact CG-CH2 3.79Å; F304-W309 HydrophobicContact CG-CH2 3.79Å; F304-W309 AromaticContact CG-CZ2 3.3Å; F304-W309 HydrophobicContact CG-CZ2 3.3Å; F304-W309 HydrophobicContact CG-CZ3 4.35Å; F304-W309 AromaticContact CG-NE1 3.83Å; F304-W309 AromaticContact CZ-CH2 3.61Å; F304-W309 HydrophobicContact CZ-CH2 3.61Å; F304-W309 AromaticContact CZ-CZ2 3.9Å; F304-W309 HydrophobicContact CZ-CZ2 3.9Å; F304-W309 HydrophobicContact CZ-CZ3 4.41Å; F304-W309 PolarHBondContact O-N 3.48Å
305	F	98.3	Very high	94.3	Very high	29 Å²	29	64 Å²	64	13%	0.127	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	152.5	-177.7	-58.2	-83.5	0	0	0	111.5	N238 V239 Y240 G241 H303 P307 D308	N238-F305 HydrophobicContact CB-CD2 4.28Å; N238-F305 HydrophobicContact CB-CE2 3.73Å; V239-F305 PolarHBondContact O-N 3.43Å; Y240-F305 HydrophobicContact CD1-CB 4.04Å; Y240-F305 HydrophobicContact CD1-CD2 4.49Å; Y240-F305 HydrophobicContact CE1-CB 4.38Å; Y240-F305 HydrophobicContact CE1-CD2 4.29Å; Y240-F305 HydrophobicContact CE1-CG 4.42Å; Y240-F305 HydrophobicContact CE2-CD2 4.41Å; Y240-F305 HydrophobicContact CG-CB 4.5Å; G241-F305 PolarHBondContact N-O 3.15Å; H303-F305 HydrophobicContact CB-CE2 3.67Å; H303-F305 HydrophobicContact CB-CZ 3.89Å; F305-P307 VanDerWaalsContact C-C 3.49Å; F305-P307 CarbonylContact C-O 3.59Å; F305-P307 WeakPolarHBondContact CA-O 3.27Å; F305-D308 VanDerWaalsContact CD1-OD1 3.27Å; F305-D308 WeakPolarHBondContact CD1-OD1 3.3Å
306	Q	96.1	Very high	92.9	Very high	18 Å²	18	67.4 Å²	67.4	8%	0.084	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	71.6	179.3	-62.1	167.6	-96.2	0	0	112.1	H92 L93 R98 G241	H92-Q306 VanDerWaalsContact CB-O 3.23Å; H92-Q306 WeakPolarHBondContact CB-O 3.2Å; L93-Q306 PolarHBondContact O-NE2 2.76Å; R98-Q306 VanDerWaalsContact CD-OE1 3.22Å; G241-Q306 VanDerWaalsContact CA-O 3.29Å; G241-Q306 WeakPolarHBondContact CA-O 3.2Å
307	P	96	Very high	90.8	Very high	38 Å²	38	73.4 Å²	73.4	25%	0.247	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	cis	-80.2	159.2	-3.4	32.8	-34.6	0	0	0	113.1	V243 F247 F305	V243-P307 HydrophobicContact CG1-CG 4.09Å; F247-P307 HydrophobicContact CE2-CG 4.42Å; F305-P307 VanDerWaalsContact C-C 3.49Å; F305-P307 CarbonylContact C-O 3.59Å; F305-P307 WeakPolarHBondContact CA-O 3.27Å
308	D	96.8	Very high	88.3	Confident	116 Å²	116	83.6 Å²	83.6	62%	0.62	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	126.2	173.7	-65.3	-112.5	0	0	0	110.2	F304 F305	F304-D308 WeakPolarHBondContact O-CA 3.42Å; F305-D308 VanDerWaalsContact CD1-OD1 3.27Å; F305-D308 WeakPolarHBondContact CD1-OD1 3.3Å
309	W	97.3	Very high	85.7	Confident	41 Å²	41	84.3 Å²	84.3	16%	0.155	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-158	158.6	173.5	60.8	-84.7	0	0	0	111.6	M242 A244 A294 F304	M242-W309 PolarHBondContact O-NE1 2.86Å; A244-W309 HydrophobicContact CB-CD2 3.74Å; A244-W309 HydrophobicContact CB-CE3 4.03Å; A244-W309 HydrophobicContact CB-CG 3.95Å; A294-W309 HydrophobicContact CB-CH2 4.21Å; A294-W309 HydrophobicContact CB-CZ3 3.94Å; F304-W309 HydrophobicContact CB-CD2 3.97Å; F304-W309 VanDerWaalsContact CB-CE2 3.48Å; F304-W309 HydrophobicContact CB-CG 4.18Å; F304-W309 HydrophobicContact CB-CZ2 3.9Å; F304-W309 AromaticContact CD1-CE2 3.93Å; F304-W309 HydrophobicContact CD1-CH2 4.01Å; F304-W309 AromaticContact CD1-CZ2 3.41Å; F304-W309 HydrophobicContact CD1-CZ2 3.41Å; F304-W309 VanDerWaalsContact CD1-CZ2 3.41Å; F304-W309 HydrophobicContact CD2-CD2 4.01Å; F304-W309 AromaticContact CD2-CE2 3.75Å; F304-W309 AromaticContact CD2-CE3 3.97Å; F304-W309 HydrophobicContact CD2-CE3 3.97Å; F304-W309 AromaticContact CD2-CH2 3.46Å; F304-W309 HydrophobicContact CD2-CH2 3.46Å; F304-W309 VanDerWaalsContact CD2-CH2 3.46Å; F304-W309 AromaticContact CD2-CZ2 3.5Å; F304-W309 HydrophobicContact CD2-CZ2 3.5Å; F304-W309 VanDerWaalsContact CD2-CZ2 3.5Å; F304-W309 AromaticContact CD2-CZ3 3.7Å; F304-W309 HydrophobicContact CD2-CZ3 3.7Å; F304-W309 AromaticContact CE1-CH2 3.93Å; F304-W309 HydrophobicContact CE1-CH2 3.93Å; F304-W309 AromaticContact CE1-CZ2 3.72Å; F304-W309 HydrophobicContact CE1-CZ2 3.72Å; F304-W309 HydrophobicContact CE2-CE3 4.44Å; F304-W309 AromaticContact CE2-CH2 3.35Å; F304-W309 HydrophobicContact CE2-CH2 3.35Å; F304-W309 AromaticContact CE2-CZ2 3.78Å; F304-W309 HydrophobicContact CE2-CZ2 3.78Å; F304-W309 AromaticContact CE2-CZ3 3.73Å; F304-W309 HydrophobicContact CE2-CZ3 3.73Å; F304-W309 HydrophobicContact CG-CD2 4.08Å; F304-W309 AromaticContact CG-CE2 3.44Å; F304-W309 VanDerWaalsContact CG-CE2 3.44Å; F304-W309 HydrophobicContact CG-CE3 4.48Å; F304-W309 AromaticContact CG-CH2 3.79Å; F304-W309 HydrophobicContact CG-CH2 3.79Å; F304-W309 AromaticContact CG-CZ2 3.3Å; F304-W309 HydrophobicContact CG-CZ2 3.3Å; F304-W309 HydrophobicContact CG-CZ3 4.35Å; F304-W309 AromaticContact CG-NE1 3.83Å; F304-W309 AromaticContact CZ-CH2 3.61Å; F304-W309 HydrophobicContact CZ-CH2 3.61Å; F304-W309 AromaticContact CZ-CZ2 3.9Å; F304-W309 HydrophobicContact CZ-CZ2 3.9Å; F304-W309 HydrophobicContact CZ-CZ3 4.41Å; F304-W309 PolarHBondContact O-N 3.48Å
310	S	96.3	Very high	83.2	Confident	97 Å²	97	86 Å²	86	68%	0.678	46%	0.46	S	S	*	.			trans	-136.8	144.5	173.1	55.7	0	0	0	0	109.5
311	P	94.4	Very high	80.1	Confident	19 Å²	19	87.2 Å²	87.2	12%	0.123	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-60.8	145.6	170.9	29.5	-37.1	0	0	0	110.2	A294 A297 R298	A294-P311 HydrophobicContact CB-CB 4.34Å; A294-P311 VanDerWaalsContact O-CB 3.3Å; A294-P311 WeakPolarHBondContact O-CB 3.47Å; A294-P311 VanDerWaalsContact O-CG 3.26Å; A294-P311 WeakPolarHBondContact O-CG 3.23Å; A297-P311 HydrophobicContact CB-CG 3.94Å; R298-P311 HydrophobicContact CG-CB 3.83Å; R298-P311 HydrophobicContact CG-CG 3.63Å
312	P	88.2	Confident	77.4	Confident	87 Å²	87	86.9 Å²	86.9	57%	0.565	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-60.8	147.8	171	26.3	-33.7	0	0	0	109.7	R298	R298-P312 PolarHBondContact NE-O 3.21Å
313	P	84.8	Confident	74.3	Confident	114 Å²	114	92.2 Å²	92.2	74%	0.74	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-56.3	153.8	177.7	23.7	-32.6	0	0	0	111
314	L	79.2	Confident	71.2	Confident	115 Å²	115	94 Å²	94	60%	0.602	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-59.9	141.6	171.2	-68.2	175.1	0	0	0	108.5	D316	L314-D316 PolarHBondContact O-N 3.37Å
315	P	75.5	Confident	68.2	Low	114 Å²	114	99.2 Å²	99.2	74%	0.74	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-53.5	137.3	172.3	-19.2	29.7	0	0	0	109.2	N317	P315-N317 PolarHBondContact O-N 2.81Å; P315-N317 VanDerWaalsContact O-N 3.11Å
316	D	68.9	Low	65.2	Low	146 Å²	146	103.3 Å²	103.3	78%	0.781	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-51.6	124.7	171.3	-72.3	-31	0	0	0	108.2	L314 R318	L314-D316 PolarHBondContact O-N 3.37Å; D316-R318 PolarHBondContact O-N 2.73Å
317	N	53.1	Low	62.3	Low	137 Å²	137	106.3 Å²	106.3	73%	0.733	65%	0.653	S	S	*	*			trans	-64.1	86.1	163.6	-103.7	-4.7	0	0	0	106.2	P315 T319	P315-N317 PolarHBondContact O-N 2.81Å; P315-N317 VanDerWaalsContact O-N 3.11Å; N317-T319 PolarHBondContact O-N 3.31Å; N317-T319 PolarHBondContact O-OG1 3.11Å
318	R	45.5	Very low	59.3	Low	231 Å²	231	113.5 Å²	113.5	87%	0.872	69%	0.685	S	S	*	*			trans	-68.2	76.3	155.4	-73.9	-172.8	179.2	-179.7	0.3	106	D316 L320	D316-R318 PolarHBondContact O-N 2.73Å; R318-L320 PolarHBondContact O-N 3.27Å
319	T	43	Very low	56.3	Low	92 Å²	92	114.7 Å²	114.7	56%	0.564	70%	0.696	S	S	*	*			trans	-56.2	109	161.8	5.1	0	0	0	0	105.9	N317	N317-T319 PolarHBondContact O-N 3.31Å; N317-T319 PolarHBondContact O-OG1 3.11Å
320	L	41.7	Very low	53.4	Low	145 Å²	145	120.3 Å²	120.3	76%	0.759	73%	0.729	S	S	*	*			trans	-51.2	135.5	151.8	-82.2	155.1	0	0	0	106.6	R318 G322	R318-L320 PolarHBondContact O-N 3.27Å; L320-G322 PolarHBondContact O-N 3.02Å
321	P	33.8	Very low	50.5	Low	132 Å²	132	124.3 Å²	124.3	86%	0.857	74%	0.737	S	S	*	*	S	Bend	trans	-58.1	116.4	-179.8	-1.6	6.7	0	0	0	109.1
322	G	41.3	Very low	47.6	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	77%	0.771	S	S	*	*			trans	106.8	77.8	175	0	0	0	0	0	114.3	L320	L320-G322 PolarHBondContact O-N 3.02Å
323	T	33.2	Very low	45	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	81%	0.81	S	S	*	*			trans	-170.1	115.5	141.7	17.8	0	0	0	0	108.3
324	A	33	Very low	43	Very low	109 Å²	109	138.7 Å²	138.7	90%	0.901	81%	0.813	S	S	*	*			trans	-66.9	131.7	-175	0	0	0	0	0	111.7
325	T	36.7	Very low	41.1	Very low	113 Å²	113	139.9 Å²	139.9	69%	0.693	82%	0.824	S	S	*	*			trans	-78.6	126.9	177.4	42.8	0	0	0	0	111.8	A327	T325-A327 PolarHBondContact O-N 3Å
326	A	34.8	Very low	39.2	Very low	115 Å²	115	141.3 Å²	141.3	95%	0.95	83%	0.829	S	S	*	*			trans	-80.7	93.6	163.7	0	0	0	0	0	109.8
327	A	34.2	Very low	37.4	Very low	82 Å²	82	141.1 Å²	141.1	68%	0.678	83%	0.832	S	S	*	*			trans	-119.8	100.7	166.3	0	0	0	0	0	107.9	T325	T325-A327 PolarHBondContact O-N 3Å
328	M	34.7	Very low	36.5	Very low	189 Å²	189	141.3 Å²	141.3	93%	0.931	84%	0.838	S	S	*	*			trans	-178.3	124.7	157.7	-103.2	171.5	-167.3	0	0	107
329	V	33.8	Very low	35.9	Very low	140 Å²	140	135.3 Å²	135.3	85%	0.848	84%	0.836	S	S	*	*			trans	165.8	91.3	144.2	163.7	0	0	0	0	105.4
330	L	36.3	Very low	35.4	Very low	160 Å²	160	138.4 Å²	138.4	84%	0.838	86%	0.855	S	S	*	*			trans	-163	66.1	146.3	-99.8	174.5	0	0	0	106.7
331	Q	34.4	Very low	34.9	Very low	181 Å²	181	137.9 Å²	137.9	85%	0.846	86%	0.862	S	S	*	*	S	Bend	trans	-148.9	129.5	157.2	-98.6	172.8	3.2	0	0	106.6
332	N	32.8	Very low	35	Very low	157 Å²	157	138.4 Å²	138.4	84%	0.84	86%	0.863	S	S	*	*			trans	78.8	90.9	179.3	-59.1	-9.3	0	0	0	117.5
333	T	34.6	Very low	34.4	Very low	225 Å²	225	144.8 Å²	144.8	100%	1.38	88%	0.878	S	S	*	*				-166.3	0	118.5	20.2	0	0	0	0	111.2

Retrieved 333 of 333 residues in 258.2 ms (Link to these results)

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