A0A087YCX0_POEFO Loading...

DNA repair protein REV1

AlphaFold DB , UniProt , Accession A0A087YCX0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 746 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	33.5	Very low	251 Å²	251	156.8 Å²	156.8	100%	1.236	80%	0.802	S	S	*	*				0	161.2	0	-78.1	167.1	164.8	0	0	108.6
2	R	32.8	Very low	33.1	Very low	228 Å²	228	157 Å²	157	86%	0.86	81%	0.806	S	S	*	*			trans	-79.4	163	-177.6	-68.3	176.2	174.6	167.5	-3.2	112
3	H	30	Very low	32.8	Very low	166 Å²	166	157.2 Å²	157.2	77%	0.769	81%	0.81	S	S	*	*			trans	137.8	99.5	146.1	-77	-64.7	0	0	0	111.1
4	T	30	Very low	32.7	Very low	123 Å²	123	156.6 Å²	156.6	76%	0.755	81%	0.809	S	S	*	*				90.2	115.1	70.3	51.4	0	0	0	0	114.4
5	H	34.2	Very low	32.6	Very low	184 Å²	184	156.5 Å²	156.5	85%	0.852	81%	0.809	S	S	*	*			trans	-55.1	162.4	159.5	-92.7	-62.3	0	0	0	112.6
6	P	45.3	Very low	32.9	Very low	127 Å²	127	153.8 Å²	153.8	83%	0.825	81%	0.805	S	S	*	*				-152.2	178.3	65.6	40.3	-17.8	0	0	0	120.2
7	Q	30.3	Very low	32.6	Very low	176 Å²	176	153.1 Å²	153.1	82%	0.822	81%	0.808	S	S	*	*			trans	-72.8	-171.4	168	-115.7	-176.4	-32.2	0	0	112.7
8	P	46.5	Very low	32.2	Very low	108 Å²	108	151.8 Å²	151.8	70%	0.701	81%	0.807	S	S	*	*			cis	-128.8	-157.5	19.3	44.8	-25	0	0	0	113.3
9	D	28.8	Very low	32.5	Very low	107 Å²	107	149.8 Å²	149.8	57%	0.572	80%	0.804	S	S	*	*			cis	-155.4	174.7	0.6	-148.9	-6.3	0	0	0	111.5
10	K	29.4	Very low	32.2	Very low	172 Å²	172	148.2 Å²	148.2	75%	0.748	81%	0.805	S	S	*	*			trans	20.9	151.5	148.4	-77.3	161.5	-156.7	143.6	0	124.3
11	A	29.6	Very low	32.1	Very low	83 Å²	83	149.8 Å²	149.8	69%	0.686	81%	0.807	S	S	*	*			cis	-161.3	166.8	0.8	0	0	0	0	0	113.1
12	D	28.8	Very low	32	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	79%	0.789	S	S	*	*			trans	20.8	131.5	160.9	-62.7	-37.7	0	0	0	123.5
13	D	29.6	Very low	32	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	79%	0.786	S	S	*	*				-161.5	174.1	114.9	-138.4	-35	0	0	0	112.3
14	D	31	Very low	32	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	79%	0.785	S	S	*	*			trans	-71.9	164.1	-150.1	-105.4	-44.5	0	0	0	122.3
15	L	31.7	Very low	31.8	Very low	156 Å²	156	140.9 Å²	140.9	82%	0.817	79%	0.787	S	S	*	*			trans	-73.7	179.9	170.1	-76.8	167.2	0	0	0	112.5
16	P	36.7	Very low	31.7	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	79%	0.785	S	S	*	*			cis	-142.8	155.4	13.4	40.6	-21	0	0	0	118.5
17	V	28.1	Very low	31	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	79%	0.785	S	S	*	*			trans	-146.5	127.7	151.2	-173.8	0	0	0	0	112.4
18	T	26.2	Very low	31.1	Very low	131 Å²	131	135.2 Å²	135.2	80%	0.804	78%	0.782	S	S	*	*			trans	-139.3	165.4	157.7	41.7	0	0	0	0	108
19	P	36.4	Very low	30.6	Very low	114 Å²	114	137.1 Å²	137.1	74%	0.74	79%	0.786	S	S	*	*			cis	-126.7	171.3	-3.5	38.7	-24.2	0	0	0	114
20	S	26.9	Very low	30.9	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	80%	0.797	S	S	*	*			trans	-159.8	104.7	147.9	-85.5	0	0	0	0	113.5
21	Q	31.3	Very low	31.7	Very low	182 Å²	182	131.7 Å²	131.7	85%	0.85	79%	0.787	S	S	*	*			trans	56.7	107.9	141.7	-65.5	-177	-24.5	0	0	120.1
22	D	28.2	Very low	32.4	Very low	163 Å²	163	133.2 Å²	133.2	87%	0.872	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-46.9	128.6	168.8	-46.3	-78.4	0	0	0	114.1
23	I	32.3	Very low	33.5	Very low	154 Å²	154	130.2 Å²	130.2	79%	0.79	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-91.2	131.1	154.7	-62.6	174.2	0	0	0	105.6	D25	I23-D25 PolarHBondContact O-N 3.21Å; I23-D25 VanDerWaalsContact O-N 3.15Å
24	P	30.5	Very low	34.6	Very low	115 Å²	115	128.5 Å²	128.5	75%	0.747	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65.8	119.5	-176.2	26	-33.7	0	0	0	110.5	S26	P24-S26 PolarHBondContact O-N 2.75Å; P24-S26 VanDerWaalsContact O-N 3.08Å
25	D	25.8	Very low	35.9	Very low	149 Å²	149	124 Å²	124	80%	0.797	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-51.3	116.7	170	-85.4	-48.3	0	0	0	109.5	I23 H27	I23-D25 PolarHBondContact O-N 3.21Å; I23-D25 VanDerWaalsContact O-N 3.15Å; D25-H27 VanDerWaalsContact C-N 3.33Å; D25-H27 PolarHBondContact O-N 3.42Å
26	S	31.4	Very low	37.3	Very low	117 Å²	117	117.3 Å²	117.3	82%	0.818	71%	0.714	S	S	*	*			trans	-68.3	99	167.3	43.4	0	0	0	0	107.1	P24 G28	P24-S26 PolarHBondContact O-N 2.75Å; P24-S26 VanDerWaalsContact O-N 3.08Å; S26-G28 PolarHBondContact O-N 3.49Å
27	H	31.8	Very low	38.5	Very low	177 Å²	177	113.8 Å²	113.8	82%	0.819	69%	0.691	S	S	*	*			trans	-43.7	104.9	179.3	-78.7	-70.3	0	0	0	110.2	D25 N29	D25-H27 VanDerWaalsContact C-N 3.33Å; D25-H27 PolarHBondContact O-N 3.42Å; H27-N29 VanDerWaalsContact C-N 3.34Å; H27-N29 PolarHBondContact O-N 2.84Å
28	G	32	Very low	40.8	Very low	74 Å²	74	113.3 Å²	113.3	76%	0.763	68%	0.683	S	S	*	*			trans	-62.3	101.3	170.4	0	0	0	0	0	107	S26 G30	S26-G28 PolarHBondContact O-N 3.49Å; G28-G30 VanDerWaalsContact C-N 3.28Å; G28-G30 PolarHBondContact O-N 3.21Å
29	N	35.5	Very low	43.7	Very low	147 Å²	147	108.8 Å²	108.8	79%	0.786	66%	0.656	S	S	*	*			trans	-58.4	102.2	164.7	-99.9	-15.6	0	0	0	106.3	H27 V31	H27-N29 VanDerWaalsContact C-N 3.34Å; H27-N29 PolarHBondContact O-N 2.84Å; N29-V31 HydrophobicContact CB-CG2 4.31Å; N29-V31 PolarHBondContact O-N 3.25Å
30	G	36.5	Very low	46.3	Very low	77 Å²	77	106.5 Å²	106.5	79%	0.794	64%	0.636	S	S	*	*			trans	-64.9	73	167.1	0	0	0	0	0	108.8	G28 D32	G28-G30 VanDerWaalsContact C-N 3.28Å; G28-G30 PolarHBondContact O-N 3.21Å; G30-D32 PolarHBondContact O-N 3.5Å
31	V	45.2	Very low	49.4	Very low	89 Å²	89	103.5 Å²	103.5	54%	0.539	62%	0.619	S	S	.	*			trans	-68.8	112.7	164.4	-174.9	0	0	0	0	105	N29 A35 A36	N29-V31 HydrophobicContact CB-CG2 4.31Å; N29-V31 PolarHBondContact O-N 3.25Å; V31-A35 HydrophobicContact CG1-CB 4.25Å; V31-A36 HydrophobicContact CG1-CB 3.9Å
32	D	45.1	Very low	52.5	Low	115 Å²	115	99.6 Å²	99.6	62%	0.615	60%	0.601	S	S	*	*			trans	-44.1	131.4	173.1	-92.4	-49.4	0	0	0	109.6	G30 D34 A35 A36	G30-D32 PolarHBondContact O-N 3.5Å; D32-D34 PolarHBondContact O-N 3.22Å; D32-A35 HydrophobicContact CB-CB 3.94Å; D32-A35 WeakPolarHBondContact O-CA 3.24Å; D32-A35 WeakPolarHBondContact O-CB 3.3Å; D32-A35 PolarHBondContact O-N 3.24Å; D32-A36 PolarHBondContact O-N 3.41Å
33	P	51.5	Low	55.7	Low	95 Å²	95	92.7 Å²	92.7	62%	0.617	56%	0.563	S	S	*	*	H	α-helix	trans	-57.3	-27.8	-179	20.8	-31.1	0	0	0	112.1	T37	P33-T37 PolarHBondContact O-N 3.33Å; P33-T37 PolarHBondContact O-OG1 2.99Å
34	D	53.6	Low	58.7	Low	123 Å²	123	87.9 Å²	87.9	66%	0.658	55%	0.547	S	S	*	.	H	α-helix	trans	-74.2	-34	173.7	-69.1	-14.1	0	0	0	113.3	D32 T37 L38	D32-D34 PolarHBondContact O-N 3.22Å; D34-T37 WeakPolarHBondContact CA-OG1 3.46Å; D34-T37 PolarHBondContact O-OG1 3.12Å; D34-T37 VanDerWaalsContact O-OG1 3.12Å; D34-L38 WeakPolarHBondContact O-CG 3.4Å; D34-L38 PolarHBondContact O-N 2.86Å
35	A	58	Low	61.8	Low	56 Å²	56	86.6 Å²	86.6	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-71.7	-40.2	174.4	0	0	0	0	0	111.5	V31 D32 T37 L38 S39	V31-A35 HydrophobicContact CG1-CB 4.25Å; D32-A35 HydrophobicContact CB-CB 3.94Å; D32-A35 WeakPolarHBondContact O-CA 3.24Å; D32-A35 WeakPolarHBondContact O-CB 3.3Å; D32-A35 PolarHBondContact O-N 3.24Å; A35-T37 PolarHBondContact O-N 2.65Å; A35-L38 PolarHBondContact O-N 3.04Å; A35-S39 PolarHBondContact O-N 3.18Å
36	A	59.8	Low	65.1	Low	14 Å²	14	80.1 Å²	80.1	12%	0.116	51%	0.507	C	S	.	.	H	α-helix	trans	-62.9	-40	177.3	0	0	0	0	0	112.3	V31 D32 L38 S39 G62	V31-A36 HydrophobicContact CG1-CB 3.9Å; D32-A36 PolarHBondContact O-N 3.41Å; A36-L38 VanDerWaalsContact C-N 3.28Å; A36-L38 PolarHBondContact O-N 3.39Å; A36-S39 WeakPolarHBondContact O-CB 3.35Å; A36-S39 PolarHBondContact O-N 3.35Å; A36-G62 VanDerWaalsContact O-CA 3.27Å; A36-G62 WeakPolarHBondContact O-CA 3.44Å
37	T	62.1	Low	68.2	Low	40 Å²	40	77.5 Å²	77.5	25%	0.245	49%	0.489	C	S	.	.	H	α-helix	trans	-72.8	-15.9	-180	42.6	0	0	0	0	114.2	P33 D34 A35 G62 K65 Q66	P33-T37 PolarHBondContact O-N 3.33Å; P33-T37 PolarHBondContact O-OG1 2.99Å; D34-T37 WeakPolarHBondContact CA-OG1 3.46Å; D34-T37 PolarHBondContact O-OG1 3.12Å; D34-T37 VanDerWaalsContact O-OG1 3.12Å; A35-T37 PolarHBondContact O-N 2.65Å; T37-G62 CarbonylContact O-C 3.46Å; T37-G62 VanDerWaalsContact O-CA 3.28Å; T37-G62 WeakPolarHBondContact O-CA 3.37Å; T37-K65 HydrophobicContact CG2-CG 4.47Å; T37-Q66 HydrophobicContact CG2-CG 4.16Å; T37-Q66 PolarHBondContact O-NE2 2.81Å
38	L	76.8	Confident	71.2	Confident	131 Å²	131	72.9 Å²	72.9	69%	0.686	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-5.1	173.3	-68	172.8	0	0	0	114.1	D34 A35 A36 M40	D34-L38 WeakPolarHBondContact O-CG 3.4Å; D34-L38 PolarHBondContact O-N 2.86Å; A35-L38 PolarHBondContact O-N 3.04Å; A36-L38 VanDerWaalsContact C-N 3.28Å; A36-L38 PolarHBondContact O-N 3.39Å; L38-M40 VanDerWaalsContact O-CE 3.3Å; L38-M40 WeakPolarHBondContact O-CE 3.35Å; L38-M40 PolarHBondContact O-N 3.2Å
39	S	87.6	Confident	74.2	Confident	36 Å²	36	75.4 Å²	75.4	25%	0.252	46%	0.456	S	S	.	.			trans	-62.2	120.9	-173.9	-179.1	0	0	0	0	114	A35 A36 A41 G62	A35-S39 PolarHBondContact O-N 3.18Å; A36-S39 WeakPolarHBondContact O-CB 3.35Å; A36-S39 PolarHBondContact O-N 3.35Å; S39-A41 VanDerWaalsContact C-N 3.31Å; S39-A41 WeakPolarHBondContact OG-CB 3.49Å; S39-A41 PolarHBondContact OG-N 2.96Å; S39-G62 PolarHBondContact O-N 2.8Å
40	M	90.4	Very high	77.1	Confident	65 Å²	65	68.7 Å²	68.7	32%	0.32	42%	0.422	S	S	.	.			trans	-91.7	16.5	172.9	-62	-65.5	109.9	0	0	113.1	L38 F60 K305	L38-M40 VanDerWaalsContact O-CE 3.3Å; L38-M40 WeakPolarHBondContact O-CE 3.35Å; L38-M40 PolarHBondContact O-N 3.2Å; M40-F60 HydrophobicContact CB-CD1 4.47Å; M40-F60 HydrophobicContact CE-CB 4.47Å; M40-F60 HydrophobicContact CE-CD2 4.43Å; M40-F60 VanDerWaalsContact O-CD1 3.27Å; M40-F60 WeakPolarHBondContact O-CD1 3.43Å; M40-F60 HydrophobicContact SD-CB 4.44Å; M40-F60 HydrophobicContact SD-CD2 3.59Å; M40-F60 VanDerWaalsContact SD-CD2 3.59Å; M40-F60 HydrophobicContact SD-CE2 3.92Å; M40-F60 HydrophobicContact SD-CG 4Å; M40-K305 HydrophobicContact CB-CB 4.28Å; M40-K305 HydrophobicContact CB-CG 4.19Å; M40-K305 WeakPolarHBondContact O-CE 3.5Å
41	A	92.6	Very high	79.9	Confident	54 Å²	54	69.3 Å²	69.3	45%	0.446	40%	0.4	S	S	.	.			trans	-63.8	146.2	168.4	0	0	0	0	0	110.2	S39 F60 F61	S39-A41 VanDerWaalsContact C-N 3.31Å; S39-A41 WeakPolarHBondContact OG-CB 3.49Å; S39-A41 PolarHBondContact OG-N 2.96Å; A41-F60 CarbonylContact O-C 3.53Å; A41-F60 VanDerWaalsContact O-CA 3.24Å; A41-F60 WeakPolarHBondContact O-CA 3.41Å; A41-F61 HydrophobicContact CB-CB 4.33Å; A41-F61 PolarHBondContact O-N 2.98Å
42	E	95.1	Very high	82.3	Confident	101 Å²	101	72.9 Å²	72.9	47%	0.472	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-100.9	133.2	-175.1	-173.7	171.6	170.7	0	0	111.2	A44 K305	E42-A44 PolarHBondContact O-N 3.2Å; E42-K305 IonicContact OE2-NZ 2.99Å; E42-K305 PolarHBondContact OE2-NZ 2.95Å
43	I	95.9	Very high	84.6	Confident	17 Å²	17	69.5 Å²	69.5	9%	0.087	40%	0.399	C	S	.	.			trans	-80	104.9	176.6	-65	178.6	0	0	0	109	S45 C46 V55 N57 G58 M59 F61 A64 L71	I43-S45 WeakPolarHBondContact CG2-O 3.45Å; I43-C46 HydrophobicContact CG2-CB 3.96Å; I43-V55 HydrophobicContact CD1-CG1 3.76Å; I43-N57 CarbonylContact O-C 3.56Å; I43-N57 WeakPolarHBondContact O-CA 3.49Å; I43-G58 PolarHBondContact O-N 2.87Å; I43-M59 WeakPolarHBondContact CB-O 3.44Å; I43-M59 PolarHBondContact N-O 2.94Å; I43-F61 HydrophobicContact CD1-CD2 4.18Å; I43-F61 HydrophobicContact CG1-CB 4.43Å; I43-F61 HydrophobicContact CG1-CD2 4.2Å; I43-A64 HydrophobicContact CD1-CB 3.31Å; I43-L71 HydrophobicContact CD1-CD2 4.21Å
44	A	95.1	Very high	86.7	Confident	54 Å²	54	66.4 Å²	66.4	45%	0.446	38%	0.384	S	S	.	.	S	Bend	trans	-64.6	-45.3	174.2	0	0	0	0	0	112.2	E42 N57 Y76	E42-A44 PolarHBondContact O-N 3.2Å; A44-N57 WeakPolarHBondContact O-CB 3.01Å; A44-N57 VanDerWaalsContact O-CG 3.3Å; A44-N57 PolarHBondContact O-ND2 3.06Å; A44-Y76 HydrophobicContact CB-CE1 3.63Å; A44-Y76 VanDerWaalsContact CB-OH 3.29Å; A44-Y76 WeakPolarHBondContact CB-OH 3.48Å
45	S	95.7	Very high	88.7	Confident	87 Å²	87	60.6 Å²	60.6	61%	0.608	35%	0.353	S	S	*	.			trans	-143.1	151.5	174.8	-159.6	0	0	0	0	112.3	I43	I43-S45 WeakPolarHBondContact CG2-O 3.45Å
46	C	96.1	Very high	90.4	Very high	14 Å²	14	66.4 Å²	66.4	10%	0.095	36%	0.363	C	S	.	.			trans	-138.8	146.1	175.1	58	0	0	0	0	110.4	I43 A50 R51 V55 N57	I43-C46 HydrophobicContact CG2-CB 3.96Å; C46-A50 HydrophobicContact CB-CB 4.1Å; C46-R51 PolarHBondContact O-NE 2.87Å; C46-R51 PolarHBondContact O-NH2 2.95Å; C46-V55 HydrophobicContact CB-CG1 4.04Å; C46-N57 PolarHBondContact N-OD1 3.05Å; C46-N57 PolarHBondContact SG-OD1 2.87Å
47	S	96.3	Very high	92.1	Very high	62 Å²	62	69.4 Å²	69.4	43%	0.434	38%	0.377	S	S	.	.			trans	-67	166.5	-179.3	81.5	0	0	0	0	112.1	E49 A50 R51	S47-E49 VanDerWaalsContact C-N 3.3Å; S47-E49 WeakPolarHBondContact CB-OE2 3.48Å; S47-E49 PolarHBondContact O-N 3.23Å; S47-E49 PolarHBondContact OG-OE2 3Å; S47-A50 PolarHBondContact O-N 3.01Å; S47-A50 PolarHBondContact OG-N 2.93Å; S47-R51 WeakPolarHBondContact O-CG 3.48Å; S47-R51 PolarHBondContact O-N 3.25Å
48	Y	94.7	Very high	93.6	Very high	79 Å²	79	69.6 Å²	69.6	31%	0.31	39%	0.387	S	S	.	.	H	α-helix	trans	-70.7	-27.5	-177.1	-76.3	-86.6	0	0	0	112.7	R51 Q52 P161	Y48-R51 WeakPolarHBondContact O-CB 3.1Å; Y48-R51 PolarHBondContact O-N 3.01Å; Y48-Q52 WeakPolarHBondContact O-CG 3.25Å; Y48-Q52 PolarHBondContact O-N 2.7Å; Y48-P161 HydrophobicContact CD1-CB 3.81Å; Y48-P161 HydrophobicContact CD1-CG 4.06Å; Y48-P161 HydrophobicContact CD2-CB 3.8Å; Y48-P161 HydrophobicContact CE1-CB 3.7Å; Y48-P161 HydrophobicContact CE1-CG 4.26Å; Y48-P161 HydrophobicContact CE2-CB 3.69Å; Y48-P161 HydrophobicContact CG-CB 3.85Å; Y48-P161 HydrophobicContact CG-CG 4.29Å
49	E	95.2	Very high	94.4	Very high	127 Å²	127	64.8 Å²	64.8	59%	0.593	36%	0.362	S	S	*	.	H	α-helix	trans	-64.7	-45.1	172.1	-51.6	69.3	-146.8	0	0	110.1	S47 R51 Q52 A53	S47-E49 VanDerWaalsContact C-N 3.3Å; S47-E49 WeakPolarHBondContact CB-OE2 3.48Å; S47-E49 PolarHBondContact O-N 3.23Å; S47-E49 PolarHBondContact OG-OE2 3Å; E49-R51 VanDerWaalsContact C-N 3.3Å; E49-R51 PolarHBondContact O-N 2.98Å; E49-Q52 WeakPolarHBondContact O-CB 3.41Å; E49-Q52 PolarHBondContact O-N 2.8Å; E49-A53 PolarHBondContact O-N 2.81Å
50	A	95.7	Very high	94.8	Very high	7 Å²	7	66.9 Å²	66.9	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-63.9	-35.4	173.6	0	0	0	0	0	112	C46 S47 A53 G54 V55 L71	C46-A50 HydrophobicContact CB-CB 4.1Å; S47-A50 PolarHBondContact O-N 3.01Å; S47-A50 PolarHBondContact OG-N 2.93Å; A50-A53 CarbonylContact O-C 3.57Å; A50-A53 PolarHBondContact O-N 2.74Å; A50-G54 PolarHBondContact O-N 3.41Å; A50-V55 HydrophobicContact CB-CB 4.15Å; A50-V55 HydrophobicContact CB-CG2 4.41Å; A50-V55 VanDerWaalsContact O-CB 3.25Å; A50-V55 WeakPolarHBondContact O-CB 3.34Å; A50-V55 WeakPolarHBondContact O-CG2 3.41Å; A50-V55 PolarHBondContact O-N 3.42Å; A50-L71 HydrophobicContact CB-CD1 4.04Å
51	R	95.5	Very high	95	Very high	90 Å²	90	65.5 Å²	65.5	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-67.5	-34.7	174.8	-67.4	171.1	-168.8	-161.7	-0.8	112.9	C46 S47 Y48 E49 A53 G54 V55 N57	C46-R51 PolarHBondContact O-NE 2.87Å; C46-R51 PolarHBondContact O-NH2 2.95Å; S47-R51 WeakPolarHBondContact O-CG 3.48Å; S47-R51 PolarHBondContact O-N 3.25Å; Y48-R51 WeakPolarHBondContact O-CB 3.1Å; Y48-R51 PolarHBondContact O-N 3.01Å; E49-R51 VanDerWaalsContact C-N 3.3Å; E49-R51 PolarHBondContact O-N 2.98Å; R51-A53 VanDerWaalsContact C-N 3.29Å; R51-A53 PolarHBondContact O-N 2.77Å; R51-G54 WeakPolarHBondContact O-CA 3.43Å; R51-G54 PolarHBondContact O-N 3.28Å; R51-V55 WeakPolarHBondContact CA-O 3.48Å; R51-N57 PolarHBondContact NH2-OD1 2.82Å
52	Q	94.6	Very high	95	Very high	164 Å²	164	62.9 Å²	62.9	77%	0.766	34%	0.337	S	S	*	.	H	α-helix	trans	-62.8	-37.3	171.9	-70.4	168.1	17	0	0	111.2	Y48 E49 G54	Y48-Q52 WeakPolarHBondContact O-CG 3.25Å; Y48-Q52 PolarHBondContact O-N 2.7Å; E49-Q52 WeakPolarHBondContact O-CB 3.41Å; E49-Q52 PolarHBondContact O-N 2.8Å; Q52-G54 PolarHBondContact O-N 2.57Å
53	A	94.8	Very high	94.9	Very high	44 Å²	44	64 Å²	64	36%	0.364	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	5.7	169.8	0	0	0	0	0	114.4	E49 A50 R51 C68	E49-A53 PolarHBondContact O-N 2.81Å; A50-A53 CarbonylContact O-C 3.57Å; A50-A53 PolarHBondContact O-N 2.74Å; R51-A53 VanDerWaalsContact C-N 3.29Å; R51-A53 PolarHBondContact O-N 2.77Å; A53-C68 HydrophobicContact CB-CB 4.02Å
54	G	94.7	Very high	94.8	Very high	30 Å²	30	63.1 Å²	63.1	31%	0.309	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	1.7	176	0	0	0	0	0	115.9	A50 R51 Q52	A50-G54 PolarHBondContact O-N 3.41Å; R51-G54 WeakPolarHBondContact O-CA 3.43Å; R51-G54 PolarHBondContact O-N 3.28Å; Q52-G54 PolarHBondContact O-N 2.57Å
55	V	96.3	Very high	94.7	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.006	33%	0.326	C	S	.	.			trans	-66.5	148	172.6	-175.5	0	0	0	0	109.9	I43 C46 A50 R51 A64 C68	I43-V55 HydrophobicContact CD1-CG1 3.76Å; C46-V55 HydrophobicContact CB-CG1 4.04Å; A50-V55 HydrophobicContact CB-CB 4.15Å; A50-V55 HydrophobicContact CB-CG2 4.41Å; A50-V55 VanDerWaalsContact O-CB 3.25Å; A50-V55 WeakPolarHBondContact O-CB 3.34Å; A50-V55 WeakPolarHBondContact O-CG2 3.41Å; A50-V55 PolarHBondContact O-N 3.42Å; R51-V55 WeakPolarHBondContact CA-O 3.48Å; V55-A64 HydrophobicContact CB-CB 4.5Å; V55-A64 HydrophobicContact CG1-CB 3.72Å; V55-A64 HydrophobicContact CG2-CB 4.04Å; V55-C68 HydrophobicContact CG2-CB 4.18Å
56	R	94.5	Very high	94.6	Very high	178 Å²	178	64.9 Å²	64.9	67%	0.672	33%	0.325	S	S	*	.			trans	-142	149.4	-178.2	-58	-177.6	-174.9	-172.9	-1.9	110.8	M59	R56-M59 HydrophobicContact CB-CE 4.22Å; R56-M59 HydrophobicContact CG-CE 4.27Å; R56-M59 WeakPolarHBondContact O-CB 3.2Å; R56-M59 PolarHBondContact O-N 3.05Å; R56-M59 VanDerWaalsContact O-N 3.1Å
57	N	94.7	Very high	94.5	Very high	76 Å²	76	68.3 Å²	68.3	41%	0.406	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	140.3	167	-59.8	27.7	0	0	0	109.5	I43 A44 C46 R51 M59	I43-N57 CarbonylContact O-C 3.56Å; I43-N57 WeakPolarHBondContact O-CA 3.49Å; A44-N57 WeakPolarHBondContact O-CB 3.01Å; A44-N57 VanDerWaalsContact O-CG 3.3Å; A44-N57 PolarHBondContact O-ND2 3.06Å; C46-N57 PolarHBondContact N-OD1 3.05Å; C46-N57 PolarHBondContact SG-OD1 2.87Å; R51-N57 PolarHBondContact NH2-OD1 2.82Å; N57-M59 VanDerWaalsContact C-N 3.29Å; N57-M59 PolarHBondContact O-N 2.9Å
58	G	93.1	Very high	94.4	Very high	45 Å²	45	66.2 Å²	66.2	46%	0.464	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	1.9	-173.2	0	0	0	0	0	115.1	I43	I43-G58 PolarHBondContact O-N 2.87Å
59	M	94.3	Very high	94.3	Very high	30 Å²	30	67.1 Å²	67.1	15%	0.148	34%	0.342	C	S	.	.			trans	-80.1	146.7	172.3	-167	179.1	-64	0	0	110.9	I43 R56 N57 K63 A64 L67	I43-M59 WeakPolarHBondContact CB-O 3.44Å; I43-M59 PolarHBondContact N-O 2.94Å; R56-M59 HydrophobicContact CB-CE 4.22Å; R56-M59 HydrophobicContact CG-CE 4.27Å; R56-M59 WeakPolarHBondContact O-CB 3.2Å; R56-M59 PolarHBondContact O-N 3.05Å; R56-M59 VanDerWaalsContact O-N 3.1Å; N57-M59 VanDerWaalsContact C-N 3.29Å; N57-M59 PolarHBondContact O-N 2.9Å; M59-K63 HydrophobicContact CG-CB 4.38Å; M59-K63 HydrophobicContact CG-CD 4.43Å; M59-K63 HydrophobicContact CG-CG 4.41Å; M59-K63 HydrophobicContact SD-CB 4.47Å; M59-K63 HydrophobicContact SD-CD 4.42Å; M59-K63 HydrophobicContact SD-CG 4.09Å; M59-A64 HydrophobicContact SD-CB 4.02Å; M59-L67 HydrophobicContact CE-CD1 3.89Å; M59-L67 HydrophobicContact SD-CD1 3.74Å
60	F	95.1	Very high	94.3	Very high	79 Å²	79	65.7 Å²	65.7	35%	0.346	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-69.5	138.1	169.8	-64.7	-45	0	0	0	111.9	M40 A41 G62 K63 A64 K305	M40-F60 HydrophobicContact CB-CD1 4.47Å; M40-F60 HydrophobicContact CE-CB 4.47Å; M40-F60 HydrophobicContact CE-CD2 4.43Å; M40-F60 VanDerWaalsContact O-CD1 3.27Å; M40-F60 WeakPolarHBondContact O-CD1 3.43Å; M40-F60 HydrophobicContact SD-CB 4.44Å; M40-F60 HydrophobicContact SD-CD2 3.59Å; M40-F60 VanDerWaalsContact SD-CD2 3.59Å; M40-F60 HydrophobicContact SD-CE2 3.92Å; M40-F60 HydrophobicContact SD-CG 4Å; A41-F60 CarbonylContact O-C 3.53Å; A41-F60 VanDerWaalsContact O-CA 3.24Å; A41-F60 WeakPolarHBondContact O-CA 3.41Å; F60-G62 PolarHBondContact O-N 2.91Å; F60-K63 PolarHBondContact O-N 2.69Å; F60-K63 VanDerWaalsContact O-N 3.16Å; F60-A64 PolarHBondContact O-N 2.81Å; F60-K305 HydrophobicContact CE1-CD 4.26Å
61	F	94.2	Very high	94.2	Very high	36 Å²	36	66.4 Å²	66.4	16%	0.158	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-42.6	-173.8	-174.3	-97.9	0	0	0	112.8	A41 I43 K63 A64 K65 L71	A41-F61 HydrophobicContact CB-CB 4.33Å; A41-F61 PolarHBondContact O-N 2.98Å; I43-F61 HydrophobicContact CD1-CD2 4.18Å; I43-F61 HydrophobicContact CG1-CB 4.43Å; I43-F61 HydrophobicContact CG1-CD2 4.2Å; F61-K63 VanDerWaalsContact C-N 3.32Å; F61-K63 PolarHBondContact O-N 3.16Å; F61-A64 CarbonylContact O-C 3.57Å; F61-A64 WeakPolarHBondContact O-CB 3.35Å; F61-A64 PolarHBondContact O-N 3.15Å; F61-A64 VanDerWaalsContact O-N 3.07Å; F61-K65 WeakPolarHBondContact O-CB 3.17Å; F61-K65 PolarHBondContact O-N 3.08Å; F61-L71 HydrophobicContact CD2-CD2 4.25Å; F61-L71 HydrophobicContact CE2-CD2 3.88Å; F61-L71 HydrophobicContact CE2-CG 4.22Å
62	G	93	Very high	94.2	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-41.1	177.4	0	0	0	0	0	112.8	A36 T37 S39 F60 K65 Q66	A36-G62 VanDerWaalsContact O-CA 3.27Å; A36-G62 WeakPolarHBondContact O-CA 3.44Å; T37-G62 CarbonylContact O-C 3.46Å; T37-G62 VanDerWaalsContact O-CA 3.28Å; T37-G62 WeakPolarHBondContact O-CA 3.37Å; S39-G62 PolarHBondContact O-N 2.8Å; F60-G62 PolarHBondContact O-N 2.91Å; G62-K65 PolarHBondContact O-N 3.36Å; G62-Q66 WeakPolarHBondContact O-CG 3.28Å; G62-Q66 PolarHBondContact O-N 2.77Å
63	K	92.9	Very high	94.1	Very high	123 Å²	123	67 Å²	67	54%	0.535	37%	0.366	S	S	.	.	H	α-helix	trans	-66.9	-38.2	173.2	-176.8	172.2	-178.5	171.6	0	112.4	M59 F60 F61 Q66 L67	M59-K63 HydrophobicContact CG-CB 4.38Å; M59-K63 HydrophobicContact CG-CD 4.43Å; M59-K63 HydrophobicContact CG-CG 4.41Å; M59-K63 HydrophobicContact SD-CB 4.47Å; M59-K63 HydrophobicContact SD-CD 4.42Å; M59-K63 HydrophobicContact SD-CG 4.09Å; F60-K63 PolarHBondContact O-N 2.69Å; F60-K63 VanDerWaalsContact O-N 3.16Å; F61-K63 VanDerWaalsContact C-N 3.32Å; F61-K63 PolarHBondContact O-N 3.16Å; K63-Q66 WeakPolarHBondContact O-CB 3.4Å; K63-Q66 PolarHBondContact O-N 3.3Å; K63-L67 WeakPolarHBondContact O-CG 3.27Å; K63-L67 PolarHBondContact O-N 2.83Å
64	A	94.6	Very high	94.2	Very high	0 Å²	0	71 Å²	71	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-67.3	-36.6	176	0	0	0	0	0	112.3	I43 V55 M59 F60 F61 Q66 L67 C68 L71	I43-A64 HydrophobicContact CD1-CB 3.31Å; V55-A64 HydrophobicContact CB-CB 4.5Å; V55-A64 HydrophobicContact CG1-CB 3.72Å; V55-A64 HydrophobicContact CG2-CB 4.04Å; M59-A64 HydrophobicContact SD-CB 4.02Å; F60-A64 PolarHBondContact O-N 2.81Å; F61-A64 CarbonylContact O-C 3.57Å; F61-A64 WeakPolarHBondContact O-CB 3.35Å; F61-A64 PolarHBondContact O-N 3.15Å; F61-A64 VanDerWaalsContact O-N 3.07Å; A64-Q66 VanDerWaalsContact C-N 3.35Å; A64-L67 PolarHBondContact O-N 2.9Å; A64-C68 PolarHBondContact O-N 3.28Å; A64-L71 HydrophobicContact CB-CD2 3.61Å
65	K	93.7	Very high	94.2	Very high	53 Å²	53	74.7 Å²	74.7	23%	0.23	40%	0.404	C	S	.	.	H	α-helix	trans	-67.8	-32.3	174.9	-164.1	64.4	162.4	171.2	0	112.2	T37 F61 G62 C68 P69 L71	T37-K65 HydrophobicContact CG2-CG 4.47Å; F61-K65 WeakPolarHBondContact O-CB 3.17Å; F61-K65 PolarHBondContact O-N 3.08Å; G62-K65 PolarHBondContact O-N 3.36Å; K65-C68 CarbonylContact O-C 3.5Å; K65-P69 VanDerWaalsContact CE-O 3.24Å; K65-P69 WeakPolarHBondContact CE-O 3.1Å; K65-P69 PolarHBondContact NZ-O 3.16Å; K65-P69 VanDerWaalsContact O-CA 3.3Å; K65-P69 WeakPolarHBondContact O-CA 3.4Å; K65-L71 HydrophobicContact CD-CB 4.16Å; K65-L71 PolarHBondContact NZ-O 3.46Å
66	Q	93.1	Very high	94.1	Very high	125 Å²	125	80.7 Å²	80.7	58%	0.584	43%	0.428	S	S	*	.	H	α-helix	trans	-66.4	-35.4	169.3	-69.7	167.8	10.8	0	0	112.8	T37 G62 K63 A64	T37-Q66 HydrophobicContact CG2-CG 4.16Å; T37-Q66 PolarHBondContact O-NE2 2.81Å; G62-Q66 WeakPolarHBondContact O-CG 3.28Å; G62-Q66 PolarHBondContact O-N 2.77Å; K63-Q66 WeakPolarHBondContact O-CB 3.4Å; K63-Q66 PolarHBondContact O-N 3.3Å; A64-Q66 VanDerWaalsContact C-N 3.35Å
67	L	93.9	Very high	94.2	Very high	86 Å²	86	76.3 Å²	76.3	45%	0.45	42%	0.417	S	S	.	.	H	α-helix	trans	-76.6	-35.1	175.3	-65.9	174.6	0	0	0	112.4	M59 K63 A64	M59-L67 HydrophobicContact CE-CD1 3.89Å; M59-L67 HydrophobicContact SD-CD1 3.74Å; K63-L67 WeakPolarHBondContact O-CG 3.27Å; K63-L67 PolarHBondContact O-N 2.83Å; A64-L67 PolarHBondContact O-N 2.9Å
68	C	94.4	Very high	94.2	Very high	18 Å²	18	79.5 Å²	79.5	12%	0.122	43%	0.428	C	S	.	.			trans	-136.8	90.4	-177.9	-175	0	0	0	0	109.9	A53 V55 A64 K65 S70 L71	A53-C68 HydrophobicContact CB-CB 4.02Å; V55-C68 HydrophobicContact CG2-CB 4.18Å; A64-C68 PolarHBondContact O-N 3.28Å; K65-C68 CarbonylContact O-C 3.5Å; C68-S70 PolarHBondContact O-N 3.04Å; C68-S70 PolarHBondContact SG-OG 3Å; C68-L71 HydrophobicContact CB-CB 4.14Å; C68-L71 WeakPolarHBondContact O-CB 3.13Å; C68-L71 PolarHBondContact O-N 3.49Å
69	P	93	Very high	94.3	Very high	97 Å²	97	83.4 Å²	83.4	63%	0.63	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.3	-178.8	-28	37	0	0	0	113.9	K65 L71	K65-P69 VanDerWaalsContact CE-O 3.24Å; K65-P69 WeakPolarHBondContact CE-O 3.1Å; K65-P69 PolarHBondContact NZ-O 3.16Å; K65-P69 VanDerWaalsContact O-CA 3.3Å; K65-P69 WeakPolarHBondContact O-CA 3.4Å; P69-L71 VanDerWaalsContact C-N 3.28Å; P69-L71 PolarHBondContact O-N 3.31Å
70	S	93.8	Very high	94.4	Very high	98 Å²	98	83.6 Å²	83.6	69%	0.685	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.5	175.1	51.2	0	0	0	0	114.5	C68 Q72	C68-S70 PolarHBondContact O-N 3.04Å; C68-S70 PolarHBondContact SG-OG 3Å; S70-Q72 PolarHBondContact O-N 3.3Å
71	L	94.8	Very high	94.4	Very high	22 Å²	22	85.2 Å²	85.2	12%	0.115	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-57.8	121.5	-177.9	-177.1	67.8	0	0	0	112	I43 A50 F61 A64 K65 C68 P69	I43-L71 HydrophobicContact CD1-CD2 4.21Å; A50-L71 HydrophobicContact CB-CD1 4.04Å; F61-L71 HydrophobicContact CD2-CD2 4.25Å; F61-L71 HydrophobicContact CE2-CD2 3.88Å; F61-L71 HydrophobicContact CE2-CG 4.22Å; A64-L71 HydrophobicContact CB-CD2 3.61Å; K65-L71 HydrophobicContact CD-CB 4.16Å; K65-L71 PolarHBondContact NZ-O 3.46Å; C68-L71 HydrophobicContact CB-CB 4.14Å; C68-L71 WeakPolarHBondContact O-CB 3.13Å; C68-L71 PolarHBondContact O-N 3.49Å; P69-L71 VanDerWaalsContact C-N 3.28Å; P69-L71 PolarHBondContact O-N 3.31Å
72	Q	94	Very high	94.4	Very high	173 Å²	173	88.5 Å²	88.5	81%	0.808	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-91.2	142.7	175.8	-64.5	177.1	-9.4	0	0	110.5	S70	S70-Q72 PolarHBondContact O-N 3.3Å
73	S	94.3	Very high	94.6	Very high	94 Å²	94	94.4 Å²	94.4	66%	0.657	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-101.3	127.5	173.5	52.6	0	0	0	0	110.2
74	V	95.2	Very high	94.8	Very high	127 Å²	127	91 Å²	91	77%	0.77	48%	0.481	S	S	*	.			trans	-111.6	135.7	174.4	-176.1	0	0	0	0	108
75	P	94.9	Very high	94.9	Very high	107 Å²	107	91.7 Å²	91.7	70%	0.695	49%	0.486	S	S	*	.			trans	-67.1	166	176.2	29.1	-35.8	0	0	0	112.1
76	Y	95.6	Very high	95	Very high	128 Å²	128	90.9 Å²	90.9	50%	0.502	48%	0.484	S	S	.	.			trans	-77.1	133.1	174.6	-65.9	-79.3	0	0	0	111.3	A44 F78 Y81	A44-Y76 HydrophobicContact CB-CE1 3.63Å; A44-Y76 VanDerWaalsContact CB-OH 3.29Å; A44-Y76 WeakPolarHBondContact CB-OH 3.48Å; Y76-F78 HydrophobicContact CD1-CE1 4.32Å; Y76-F78 HydrophobicContact CD1-CZ 4.18Å; Y76-F78 HydrophobicContact CD2-CZ 4.47Å; Y76-F78 HydrophobicContact CG-CE1 4.43Å; Y76-F78 HydrophobicContact CG-CE2 4.29Å; Y76-F78 AromaticContact CG-CZ 3.87Å; Y76-F78 HydrophobicContact CG-CZ 3.87Å; Y76-Y81 WeakPolarHBondContact CA-OH 3.36Å; Y76-Y81 HydrophobicContact CD1-CE2 4.2Å
77	D	96	Very high	95.2	Very high	85 Å²	85	86.2 Å²	86.2	46%	0.455	46%	0.463	S	S	.	.			trans	-119.3	85.3	171.2	-172.4	-20.2	0	0	0	109.3	D79 A80 Y81	D77-D79 VanDerWaalsContact C-N 3.29Å; D77-D79 PolarHBondContact O-N 3.32Å; D77-D79 PolarHBondContact OD1-N 3.4Å; D77-A80 HydrophobicContact CB-CB 4.15Å; D77-A80 WeakPolarHBondContact OD1-CB 3.22Å; D77-A80 PolarHBondContact OD1-N 3.3Å; D77-A80 WeakPolarHBondContact OD2-CB 3.36Å; D77-Y81 HydrophobicContact CB-CE1 4.38Å; D77-Y81 PolarHBondContact N-OH 3.37Å; D77-Y81 VanDerWaalsContact N-OH 3.12Å; D77-Y81 WeakPolarHBondContact O-CD1 3.47Å; D77-Y81 WeakPolarHBondContact O-CD2 3.48Å; D77-Y81 WeakPolarHBondContact O-CE1 3.36Å; D77-Y81 WeakPolarHBondContact O-CE2 3.47Å; D77-Y81 PolarHBondContact O-N 3.25Å; D77-Y81 VanDerWaalsContact O-N 3.14Å
78	F	94.6	Very high	95.3	Very high	144 Å²	144	83.3 Å²	83.3	63%	0.632	45%	0.447	S	S	*	.	H	α-helix	trans	-68	-27.9	-173.6	-66	-69.5	0	0	0	113.4	Y76 Y81 K82	Y76-F78 HydrophobicContact CD1-CE1 4.32Å; Y76-F78 HydrophobicContact CD1-CZ 4.18Å; Y76-F78 HydrophobicContact CD2-CZ 4.47Å; Y76-F78 HydrophobicContact CG-CE1 4.43Å; Y76-F78 HydrophobicContact CG-CE2 4.29Å; Y76-F78 AromaticContact CG-CZ 3.87Å; Y76-F78 HydrophobicContact CG-CZ 3.87Å; F78-Y81 HydrophobicContact CD1-CD2 4.24Å; F78-Y81 HydrophobicContact CD1-CE2 4.46Å; F78-K82 WeakPolarHBondContact O-CB 3.45Å; F78-K82 PolarHBondContact O-N 3.47Å; F78-K82 VanDerWaalsContact O-N 3.09Å
79	D	95.6	Very high	95.4	Very high	127 Å²	127	82.9 Å²	82.9	68%	0.679	44%	0.443	S	S	*	.	H	α-helix	trans	-76.1	-44.2	-179.9	-69.8	-43.7	0	0	0	110.5	D77 Y81 K82 E83	D77-D79 VanDerWaalsContact C-N 3.29Å; D77-D79 PolarHBondContact O-N 3.32Å; D77-D79 PolarHBondContact OD1-N 3.4Å; D79-Y81 VanDerWaalsContact C-N 3.32Å; D79-Y81 PolarHBondContact O-N 3.36Å; D79-K82 WeakPolarHBondContact O-CB 3.4Å; D79-K82 PolarHBondContact O-N 2.85Å; D79-K82 VanDerWaalsContact O-N 3.13Å; D79-E83 PolarHBondContact O-N 3.47Å
80	A	95.3	Very high	95.5	Very high	34 Å²	34	81.7 Å²	81.7	28%	0.281	43%	0.429	S	S	.	.	H	α-helix	trans	-60.6	-39.4	172.1	0	0	0	0	0	112.3	D77 K82 E83 V84	D77-A80 HydrophobicContact CB-CB 4.15Å; D77-A80 WeakPolarHBondContact OD1-CB 3.22Å; D77-A80 PolarHBondContact OD1-N 3.3Å; D77-A80 WeakPolarHBondContact OD2-CB 3.36Å; A80-K82 VanDerWaalsContact C-N 3.32Å; A80-K82 PolarHBondContact O-N 3.38Å; A80-E83 PolarHBondContact O-N 3.07Å; A80-V84 WeakPolarHBondContact O-CG2 3.49Å; A80-V84 PolarHBondContact O-N 3.47Å
81	Y	95.5	Very high	95.7	Very high	112 Å²	112	77.7 Å²	77.7	44%	0.439	40%	0.4	S	S	.	.	H	α-helix	trans	-64	-38.1	175.6	-53.9	-22.4	0	0	0	112.1	Y76 D77 F78 D79 A85	Y76-Y81 WeakPolarHBondContact CA-OH 3.36Å; Y76-Y81 HydrophobicContact CD1-CE2 4.2Å; D77-Y81 HydrophobicContact CB-CE1 4.38Å; D77-Y81 PolarHBondContact N-OH 3.37Å; D77-Y81 VanDerWaalsContact N-OH 3.12Å; D77-Y81 WeakPolarHBondContact O-CD1 3.47Å; D77-Y81 WeakPolarHBondContact O-CD2 3.48Å; D77-Y81 WeakPolarHBondContact O-CE1 3.36Å; D77-Y81 WeakPolarHBondContact O-CE2 3.47Å; D77-Y81 PolarHBondContact O-N 3.25Å; D77-Y81 VanDerWaalsContact O-N 3.14Å; F78-Y81 HydrophobicContact CD1-CD2 4.24Å; F78-Y81 HydrophobicContact CD1-CE2 4.46Å; D79-Y81 VanDerWaalsContact C-N 3.32Å; D79-Y81 PolarHBondContact O-N 3.36Å; Y81-A85 VanDerWaalsContact O-CB 3.23Å; Y81-A85 WeakPolarHBondContact O-CB 3.38Å; Y81-A85 PolarHBondContact O-N 3.16Å
82	K	95.1	Very high	95.7	Very high	106 Å²	106	77.1 Å²	77.1	46%	0.461	40%	0.397	S	S	.	.	H	α-helix	trans	-67.3	-42	176.5	-175.2	-176.2	177.1	-173.2	0	111.2	F78 D79 A80 A85 L86	F78-K82 WeakPolarHBondContact O-CB 3.45Å; F78-K82 PolarHBondContact O-N 3.47Å; F78-K82 VanDerWaalsContact O-N 3.09Å; D79-K82 WeakPolarHBondContact O-CB 3.4Å; D79-K82 PolarHBondContact O-N 2.85Å; D79-K82 VanDerWaalsContact O-N 3.13Å; A80-K82 VanDerWaalsContact C-N 3.32Å; A80-K82 PolarHBondContact O-N 3.38Å; K82-A85 PolarHBondContact O-N 3.48Å; K82-L86 HydrophobicContact CG-CD1 4.14Å; K82-L86 WeakPolarHBondContact O-CB 3.38Å; K82-L86 VanDerWaalsContact O-CG 3.31Å; K82-L86 WeakPolarHBondContact O-CG 3.15Å; K82-L86 PolarHBondContact O-N 2.98Å
83	E	96.3	Very high	95.8	Very high	123 Å²	123	70.1 Å²	70.1	58%	0.575	37%	0.369	S	S	*	.	H	α-helix	trans	-63.1	-50	177.2	-168.7	-169.5	153.6	0	0	111.9	D79 A80 A85 L86 N87	D79-E83 PolarHBondContact O-N 3.47Å; A80-E83 PolarHBondContact O-N 3.07Å; E83-A85 VanDerWaalsContact C-N 3.32Å; E83-A85 PolarHBondContact O-N 3.29Å; E83-L86 PolarHBondContact O-N 2.89Å; E83-N87 WeakPolarHBondContact O-CB 3.17Å; E83-N87 PolarHBondContact O-N 3.49Å; E83-N87 PolarHBondContact O-ND2 3Å
84	V	97.1	Very high	95.9	Very high	53 Å²	53	70.1 Å²	70.1	32%	0.321	37%	0.369	S	S	.	.	H	α-helix	trans	-61.4	-40.9	177.7	171.4	0	0	0	0	111.3	A80 N87 M88 T137	A80-V84 WeakPolarHBondContact O-CG2 3.49Å; A80-V84 PolarHBondContact O-N 3.47Å; V84-N87 PolarHBondContact O-N 3.32Å; V84-M88 WeakPolarHBondContact O-CB 3.37Å; V84-M88 PolarHBondContact O-N 3.07Å; V84-T137 HydrophobicContact CG1-CG2 4.29Å
85	A	96.7	Very high	95.8	Very high	14 Å²	14	67 Å²	67	12%	0.116	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-48	175.2	0	0	0	0	0	112.2	Y81 K82 E83 N87 M88 Y89 C104	Y81-A85 VanDerWaalsContact O-CB 3.23Å; Y81-A85 WeakPolarHBondContact O-CB 3.38Å; Y81-A85 PolarHBondContact O-N 3.16Å; K82-A85 PolarHBondContact O-N 3.48Å; E83-A85 VanDerWaalsContact C-N 3.32Å; E83-A85 PolarHBondContact O-N 3.29Å; A85-N87 PolarHBondContact O-N 2.96Å; A85-M88 PolarHBondContact O-N 3.12Å; A85-Y89 WeakPolarHBondContact O-CD2 3.14Å; A85-Y89 PolarHBondContact O-N 2.8Å; A85-C104 HydrophobicContact CB-CB 3.84Å; A85-C104 WeakPolarHBondContact CB-O 3.22Å
86	L	95.8	Very high	95.7	Very high	36 Å²	36	62.8 Å²	62.8	19%	0.188	32%	0.316	C	S	.	.	H	α-helix	trans	-56.7	-49	174.9	-78.9	164.7	0	0	0	111.1	K82 E83 M88 Y89 E90 L381 L382	K82-L86 HydrophobicContact CG-CD1 4.14Å; K82-L86 WeakPolarHBondContact O-CB 3.38Å; K82-L86 VanDerWaalsContact O-CG 3.31Å; K82-L86 WeakPolarHBondContact O-CG 3.15Å; K82-L86 PolarHBondContact O-N 2.98Å; E83-L86 PolarHBondContact O-N 2.89Å; L86-M88 VanDerWaalsContact C-N 3.33Å; L86-M88 PolarHBondContact O-N 3.4Å; L86-Y89 PolarHBondContact O-N 3.2Å; L86-E90 WeakPolarHBondContact O-CG 3.27Å; L86-E90 PolarHBondContact O-N 3.41Å; L86-L381 HydrophobicContact CD2-CB 3.55Å; L86-L381 HydrophobicContact CD2-CD1 3.85Å; L86-L381 HydrophobicContact CD2-CG 4.32Å; L86-L382 HydrophobicContact CD1-CD2 4.46Å; L86-L382 HydrophobicContact CD2-CD2 4.48Å
87	N	96.6	Very high	95.5	Very high	26 Å²	26	63.6 Å²	63.6	14%	0.139	32%	0.324	C	S	.	.	H	α-helix	trans	-60.6	-40.1	179.3	-80.6	-37.9	0	0	0	112.7	E83 V84 A85 I91 K136 T137	E83-N87 WeakPolarHBondContact O-CB 3.17Å; E83-N87 PolarHBondContact O-N 3.49Å; E83-N87 PolarHBondContact O-ND2 3Å; V84-N87 PolarHBondContact O-N 3.32Å; A85-N87 PolarHBondContact O-N 2.96Å; N87-I91 WeakPolarHBondContact O-CD1 3.42Å; N87-I91 WeakPolarHBondContact O-CG1 3.36Å; N87-I91 PolarHBondContact O-N 3.36Å; N87-I91 VanDerWaalsContact O-N 3.11Å; N87-K136 HydrophobicContact CB-CD 4.15Å; N87-K136 WeakPolarHBondContact OD1-CE 3.36Å; N87-K136 PolarHBondContact OD1-NZ 3.35Å; N87-T137 HydrophobicContact CB-CG2 3.77Å
88	M	96.7	Very high	95.4	Very high	25 Å²	25	62.1 Å²	62.1	12%	0.123	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-52.6	173.5	-176.3	-169.6	73.4	0	0	111.1	V84 A85 L86 E90 I91 L92 C104 I133	V84-M88 WeakPolarHBondContact O-CB 3.37Å; V84-M88 PolarHBondContact O-N 3.07Å; A85-M88 PolarHBondContact O-N 3.12Å; L86-M88 VanDerWaalsContact C-N 3.33Å; L86-M88 PolarHBondContact O-N 3.4Å; M88-E90 VanDerWaalsContact C-N 3.32Å; M88-E90 PolarHBondContact O-N 3.4Å; M88-I91 PolarHBondContact O-N 3.04Å; M88-I91 VanDerWaalsContact O-N 3.17Å; M88-L92 HydrophobicContact CG-CD1 4.46Å; M88-L92 WeakPolarHBondContact O-CG 3.34Å; M88-L92 PolarHBondContact O-N 3.01Å; M88-C104 WeakPolarHBondContact CE-O 3.43Å; M88-I133 HydrophobicContact CG-CD1 4.13Å; M88-I133 HydrophobicContact CG-CG1 4.48Å
89	Y	96.3	Very high	95.3	Very high	9 Å²	9	55.7 Å²	55.7	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-34.5	-179.5	-85.7	-79.1	0	0	0	113	A85 L86 A93 I99 A101 S103 E106 A107 I377 L381	A85-Y89 WeakPolarHBondContact O-CD2 3.14Å; A85-Y89 PolarHBondContact O-N 2.8Å; L86-Y89 PolarHBondContact O-N 3.2Å; Y89-A93 VanDerWaalsContact O-CB 3.26Å; Y89-A93 WeakPolarHBondContact O-CB 3.35Å; Y89-A93 PolarHBondContact O-N 2.92Å; Y89-I99 HydrophobicContact CE1-CG2 4.26Å; Y89-A101 HydrophobicContact CE1-CB 3.77Å; Y89-A101 VanDerWaalsContact OH-CA 3.29Å; Y89-A101 WeakPolarHBondContact OH-CA 3.44Å; Y89-A101 WeakPolarHBondContact OH-CB 3.43Å; Y89-S103 WeakPolarHBondContact CE2-O 3.48Å; Y89-S103 PolarHBondContact OH-O 2.93Å; Y89-E106 PolarHBondContact OH-O 3.03Å; Y89-E106 VanDerWaalsContact OH-O 3.1Å; Y89-A107 HydrophobicContact CE1-CB 4.01Å; Y89-I377 HydrophobicContact CD1-CG2 4.37Å; Y89-L381 HydrophobicContact CD2-CD1 4.33Å; Y89-L381 HydrophobicContact CG-CD1 4.19Å
90	E	96.4	Very high	95.3	Very high	73 Å²	73	50.8 Å²	50.8	34%	0.341	26%	0.261	S	S	.	.	H	α-helix	trans	-64.1	-40.9	172.5	-76.5	-173.1	162	0	0	112.3	L86 M88 A93 S94 K136 K378	L86-E90 WeakPolarHBondContact O-CG 3.27Å; L86-E90 PolarHBondContact O-N 3.41Å; M88-E90 VanDerWaalsContact C-N 3.32Å; M88-E90 PolarHBondContact O-N 3.4Å; E90-A93 PolarHBondContact O-N 2.94Å; E90-S94 PolarHBondContact O-N 3.26Å; E90-K136 IonicContact OE2-NZ 2.7Å; E90-K136 PolarHBondContact OE2-NZ 2.94Å; E90-K378 IonicContact OE1-NZ 3.78Å; E90-K378 PolarHBondContact OE1-NZ 3.24Å
91	I	96.6	Very high	95.2	Very high	13 Å²	13	51.6 Å²	51.6	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-52.1	174.9	-69.6	162.4	0	0	0	109.9	N87 M88 A93 S94 Y95 D132 I133 K136	N87-I91 WeakPolarHBondContact O-CD1 3.42Å; N87-I91 WeakPolarHBondContact O-CG1 3.36Å; N87-I91 PolarHBondContact O-N 3.36Å; N87-I91 VanDerWaalsContact O-N 3.11Å; M88-I91 PolarHBondContact O-N 3.04Å; M88-I91 VanDerWaalsContact O-N 3.17Å; I91-A93 PolarHBondContact O-N 3.41Å; I91-S94 PolarHBondContact O-N 3.19Å; I91-S94 PolarHBondContact O-OG 3.03Å; I91-Y95 HydrophobicContact CG2-CD2 4.36Å; I91-Y95 HydrophobicContact CG2-CE2 4.07Å; I91-Y95 WeakPolarHBondContact O-CD2 3.43Å; I91-D132 HydrophobicContact CG2-CB 3.89Å; I91-I133 HydrophobicContact CD1-CG1 4.07Å; I91-I133 HydrophobicContact CG2-CG1 4.26Å; I91-K136 HydrophobicContact CD1-CB 3.75Å; I91-K136 HydrophobicContact CD1-CD 3.72Å; I91-K136 HydrophobicContact CD1-CG 4.35Å; I91-K136 HydrophobicContact CG1-CD 3.87Å
92	L	96.1	Very high	95	Very high	10 Å²	10	49 Å²	49	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-57.2	-40.9	-179.6	-60.1	-175.3	0	0	0	111.6	M88 S94 Y95 T96 I99 A107 I109 I129 I133	M88-L92 HydrophobicContact CG-CD1 4.46Å; M88-L92 WeakPolarHBondContact O-CG 3.34Å; M88-L92 PolarHBondContact O-N 3.01Å; L92-S94 PolarHBondContact O-N 2.91Å; L92-Y95 PolarHBondContact O-N 3.42Å; L92-T96 PolarHBondContact O-N 2.92Å; L92-T96 VanDerWaalsContact O-N 3.15Å; L92-I99 HydrophobicContact CB-CD1 3.63Å; L92-A107 HydrophobicContact CD1-CB 3.83Å; L92-I109 HydrophobicContact CB-CD1 4.38Å; L92-I109 HydrophobicContact CD1-CD1 4.05Å; L92-I109 HydrophobicContact CD2-CD1 3.69Å; L92-I109 HydrophobicContact CG-CD1 4.23Å; L92-I129 HydrophobicContact CD2-CG2 3.62Å; L92-I133 HydrophobicContact CD2-CD1 4.32Å
93	A	95.5	Very high	95	Very high	26 Å²	26	46.2 Å²	46.2	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-22	177.7	0	0	0	0	0	114.3	Y89 E90 I91 Y95 T96 I99 I377	Y89-A93 VanDerWaalsContact O-CB 3.26Å; Y89-A93 WeakPolarHBondContact O-CB 3.35Å; Y89-A93 PolarHBondContact O-N 2.92Å; E90-A93 PolarHBondContact O-N 2.94Å; I91-A93 PolarHBondContact O-N 3.41Å; A93-Y95 VanDerWaalsContact C-N 3.32Å; A93-T96 WeakPolarHBondContact CA-O 3.26Å; A93-I99 HydrophobicContact CB-CD1 4.42Å; A93-I377 HydrophobicContact CB-CD1 4.1Å
94	S	95.2	Very high	94.9	Very high	94 Å²	94	44.3 Å²	44.3	66%	0.657	25%	0.254	S	S	*	.	H	α-helix	trans	-76.8	-17.3	172.4	68.8	0	0	0	0	113.7	E90 I91 L92	E90-S94 PolarHBondContact O-N 3.26Å; I91-S94 PolarHBondContact O-N 3.19Å; I91-S94 PolarHBondContact O-OG 3.03Å; L92-S94 PolarHBondContact O-N 2.91Å
95	Y	93.9	Very high	94.8	Very high	63 Å²	63	47 Å²	47	25%	0.247	27%	0.267	C	S	.	.	H	α-helix	trans	-91.2	-47.3	173.5	-77	-86.6	0	0	0	112.6	I91 L92 A93 L114 L125 I129 D132	I91-Y95 HydrophobicContact CG2-CD2 4.36Å; I91-Y95 HydrophobicContact CG2-CE2 4.07Å; I91-Y95 WeakPolarHBondContact O-CD2 3.43Å; L92-Y95 PolarHBondContact O-N 3.42Å; A93-Y95 VanDerWaalsContact C-N 3.32Å; Y95-L114 HydrophobicContact CD1-CD2 4.36Å; Y95-L125 HydrophobicContact CD1-CD1 3.83Å; Y95-L125 HydrophobicContact CE1-CD1 3.94Å; Y95-I129 HydrophobicContact CD1-CG1 4.3Å; Y95-I129 HydrophobicContact CD2-CG1 3.94Å; Y95-I129 HydrophobicContact CE1-CG1 4.14Å; Y95-I129 HydrophobicContact CE2-CG1 3.8Å; Y95-I129 HydrophobicContact CG-CD1 4.45Å; Y95-I129 HydrophobicContact CG-CG1 4.19Å; Y95-D132 WeakPolarHBondContact CE2-OD2 3.45Å; Y95-D132 PolarHBondContact OH-OD2 3.1Å
96	T	93	Very high	94.8	Very high	17 Å²	17	49.1 Å²	49.1	10%	0.104	27%	0.274	C	S	.	.			trans	-157.2	159	175.6	179.9	0	0	0	0	111.6	L92 A93 D98 I99 I109	L92-T96 PolarHBondContact O-N 2.92Å; L92-T96 VanDerWaalsContact O-N 3.15Å; A93-T96 WeakPolarHBondContact CA-O 3.26Å; T96-D98 HydrophobicContact CG2-CB 4.37Å; T96-D98 WeakPolarHBondContact OG1-CB 3.35Å; T96-D98 PolarHBondContact OG1-N 3.42Å; T96-D98 PolarHBondContact OG1-OD2 3.11Å; T96-D98 VanDerWaalsContact OG1-OD2 3.13Å; T96-I99 WeakPolarHBondContact O-CD1 3.33Å; T96-I109 HydrophobicContact CG2-CG2 3.33Å
97	H	91.5	Very high	94.8	Very high	146 Å²	146	48.8 Å²	48.8	68%	0.676	28%	0.277	S	S	*	.	S	Bend	trans	-89.8	-7.7	170.9	-63.9	78.3	0	0	0	112.6	I99	H97-I99 PolarHBondContact O-N 3.29Å
98	D	93.1	Very high	94.8	Very high	53 Å²	53	48.5 Å²	48.5	28%	0.283	28%	0.275	S	S	.	.			trans	-77.8	53.7	-177.2	-60.3	-44.8	0	0	0	112.4	T96 I109 D110 F240	T96-D98 HydrophobicContact CG2-CB 4.37Å; T96-D98 WeakPolarHBondContact OG1-CB 3.35Å; T96-D98 PolarHBondContact OG1-N 3.42Å; T96-D98 PolarHBondContact OG1-OD2 3.11Å; T96-D98 VanDerWaalsContact OG1-OD2 3.13Å; D98-I109 WeakPolarHBondContact O-CA 3.37Å; D98-D110 HydrophobicContact CB-CB 4.09Å; D98-D110 PolarHBondContact O-N 3.13Å; D98-F240 VanDerWaalsContact C-CD1 3.45Å; D98-F240 HydrophobicContact CB-CD1 4.3Å; D98-F240 HydrophobicContact CB-CE1 3.56Å; D98-F240 HydrophobicContact CB-CZ 3.84Å
99	I	94.2	Very high	94.8	Very high	10 Å²	10	50 Å²	50	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.1	-172.2	-57.3	171.1	0	0	0	110.4	Y89 L92 A93 T96 H97 A107 L108 I109 I377	Y89-I99 HydrophobicContact CE1-CG2 4.26Å; L92-I99 HydrophobicContact CB-CD1 3.63Å; A93-I99 HydrophobicContact CB-CD1 4.42Å; T96-I99 WeakPolarHBondContact O-CD1 3.33Å; H97-I99 PolarHBondContact O-N 3.29Å; I99-A107 HydrophobicContact CG2-CB 4.11Å; I99-L108 CarbonylContact C-O 3.58Å; I99-L108 WeakPolarHBondContact CA-O 3.48Å; I99-I109 HydrophobicContact CG1-CG1 4.47Å; I99-I377 HydrophobicContact CD1-CD1 4.18Å
100	E	94.9	Very high	94.7	Very high	24 Å²	24	52.3 Å²	52.3	11%	0.112	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	110.7	163.6	176.9	175.6	168.8	0	0	110.3	L102 L108 V238 R239 K242	E100-L102 HydrophobicContact CG-CD2 4.31Å; E100-L102 PolarHBondContact O-N 3.48Å; E100-L108 HydrophobicContact CB-CB 4.23Å; E100-L108 PolarHBondContact N-O 3.31Å; E100-L108 PolarHBondContact O-N 3.49Å; E100-V238 HydrophobicContact CB-CG1 3.43Å; E100-V238 VanDerWaalsContact CB-CG1 3.43Å; E100-R239 WeakPolarHBondContact CG-O 3.47Å; E100-R239 PolarHBondContact OE2-N 3.23Å; E100-K242 VanDerWaalsContact CD-NZ 3.31Å; E100-K242 VanDerWaalsContact CG-CE 3.45Å; E100-K242 WeakPolarHBondContact OE1-CE 3.31Å; E100-K242 IonicContact OE1-NZ 3.92Å; E100-K242 PolarHBondContact OE1-NZ 2.86Å
101	A	92.5	Very high	94.6	Very high	51 Å²	51	50 Å²	50	42%	0.421	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	129.3	171.4	0	0	0	0	0	111.4	Y89 K242	Y89-A101 HydrophobicContact CE1-CB 3.77Å; Y89-A101 VanDerWaalsContact OH-CA 3.29Å; Y89-A101 WeakPolarHBondContact OH-CA 3.44Å; Y89-A101 WeakPolarHBondContact OH-CB 3.43Å; A101-K242 PolarHBondContact O-NZ 3.36Å
102	L	92.7	Very high	94.4	Very high	58 Å²	58	53.4 Å²	53.4	30%	0.304	32%	0.315	S	S	.	.			trans	-109	-48.9	175.1	-61.8	-176.5	0	0	0	112.2	E100 E106 L108	E100-L102 HydrophobicContact CG-CD2 4.31Å; E100-L102 PolarHBondContact O-N 3.48Å; L102-E106 HydrophobicContact CB-CB 4.23Å; L102-E106 WeakPolarHBondContact CB-O 3.33Å; L102-E106 HydrophobicContact CD1-CB 4.47Å; L102-E106 PolarHBondContact N-O 3.35Å; L102-E106 VanDerWaalsContact N-O 3.12Å; L102-L108 HydrophobicContact CD1-CD1 4.14Å; L102-L108 HydrophobicContact CD1-CD2 4.08Å; L102-L108 HydrophobicContact CD1-CG 3.74Å; L102-L108 HydrophobicContact CD2-CD1 4.01Å; L102-L108 HydrophobicContact CD2-CG 4.3Å; L102-L108 HydrophobicContact CG-CD1 4.32Å; L102-L108 HydrophobicContact CG-CG 4.06Å
103	S	93.8	Very high	94.2	Very high	46 Å²	46	59 Å²	59	32%	0.322	34%	0.34	S	S	.	.	S	Bend	trans	-147	-174.8	177.2	59.4	0	0	0	0	110.1	Y89 D105 E106	Y89-S103 WeakPolarHBondContact CE2-O 3.48Å; Y89-S103 PolarHBondContact OH-O 2.93Å; S103-D105 WeakPolarHBondContact CB-OD1 3.5Å; S103-D105 PolarHBondContact O-N 3.37Å; S103-D105 PolarHBondContact OG-N 3.4Å; S103-D105 PolarHBondContact OG-OD1 2.92Å; S103-E106 PolarHBondContact N-O 3.21Å; S103-E106 WeakPolarHBondContact OG-CB 3.42Å; S103-E106 PolarHBondContact OG-N 3.43Å
104	C	94	Very high	94.1	Very high	84 Å²	84	59.1 Å²	59.1	57%	0.568	34%	0.337	S	S	*	.	S	Bend	trans	-65.5	-23.3	172.2	50	0	0	0	0	113.2	A85 M88	A85-C104 HydrophobicContact CB-CB 3.84Å; A85-C104 WeakPolarHBondContact CB-O 3.22Å; M88-C104 WeakPolarHBondContact CE-O 3.43Å
105	D	95.5	Very high	94	Very high	109 Å²	109	56.5 Å²	56.5	58%	0.583	32%	0.315	S	S	*	.	S	Bend	trans	-120.4	-3.5	-174.1	68.4	-37.5	0	0	0	114.6	S103	S103-D105 WeakPolarHBondContact CB-OD1 3.5Å; S103-D105 PolarHBondContact O-N 3.37Å; S103-D105 PolarHBondContact OG-N 3.4Å; S103-D105 PolarHBondContact OG-OD1 2.92Å
106	E	96.2	Very high	93.9	Very high	58 Å²	58	57.5 Å²	57.5	27%	0.271	34%	0.337	S	S	.	.			trans	-131.4	135.8	176.2	-56.1	-163.6	149.5	0	0	111.2	Y89 L102 S103 R153 K160	Y89-E106 PolarHBondContact OH-O 3.03Å; Y89-E106 VanDerWaalsContact OH-O 3.1Å; L102-E106 HydrophobicContact CB-CB 4.23Å; L102-E106 WeakPolarHBondContact CB-O 3.33Å; L102-E106 HydrophobicContact CD1-CB 4.47Å; L102-E106 PolarHBondContact N-O 3.35Å; L102-E106 VanDerWaalsContact N-O 3.12Å; S103-E106 PolarHBondContact N-O 3.21Å; S103-E106 WeakPolarHBondContact OG-CB 3.42Å; S103-E106 PolarHBondContact OG-N 3.43Å; E106-R153 IonicContact OE2-NH2 3.16Å; E106-R153 PolarHBondContact OE2-NH2 2.98Å; E106-K160 IonicContact OE1-NZ 3.22Å; E106-K160 PolarHBondContact OE1-NZ 3.35Å
107	A	96.2	Very high	93.9	Very high	29 Å²	29	63.3 Å²	63.3	24%	0.24	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	160.6	171.8	0	0	0	0	0	110.1	Y89 L92 I99	Y89-A107 HydrophobicContact CE1-CB 4.01Å; L92-A107 HydrophobicContact CD1-CB 3.83Å; I99-A107 HydrophobicContact CG2-CB 4.11Å
108	L	96.8	Very high	93.9	Very high	20 Å²	20	60.5 Å²	60.5	11%	0.105	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	147.6	163.9	-57.5	167.4	0	0	0	108.4	I99 E100 L102 I149 R153 V238	I99-L108 CarbonylContact C-O 3.58Å; I99-L108 WeakPolarHBondContact CA-O 3.48Å; E100-L108 HydrophobicContact CB-CB 4.23Å; E100-L108 PolarHBondContact N-O 3.31Å; E100-L108 PolarHBondContact O-N 3.49Å; L102-L108 HydrophobicContact CD1-CD1 4.14Å; L102-L108 HydrophobicContact CD1-CD2 4.08Å; L102-L108 HydrophobicContact CD1-CG 3.74Å; L102-L108 HydrophobicContact CD2-CD1 4.01Å; L102-L108 HydrophobicContact CD2-CG 4.3Å; L102-L108 HydrophobicContact CG-CD1 4.32Å; L102-L108 HydrophobicContact CG-CG 4.06Å; L108-I149 HydrophobicContact CD1-CB 4.49Å; L108-I149 HydrophobicContact CD1-CD1 4.1Å; L108-I149 HydrophobicContact CD1-CG1 4.2Å; L108-I149 HydrophobicContact CD1-CG2 3.56Å; L108-I149 HydrophobicContact CD2-CG2 4.26Å; L108-R153 HydrophobicContact CD2-CG 3.97Å; L108-V238 HydrophobicContact CB-CG1 4.46Å
109	I	95.8	Very high	93.8	Very high	57 Å²	57	61.3 Å²	61.3	29%	0.292	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.7	-179.7	-51.1	177.6	0	0	0	106.9	L92 T96 D98 I99	L92-I109 HydrophobicContact CB-CD1 4.38Å; L92-I109 HydrophobicContact CD1-CD1 4.05Å; L92-I109 HydrophobicContact CD2-CD1 3.69Å; L92-I109 HydrophobicContact CG-CD1 4.23Å; T96-I109 HydrophobicContact CG2-CG2 3.33Å; D98-I109 WeakPolarHBondContact O-CA 3.37Å; I99-I109 HydrophobicContact CG1-CG1 4.47Å
110	D	95.4	Very high	93.8	Very high	58 Å²	58	63.7 Å²	63.7	31%	0.31	39%	0.391	S	S	.	.			trans	-85.7	107.4	162.6	-162.7	-24.4	0	0	0	108.5	D98 S112 V238	D98-D110 HydrophobicContact CB-CB 4.09Å; D98-D110 PolarHBondContact O-N 3.13Å; D110-S112 WeakPolarHBondContact OD1-CB 3.33Å; D110-S112 PolarHBondContact OD1-N 3.26Å; D110-S112 PolarHBondContact OD1-OG 3.04Å; D110-V238 HydrophobicContact CB-CB 4.4Å; D110-V238 HydrophobicContact CB-CG2 4.09Å
111	A	93.9	Very high	93.8	Very high	23 Å²	23	66.7 Å²	66.7	19%	0.19	41%	0.411	C	S	.	.			trans	-94	4.3	179.8	0	0	0	0	0	112.7	H113 L114 L115 L125	A111-H113 PolarHBondContact O-N 3.07Å; A111-L114 PolarHBondContact O-N 3.03Å; A111-L115 HydrophobicContact CB-CD1 3.92Å; A111-L115 HydrophobicContact CB-CG 4.11Å; A111-L115 WeakPolarHBondContact O-CB 3.35Å; A111-L115 VanDerWaalsContact O-CG 3.27Å; A111-L115 WeakPolarHBondContact O-CG 3.46Å; A111-L115 PolarHBondContact O-N 2.95Å; A111-L125 HydrophobicContact CB-CD2 3.88Å
112	S	92.7	Very high	93.9	Very high	86 Å²	86	65.9 Å²	65.9	60%	0.601	40%	0.402	S	S	*	.	H	α-helix	trans	-60.6	-43.3	-169.1	-53.8	0	0	0	0	113	D110 A116	D110-S112 WeakPolarHBondContact OD1-CB 3.33Å; D110-S112 PolarHBondContact OD1-N 3.26Å; D110-S112 PolarHBondContact OD1-OG 3.04Å; S112-A116 PolarHBondContact O-N 2.79Å
113	H	91.8	Very high	94	Very high	128 Å²	128	65.8 Å²	65.8	59%	0.593	40%	0.401	S	S	*	.	H	α-helix	trans	-70.3	-47.3	175.7	-169.5	-78.8	0	0	0	111.7	A111 L115 A116 E117	A111-H113 PolarHBondContact O-N 3.07Å; H113-L115 VanDerWaalsContact C-N 3.34Å; H113-L115 PolarHBondContact O-N 3.48Å; H113-A116 PolarHBondContact O-N 3.43Å; H113-A116 VanDerWaalsContact O-N 3.12Å; H113-E117 IonicContact CE1-OE2 2.68Å; H113-E117 PolarHBondContact CE1-OE2 3.07Å; H113-E117 VanDerWaalsContact CE1-OE2 3.31Å; H113-E117 IonicContact ND1-OE2 3.62Å; H113-E117 PolarHBondContact ND1-OE2 3.05Å; H113-E117 WeakPolarHBondContact O-CB 3.33Å; H113-E117 PolarHBondContact O-N 3.24Å
114	L	92.2	Very high	94.1	Very high	28 Å²	28	65.6 Å²	65.6	15%	0.147	40%	0.403	C	S	.	.	H	α-helix	trans	-59.4	-41.7	-177.9	-179.1	63.3	0	0	0	112.5	Y95 A111 E117 V118 L125	Y95-L114 HydrophobicContact CD1-CD2 4.36Å; A111-L114 PolarHBondContact O-N 3.03Å; L114-E117 PolarHBondContact O-N 2.61Å; L114-V118 HydrophobicContact CD1-CG2 3.82Å; L114-V118 WeakPolarHBondContact O-CB 3.24Å; L114-V118 WeakPolarHBondContact O-CG2 3.3Å; L114-V118 PolarHBondContact O-N 2.9Å; L114-L125 HydrophobicContact CD2-CD1 4.05Å; L114-L125 HydrophobicContact CD2-CD2 3.95Å; L114-L125 HydrophobicContact CG-CD2 4.47Å
115	L	93.5	Very high	94.1	Very high	39 Å²	39	62.6 Å²	62.6	20%	0.204	38%	0.381	C	S	.	.	H	α-helix	trans	-66.6	-37.1	176.6	-70.2	167.9	0	0	0	112.2	A111 H113 G119 V120 P122 L125	A111-L115 HydrophobicContact CB-CD1 3.92Å; A111-L115 HydrophobicContact CB-CG 4.11Å; A111-L115 WeakPolarHBondContact O-CB 3.35Å; A111-L115 VanDerWaalsContact O-CG 3.27Å; A111-L115 WeakPolarHBondContact O-CG 3.46Å; A111-L115 PolarHBondContact O-N 2.95Å; H113-L115 VanDerWaalsContact C-N 3.34Å; H113-L115 PolarHBondContact O-N 3.48Å; L115-G119 WeakPolarHBondContact O-CA 3.25Å; L115-G119 PolarHBondContact O-N 3.24Å; L115-V120 HydrophobicContact CD2-CG2 4.18Å; L115-V120 WeakPolarHBondContact CD2-O 3.27Å; L115-P122 HydrophobicContact CD1-CB 4.46Å; L115-P122 HydrophobicContact CD1-CG 4.12Å; L115-L125 HydrophobicContact CD2-CB 4.08Å; L115-L125 HydrophobicContact CD2-CD2 3.71Å; L115-L125 HydrophobicContact CG-CD2 4.07Å
116	A	92.7	Very high	94.2	Very high	84 Å²	84	57.6 Å²	57.6	69%	0.694	35%	0.354	S	S	*	.	H	α-helix	trans	-71	-35.8	177	0	0	0	0	0	112.6	S112 H113	S112-A116 PolarHBondContact O-N 2.79Å; H113-A116 PolarHBondContact O-N 3.43Å; H113-A116 VanDerWaalsContact O-N 3.12Å
117	E	92.6	Very high	94.2	Very high	139 Å²	139	60.7 Å²	60.7	65%	0.65	37%	0.369	S	S	*	.	H	α-helix	trans	-74	-44.7	179.1	-175.8	175.8	171.1	0	0	112.6	H113 L114	H113-E117 IonicContact CE1-OE2 2.68Å; H113-E117 PolarHBondContact CE1-OE2 3.07Å; H113-E117 VanDerWaalsContact CE1-OE2 3.31Å; H113-E117 IonicContact ND1-OE2 3.62Å; H113-E117 PolarHBondContact ND1-OE2 3.05Å; H113-E117 WeakPolarHBondContact O-CB 3.33Å; H113-E117 PolarHBondContact O-N 3.24Å; L114-E117 PolarHBondContact O-N 2.61Å
118	V	91.4	Very high	94.2	Very high	87 Å²	87	61.2 Å²	61.2	53%	0.527	37%	0.373	S	S	.	.	H	α-helix	trans	-87.4	-19.1	-176.1	-175.2	0	0	0	0	112.2	L114 V120	L114-V118 HydrophobicContact CD1-CG2 3.82Å; L114-V118 WeakPolarHBondContact O-CB 3.24Å; L114-V118 WeakPolarHBondContact O-CG2 3.3Å; L114-V118 PolarHBondContact O-N 2.9Å; V118-V120 VanDerWaalsContact C-N 3.29Å; V118-V120 HydrophobicContact CB-CG2 4.15Å; V118-V120 HydrophobicContact CG1-CG1 3.91Å; V118-V120 HydrophobicContact CG1-CG2 3.89Å; V118-V120 PolarHBondContact O-N 2.93Å
119	G	91.3	Very high	94.2	Very high	69 Å²	69	61 Å²	61	71%	0.711	37%	0.372	S	S	*	.			trans	70.5	20.1	176.2	0	0	0	0	0	114.9	L115	L115-G119 WeakPolarHBondContact O-CA 3.25Å; L115-G119 PolarHBondContact O-N 3.24Å
120	V	93.4	Very high	94.3	Very high	61 Å²	61	60.3 Å²	60.3	37%	0.37	37%	0.366	S	S	.	.			trans	-97.7	159.3	-178.7	-69.9	0	0	0	0	112.5	L115 V118 A124 L125	L115-V120 HydrophobicContact CD2-CG2 4.18Å; L115-V120 WeakPolarHBondContact CD2-O 3.27Å; V118-V120 VanDerWaalsContact C-N 3.29Å; V118-V120 HydrophobicContact CB-CG2 4.15Å; V118-V120 HydrophobicContact CG1-CG1 3.91Å; V118-V120 HydrophobicContact CG1-CG2 3.89Å; V118-V120 PolarHBondContact O-N 2.93Å; V120-A124 HydrophobicContact CB-CB 4.5Å; V120-L125 HydrophobicContact CG2-CB 4.46Å
121	T	94.6	Very high	94.4	Very high	86 Å²	86	60.3 Å²	60.3	53%	0.528	37%	0.373	S	S	.	.			trans	-72.1	151.9	174	61.6	0	0	0	0	111.2	D123 A124 L125	T121-D123 PolarHBondContact O-N 2.88Å; T121-A124 PolarHBondContact O-N 3.38Å; T121-A124 VanDerWaalsContact O-N 3.13Å; T121-A124 WeakPolarHBondContact OG1-CB 3.24Å; T121-A124 PolarHBondContact OG1-N 3.32Å; T121-L125 PolarHBondContact O-N 3.05Å
122	P	94.6	Very high	94.6	Very high	35 Å²	35	62.6 Å²	62.6	23%	0.227	38%	0.382	C	S	.	.	H	α-helix	trans	-53.6	-41.1	174.4	-26.4	34.3	0	0	0	112.8	L115 A124 L125 A126 M145 F166	L115-P122 HydrophobicContact CD1-CB 4.46Å; L115-P122 HydrophobicContact CD1-CG 4.12Å; P122-A124 PolarHBondContact O-N 3.11Å; P122-L125 PolarHBondContact O-N 3.45Å; P122-A126 WeakPolarHBondContact O-CB 3.43Å; P122-A126 PolarHBondContact O-N 3.5Å; P122-M145 HydrophobicContact CB-SD 3.59Å; P122-M145 VanDerWaalsContact CB-SD 3.59Å; P122-F166 HydrophobicContact CG-CE1 4.31Å; P122-F166 HydrophobicContact CG-CZ 4.3Å
123	D	95.3	Very high	94.8	Very high	56 Å²	56	59 Å²	59	30%	0.299	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-40	178	-80.4	-74.2	0	0	0	113.5	T121 A126 E127 Q164	T121-D123 PolarHBondContact O-N 2.88Å; D123-A126 PolarHBondContact O-N 3.03Å; D123-E127 WeakPolarHBondContact O-CB 3.43Å; D123-E127 PolarHBondContact O-N 3.24Å; D123-Q164 PolarHBondContact O-NE2 3.02Å; D123-Q164 PolarHBondContact OD1-NE2 3.01Å
124	A	95.6	Very high	95.1	Very high	42 Å²	42	59.4 Å²	59.4	35%	0.347	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-41.1	177.1	0	0	0	0	0	111.7	V120 T121 P122 E127 A128	V120-A124 HydrophobicContact CB-CB 4.5Å; T121-A124 PolarHBondContact O-N 3.38Å; T121-A124 VanDerWaalsContact O-N 3.13Å; T121-A124 WeakPolarHBondContact OG1-CB 3.24Å; T121-A124 PolarHBondContact OG1-N 3.32Å; P122-A124 PolarHBondContact O-N 3.11Å; A124-E127 PolarHBondContact O-N 3.36Å; A124-A128 PolarHBondContact O-N 2.82Å
125	L	95.6	Very high	95.3	Very high	21 Å²	21	61.2 Å²	61.2	11%	0.11	38%	0.379	C	S	.	.	H	α-helix	trans	-64.1	-42.6	174.7	178.7	62.9	0	0	0	111.7	Y95 A111 L114 L115 V120 T121 P122 E127 A128 I129	Y95-L125 HydrophobicContact CD1-CD1 3.83Å; Y95-L125 HydrophobicContact CE1-CD1 3.94Å; A111-L125 HydrophobicContact CB-CD2 3.88Å; L114-L125 HydrophobicContact CD2-CD1 4.05Å; L114-L125 HydrophobicContact CD2-CD2 3.95Å; L114-L125 HydrophobicContact CG-CD2 4.47Å; L115-L125 HydrophobicContact CD2-CB 4.08Å; L115-L125 HydrophobicContact CD2-CD2 3.71Å; L115-L125 HydrophobicContact CG-CD2 4.07Å; V120-L125 HydrophobicContact CG2-CB 4.46Å; T121-L125 PolarHBondContact O-N 3.05Å; P122-L125 PolarHBondContact O-N 3.45Å; L125-E127 VanDerWaalsContact C-N 3.33Å; L125-E127 PolarHBondContact O-N 2.92Å; L125-A128 PolarHBondContact O-N 3.38Å; L125-I129 HydrophobicContact CD1-CD1 3.92Å; L125-I129 HydrophobicContact CD1-CG1 4.3Å; L125-I129 HydrophobicContact CG-CD1 3.93Å; L125-I129 WeakPolarHBondContact O-CG1 3.33Å; L125-I129 PolarHBondContact O-N 2.88Å
126	A	96.5	Very high	95.5	Very high	3 Å²	3	64.1 Å²	64.1	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-64.6	-36.4	176.7	0	0	0	0	0	112.6	P122 D123 R130 V143 M145 Q164	P122-A126 WeakPolarHBondContact O-CB 3.43Å; P122-A126 PolarHBondContact O-N 3.5Å; D123-A126 PolarHBondContact O-N 3.03Å; A126-R130 WeakPolarHBondContact O-CB 3.49Å; A126-R130 WeakPolarHBondContact O-CD 3.46Å; A126-R130 WeakPolarHBondContact O-CG 3.43Å; A126-R130 PolarHBondContact O-N 3.15Å; A126-R130 VanDerWaalsContact O-N 3.11Å; A126-V143 HydrophobicContact CB-CB 4.11Å; A126-V143 HydrophobicContact CB-CG1 3.75Å; A126-M145 HydrophobicContact CB-CE 3.68Å; A126-M145 HydrophobicContact CB-SD 3.64Å; A126-Q164 HydrophobicContact CB-CB 4.41Å
127	E	97.1	Very high	95.6	Very high	124 Å²	124	61.2 Å²	61.2	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-67.2	-46.9	175.5	-176.7	165.3	-154.9	0	0	111.4	D123 A124 L125 R130 A131	D123-E127 WeakPolarHBondContact O-CB 3.43Å; D123-E127 PolarHBondContact O-N 3.24Å; A124-E127 PolarHBondContact O-N 3.36Å; L125-E127 VanDerWaalsContact C-N 3.33Å; L125-E127 PolarHBondContact O-N 2.92Å; E127-R130 PolarHBondContact O-N 3.33Å; E127-A131 WeakPolarHBondContact O-CB 3.37Å; E127-A131 PolarHBondContact O-N 2.87Å
128	A	96.4	Very high	95.8	Very high	39 Å²	39	56.7 Å²	56.7	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-57.8	-51.2	176.4	0	0	0	0	0	112.2	A124 L125 R130 A131 D132	A124-A128 PolarHBondContact O-N 2.82Å; L125-A128 PolarHBondContact O-N 3.38Å; A128-R130 VanDerWaalsContact C-N 3.29Å; A128-R130 PolarHBondContact O-N 3.33Å; A128-A131 WeakPolarHBondContact O-CB 3.37Å; A128-A131 PolarHBondContact O-N 3.45Å; A128-A131 VanDerWaalsContact O-N 3.11Å; A128-D132 PolarHBondContact O-N 3.11Å
129	I	96.6	Very high	96	Very high	17 Å²	17	55.2 Å²	55.2	9%	0.087	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-40.2	177.5	-69.2	168.9	0	0	0	111.4	L92 Y95 L125 I133	L92-I129 HydrophobicContact CD2-CG2 3.62Å; Y95-I129 HydrophobicContact CD1-CG1 4.3Å; Y95-I129 HydrophobicContact CD2-CG1 3.94Å; Y95-I129 HydrophobicContact CE1-CG1 4.14Å; Y95-I129 HydrophobicContact CE2-CG1 3.8Å; Y95-I129 HydrophobicContact CG-CD1 4.45Å; Y95-I129 HydrophobicContact CG-CG1 4.19Å; L125-I129 HydrophobicContact CD1-CD1 3.92Å; L125-I129 HydrophobicContact CD1-CG1 4.3Å; L125-I129 HydrophobicContact CG-CD1 3.93Å; L125-I129 WeakPolarHBondContact O-CG1 3.33Å; L125-I129 PolarHBondContact O-N 2.88Å; I129-I133 HydrophobicContact CG2-CD1 3.79Å; I129-I133 WeakPolarHBondContact O-CB 3.28Å; I129-I133 WeakPolarHBondContact O-CD1 3.3Å; I129-I133 VanDerWaalsContact O-CG1 3.25Å; I129-I133 WeakPolarHBondContact O-CG1 3.29Å; I129-I133 PolarHBondContact O-N 2.97Å
130	R	97.7	Very high	96.2	Very high	42 Å²	42	55 Å²	55	16%	0.158	33%	0.333	C	S	.	.	H	α-helix	trans	-68	-38.2	177.3	-74.6	169.6	63.4	-128.6	-11.6	112.2	A126 E127 A128 R134 A141 V143 N162	A126-R130 WeakPolarHBondContact O-CB 3.49Å; A126-R130 WeakPolarHBondContact O-CD 3.46Å; A126-R130 WeakPolarHBondContact O-CG 3.43Å; A126-R130 PolarHBondContact O-N 3.15Å; A126-R130 VanDerWaalsContact O-N 3.11Å; E127-R130 PolarHBondContact O-N 3.33Å; A128-R130 VanDerWaalsContact C-N 3.29Å; A128-R130 PolarHBondContact O-N 3.33Å; R130-R134 WeakPolarHBondContact O-CB 3.49Å; R130-R134 PolarHBondContact O-N 3.13Å; R130-A141 HydrophobicContact CG-CB 4.29Å; R130-A141 PolarHBondContact NE-O 3.16Å; R130-V143 HydrophobicContact CG-CG2 3.64Å; R130-N162 PolarHBondContact NH2-O 3.08Å; R130-N162 PolarHBondContact NH2-OD1 3.16Å; R130-N162 VanDerWaalsContact NH2-OD1 3.16Å
131	A	97.6	Very high	96.4	Very high	57 Å²	57	53.1 Å²	53.1	47%	0.471	33%	0.325	S	S	.	.	H	α-helix	trans	-64.7	-46.7	176.2	0	0	0	0	0	111.2	E127 A128 R134 G135	E127-A131 WeakPolarHBondContact O-CB 3.37Å; E127-A131 PolarHBondContact O-N 2.87Å; A128-A131 WeakPolarHBondContact O-CB 3.37Å; A128-A131 PolarHBondContact O-N 3.45Å; A128-A131 VanDerWaalsContact O-N 3.11Å; A131-R134 PolarHBondContact O-N 2.78Å; A131-G135 PolarHBondContact O-N 3.1Å
132	D	97.4	Very high	96.6	Very high	71 Å²	71	50.3 Å²	50.3	38%	0.38	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-45	178.7	-72.3	-14.6	0	0	0	112.4	I91 Y95 A128 R134 G135 K136	I91-D132 HydrophobicContact CG2-CB 3.89Å; Y95-D132 WeakPolarHBondContact CE2-OD2 3.45Å; Y95-D132 PolarHBondContact OH-OD2 3.1Å; A128-D132 PolarHBondContact O-N 3.11Å; D132-R134 VanDerWaalsContact C-N 3.31Å; D132-R134 PolarHBondContact O-N 3.26Å; D132-G135 PolarHBondContact O-N 3.09Å; D132-K136 PolarHBondContact O-N 3.48Å
133	I	97.2	Very high	96.7	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.062	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-46.2	175.1	-69.3	167.3	0	0	0	109.8	M88 I91 L92 I129 G135 T137 A141	M88-I133 HydrophobicContact CG-CD1 4.13Å; M88-I133 HydrophobicContact CG-CG1 4.48Å; I91-I133 HydrophobicContact CD1-CG1 4.07Å; I91-I133 HydrophobicContact CG2-CG1 4.26Å; L92-I133 HydrophobicContact CD2-CD1 4.32Å; I129-I133 HydrophobicContact CG2-CD1 3.79Å; I129-I133 WeakPolarHBondContact O-CB 3.28Å; I129-I133 WeakPolarHBondContact O-CD1 3.3Å; I129-I133 VanDerWaalsContact O-CG1 3.25Å; I129-I133 WeakPolarHBondContact O-CG1 3.29Å; I129-I133 PolarHBondContact O-N 2.97Å; I133-G135 VanDerWaalsContact C-N 3.34Å; I133-G135 PolarHBondContact O-N 3.2Å; I133-T137 WeakPolarHBondContact O-CB 3.46Å; I133-T137 PolarHBondContact O-N 2.84Å; I133-T137 PolarHBondContact O-OG1 3.01Å; I133-A141 HydrophobicContact CD1-CB 4.05Å; I133-A141 HydrophobicContact CG2-CB 4.15Å
134	R	97.4	Very high	96.9	Very high	135 Å²	135	48.2 Å²	48.2	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-36.6	178.4	-179.9	59	174.4	-159.7	-10.4	112.4	R130 A131 D132 G138 C139 C140	R130-R134 WeakPolarHBondContact O-CB 3.49Å; R130-R134 PolarHBondContact O-N 3.13Å; A131-R134 PolarHBondContact O-N 2.78Å; D132-R134 VanDerWaalsContact C-N 3.31Å; D132-R134 PolarHBondContact O-N 3.26Å; R134-G138 PolarHBondContact NH1-O 3.49Å; R134-G138 VanDerWaalsContact O-CA 3.26Å; R134-G138 WeakPolarHBondContact O-CA 3.17Å; R134-G138 PolarHBondContact O-N 2.8Å; R134-C139 VanDerWaalsContact CA-O 3.27Å; R134-C139 WeakPolarHBondContact CA-O 3.27Å; R134-C139 WeakPolarHBondContact CD-O 3.39Å; R134-C140 PolarHBondContact NH1-SG 3.37Å; R134-C140 VanDerWaalsContact NH1-SG 3.36Å
135	G	97.4	Very high	97	Very high	67 Å²	67	47.4 Å²	47.4	69%	0.691	29%	0.289	S	S	*	.	H	α-helix	trans	-66.7	-47.9	177.5	0	0	0	0	0	113.1	A131 D132 I133	A131-G135 PolarHBondContact O-N 3.1Å; D132-G135 PolarHBondContact O-N 3.09Å; I133-G135 VanDerWaalsContact C-N 3.34Å; I133-G135 PolarHBondContact O-N 3.2Å
136	K	96.4	Very high	97	Very high	99 Å²	99	47.5 Å²	47.5	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-78.8	-36.2	-178.2	-162.8	-177.5	-179	-165.8	0	113.4	N87 E90 I91 D132	N87-K136 HydrophobicContact CB-CD 4.15Å; N87-K136 WeakPolarHBondContact OD1-CE 3.36Å; N87-K136 PolarHBondContact OD1-NZ 3.35Å; E90-K136 IonicContact OE2-NZ 2.7Å; E90-K136 PolarHBondContact OE2-NZ 2.94Å; I91-K136 HydrophobicContact CD1-CB 3.75Å; I91-K136 HydrophobicContact CD1-CD 3.72Å; I91-K136 HydrophobicContact CD1-CG 4.35Å; I91-K136 HydrophobicContact CG1-CD 3.87Å; D132-K136 PolarHBondContact O-N 3.48Å
137	T	95.8	Very high	96.9	Very high	23 Å²	23	51.4 Å²	51.4	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-107.8	-10.6	-170.4	71.8	0	0	0	0	114.8	V84 N87 I133 C139	V84-T137 HydrophobicContact CG1-CG2 4.29Å; N87-T137 HydrophobicContact CB-CG2 3.77Å; I133-T137 WeakPolarHBondContact O-CB 3.46Å; I133-T137 PolarHBondContact O-N 2.84Å; I133-T137 PolarHBondContact O-OG1 3.01Å; T137-C139 PolarHBondContact O-N 3.31Å; T137-C139 PolarHBondContact O-SG 2.83Å; T137-C139 WeakPolarHBondContact OG1-CB 3.49Å; T137-C139 PolarHBondContact OG1-N 3.25Å
138	G	95.8	Very high	96.9	Very high	44 Å²	44	47 Å²	47	45%	0.454	30%	0.303	S	S	.	.	S	Bend	trans	64.7	-0.3	-167.8	0	0	0	0	0	114.4	R134	R134-G138 PolarHBondContact NH1-O 3.49Å; R134-G138 VanDerWaalsContact O-CA 3.26Å; R134-G138 WeakPolarHBondContact O-CA 3.17Å; R134-G138 PolarHBondContact O-N 2.8Å
139	C	96.4	Very high	96.9	Very high	57 Å²	57	46 Å²	46	39%	0.385	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-99.7	147.8	-175.5	-63.7	0	0	0	0	112.1	R134 T137	R134-C139 VanDerWaalsContact CA-O 3.27Å; R134-C139 WeakPolarHBondContact CA-O 3.27Å; R134-C139 WeakPolarHBondContact CD-O 3.39Å; T137-C139 PolarHBondContact O-N 3.31Å; T137-C139 PolarHBondContact O-SG 2.83Å; T137-C139 WeakPolarHBondContact OG1-CB 3.49Å; T137-C139 PolarHBondContact OG1-N 3.25Å
140	C	96.4	Very high	96.9	Very high	63 Å²	63	45.2 Å²	45.2	43%	0.426	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-88.8	130.2	176	-69.8	0	0	0	0	111.6	R134 N162	R134-C140 PolarHBondContact NH1-SG 3.37Å; R134-C140 VanDerWaalsContact NH1-SG 3.36Å; C140-N162 HydrophobicContact CB-CB 3.97Å
141	A	96.8	Very high	96.8	Very high	23 Å²	23	43.3 Å²	43.3	19%	0.19	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-99.5	162.9	169.8	0	0	0	0	0	112.1	R130 I133	R130-A141 HydrophobicContact CG-CB 4.29Å; R130-A141 PolarHBondContact NE-O 3.16Å; I133-A141 HydrophobicContact CD1-CB 4.05Å; I133-A141 HydrophobicContact CG2-CB 4.15Å
142	S	98	Very high	96.8	Very high	26 Å²	26	41.5 Å²	41.5	18%	0.182	27%	0.266	C	S	.	.			trans	-135.8	132.2	171.5	-51	0	0	0	0	110.3	N162 G163	S142-N162 WeakPolarHBondContact OG-CA 3.5Å; S142-N162 PolarHBondContact OG-N 2.95Å; S142-G163 CarbonylContact C-O 3.57Å; S142-G163 WeakPolarHBondContact CA-O 3.43Å; S142-G163 WeakPolarHBondContact CB-O 3.45Å
143	V	98.3	Very high	96.7	Very high	36 Å²	36	42.5 Å²	42.5	22%	0.218	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.8	-167.8	178.9	0	0	0	0	110.5	A126 R130 M145 G163 Q164 Y165	A126-V143 HydrophobicContact CB-CB 4.11Å; A126-V143 HydrophobicContact CB-CG1 3.75Å; R130-V143 HydrophobicContact CG-CG2 3.64Å; V143-M145 HydrophobicContact CG1-CG 4.09Å; V143-G163 PolarHBondContact N-O 2.78Å; V143-G163 VanDerWaalsContact N-O 3.1Å; V143-Q164 HydrophobicContact CB-CB 4.37Å; V143-Q164 CarbonylContact O-C 3.38Å; V143-Q164 WeakPolarHBondContact O-CA 3.49Å; V143-Y165 PolarHBondContact O-N 3.22Å
144	G	97.9	Very high	96.7	Very high	12 Å²	12	42.1 Å²	42.1	12%	0.124	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.9	170.2	0	0	0	0	0	110.6	T156	G144-T156 VanDerWaalsContact CA-OG1 3.3Å; G144-T156 WeakPolarHBondContact CA-OG1 3.32Å; G144-T156 PolarHBondContact N-OG1 3.16Å; G144-T156 VanDerWaalsContact N-OG1 3.15Å
145	M	97.5	Very high	96.6	Very high	24 Å²	24	35.7 Å²	35.7	12%	0.118	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	144.9	178.6	-61.8	160.2	-81.6	0	0	109.6	P122 A126 V143 Q164 Y165 F166 L167	P122-M145 HydrophobicContact CB-SD 3.59Å; P122-M145 VanDerWaalsContact CB-SD 3.59Å; A126-M145 HydrophobicContact CB-CE 3.68Å; A126-M145 HydrophobicContact CB-SD 3.64Å; V143-M145 HydrophobicContact CG1-CG 4.09Å; M145-Q164 HydrophobicContact CE-CB 4.08Å; M145-Q164 HydrophobicContact CE-CG 4.35Å; M145-Y165 PolarHBondContact N-O 3.13Å; M145-F166 HydrophobicContact CB-CB 4.22Å; M145-F166 HydrophobicContact CB-CD2 3.7Å; M145-F166 HydrophobicContact CB-CG 4.33Å; M145-F166 HydrophobicContact CE-CB 3.94Å; M145-F166 HydrophobicContact SD-CB 4.45Å; M145-L167 PolarHBondContact O-N 2.96Å
146	G	96.4	Very high	96.6	Very high	24 Å²	24	33.8 Å²	33.8	25%	0.247	21%	0.213	C	C	.	.			trans	-176.9	167.5	177.8	0	0	0	0	0	110.4	N148	G146-N148 PolarHBondContact O-N 3.02Å; G146-N148 VanDerWaalsContact O-N 3.14Å
147	S	95.4	Very high	96.5	Very high	84 Å²	84	35.7 Å²	35.7	59%	0.587	22%	0.218	S	C	*	.	S	Bend	trans	-72.2	-2.8	-172.1	53.2	0	0	0	0	115.7	L151	S147-L151 VanDerWaalsContact OG-CD1 3.28Å; S147-L151 WeakPolarHBondContact OG-CD1 3.38Å
148	N	96.1	Very high	96.4	Very high	32 Å²	32	40 Å²	40	17%	0.171	23%	0.234	C	C	.	.	S	Bend	trans	-156.3	171.3	171.5	64.6	54.6	0	0	0	111.9	G146 L150 L151 A152 G232 D234	G146-N148 PolarHBondContact O-N 3.02Å; G146-N148 VanDerWaalsContact O-N 3.14Å; N148-L150 VanDerWaalsContact C-N 3.35Å; N148-L150 PolarHBondContact O-N 3.32Å; N148-L150 WeakPolarHBondContact OD1-CB 3.25Å; N148-L150 PolarHBondContact OD1-N 2.95Å; N148-L150 VanDerWaalsContact OD1-N 3.12Å; N148-L151 WeakPolarHBondContact ND2-CD1 3.44Å; N148-L151 PolarHBondContact O-N 3.15Å; N148-L151 WeakPolarHBondContact OD1-CG 3.32Å; N148-L151 PolarHBondContact OD1-N 2.95Å; N148-A152 PolarHBondContact O-N 3.12Å; N148-G232 PolarHBondContact ND2-O 2.96Å; N148-D234 HydrophobicContact CB-CB 4.24Å; N148-D234 WeakPolarHBondContact CB-O 3.37Å
149	I	96.3	Very high	96.4	Very high	18 Å²	18	38.3 Å²	38.3	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-56.8	-42.9	-176.5	-63.9	177.8	0	0	0	112.6	L108 R153 R236 V238	L108-I149 HydrophobicContact CD1-CB 4.49Å; L108-I149 HydrophobicContact CD1-CD1 4.1Å; L108-I149 HydrophobicContact CD1-CG1 4.2Å; L108-I149 HydrophobicContact CD1-CG2 3.56Å; L108-I149 HydrophobicContact CD2-CG2 4.26Å; I149-R153 HydrophobicContact CG2-CG 4.5Å; I149-R153 WeakPolarHBondContact O-CB 3.34Å; I149-R153 VanDerWaalsContact O-CG 3.29Å; I149-R153 WeakPolarHBondContact O-CG 3.4Å; I149-R153 PolarHBondContact O-N 3.4Å; I149-R153 VanDerWaalsContact O-N 3.07Å; I149-R236 HydrophobicContact CD1-CB 4.42Å; I149-R236 VanDerWaalsContact CD1-O 3.23Å; I149-R236 WeakPolarHBondContact CD1-O 3.45Å; I149-V238 HydrophobicContact CD1-CG2 4.15Å; I149-V238 HydrophobicContact CG1-CG2 4.26Å
150	L	96.6	Very high	96.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-51.3	177.8	171.2	66.8	0	0	0	111	N148 R153 L154 L184 P185 F229 D234	N148-L150 VanDerWaalsContact C-N 3.35Å; N148-L150 PolarHBondContact O-N 3.32Å; N148-L150 WeakPolarHBondContact OD1-CB 3.25Å; N148-L150 PolarHBondContact OD1-N 2.95Å; N148-L150 VanDerWaalsContact OD1-N 3.12Å; L150-R153 PolarHBondContact O-N 3.01Å; L150-L154 HydrophobicContact CD1-CD1 3.93Å; L150-L154 HydrophobicContact CD1-CG 4.24Å; L150-L154 HydrophobicContact CG-CD1 4.07Å; L150-L154 WeakPolarHBondContact O-CG 3.4Å; L150-L154 PolarHBondContact O-N 2.56Å; L150-L184 HydrophobicContact CD1-CD2 4.43Å; L150-P185 HydrophobicContact CD1-CG 3.79Å; L150-F229 HydrophobicContact CD1-CD2 4.25Å; L150-F229 HydrophobicContact CD1-CG 4.31Å; L150-F229 HydrophobicContact CD2-CB 3.84Å; L150-F229 HydrophobicContact CD2-CD1 3.81Å; L150-F229 HydrophobicContact CD2-CG 3.84Å; L150-D234 HydrophobicContact CB-CB 3.64Å; L150-D234 WeakPolarHBondContact CB-OD2 3.49Å; L150-D234 HydrophobicContact CD2-CB 4.45Å; L150-D234 PolarHBondContact N-OD2 2.89Å; L150-D234 VanDerWaalsContact N-OD2 3.16Å
151	L	96.9	Very high	96.4	Very high	3 Å²	3	40 Å²	40	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-47	-178.3	-66	177.7	0	0	0	111.5	S147 N148 R153 L154 A155 L167 V172 I176	S147-L151 VanDerWaalsContact OG-CD1 3.28Å; S147-L151 WeakPolarHBondContact OG-CD1 3.38Å; N148-L151 WeakPolarHBondContact ND2-CD1 3.44Å; N148-L151 PolarHBondContact O-N 3.15Å; N148-L151 WeakPolarHBondContact OD1-CG 3.32Å; N148-L151 PolarHBondContact OD1-N 2.95Å; L151-R153 PolarHBondContact O-N 3.14Å; L151-L154 PolarHBondContact O-N 2.99Å; L151-L154 VanDerWaalsContact O-N 3.16Å; L151-A155 WeakPolarHBondContact O-CB 3.49Å; L151-A155 PolarHBondContact O-N 3.44Å; L151-L167 HydrophobicContact CB-CD2 4.21Å; L151-L167 HydrophobicContact CD2-CD2 3.81Å; L151-V172 HydrophobicContact CD1-CG1 4.31Å; L151-V172 HydrophobicContact CD1-CG2 3.91Å; L151-V172 HydrophobicContact CD2-CG1 3.73Å; L151-V172 HydrophobicContact CD2-CG2 4.2Å; L151-I176 HydrophobicContact CD2-CD1 3.67Å; L151-I176 HydrophobicContact CD2-CG1 4.46Å
152	A	96.9	Very high	96.3	Very high	19 Å²	19	43 Å²	43	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-56.4	-46.8	175.6	0	0	0	0	0	111.8	N148 L154 A155 T156	N148-A152 PolarHBondContact O-N 3.12Å; A152-L154 VanDerWaalsContact C-N 3.33Å; A152-L154 PolarHBondContact O-N 2.87Å; A152-A155 WeakPolarHBondContact O-CB 3.38Å; A152-A155 PolarHBondContact O-N 3.21Å; A152-T156 PolarHBondContact O-N 3.05Å; A152-T156 PolarHBondContact O-OG1 3.29Å
153	R	96.1	Very high	96.2	Very high	92 Å²	92	42.7 Å²	42.7	35%	0.347	23%	0.231	S	C	.	.	H	α-helix	trans	-67	-29.2	178.4	-69.9	-170.1	78.6	158.9	12.4	114.1	E106 L108 I149 L150 L151	E106-R153 IonicContact OE2-NH2 3.16Å; E106-R153 PolarHBondContact OE2-NH2 2.98Å; L108-R153 HydrophobicContact CD2-CG 3.97Å; I149-R153 HydrophobicContact CG2-CG 4.5Å; I149-R153 WeakPolarHBondContact O-CB 3.34Å; I149-R153 VanDerWaalsContact O-CG 3.29Å; I149-R153 WeakPolarHBondContact O-CG 3.4Å; I149-R153 PolarHBondContact O-N 3.4Å; I149-R153 VanDerWaalsContact O-N 3.07Å; L150-R153 PolarHBondContact O-N 3.01Å; L151-R153 PolarHBondContact O-N 3.14Å
154	L	95.6	Very high	96.2	Very high	3 Å²	3	43 Å²	43	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-75.4	-41.6	173	-67.8	174.4	0	0	0	110.9	L150 L151 A152 T156 R157 F175 L179	L150-L154 HydrophobicContact CD1-CD1 3.93Å; L150-L154 HydrophobicContact CD1-CG 4.24Å; L150-L154 HydrophobicContact CG-CD1 4.07Å; L150-L154 WeakPolarHBondContact O-CG 3.4Å; L150-L154 PolarHBondContact O-N 2.56Å; L151-L154 PolarHBondContact O-N 2.99Å; L151-L154 VanDerWaalsContact O-N 3.16Å; A152-L154 VanDerWaalsContact C-N 3.33Å; A152-L154 PolarHBondContact O-N 2.87Å; L154-T156 VanDerWaalsContact C-N 3.31Å; L154-T156 PolarHBondContact O-N 3.38Å; L154-R157 WeakPolarHBondContact O-CB 3.5Å; L154-R157 PolarHBondContact O-N 3.41Å; L154-R157 VanDerWaalsContact O-N 3.07Å; L154-F175 HydrophobicContact CB-CE1 3.83Å; L154-F175 HydrophobicContact CB-CZ 4.21Å; L154-L179 HydrophobicContact CB-CD1 4.49Å; L154-L179 HydrophobicContact CD1-CD1 3.77Å; L154-L179 HydrophobicContact CD2-CD1 4.02Å; L154-L179 HydrophobicContact CG-CD1 4.31Å
155	A	96.9	Very high	96.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58	-41.1	173.5	0	0	0	0	0	111.8	L151 A152 R157 K158 A159 Y165 L167	L151-A155 WeakPolarHBondContact O-CB 3.49Å; L151-A155 PolarHBondContact O-N 3.44Å; A152-A155 WeakPolarHBondContact O-CB 3.38Å; A152-A155 PolarHBondContact O-N 3.21Å; A155-R157 PolarHBondContact O-N 3.41Å; A155-R157 VanDerWaalsContact O-N 3.12Å; A155-K158 PolarHBondContact O-N 2.91Å; A155-A159 PolarHBondContact O-N 3.18Å; A155-Y165 HydrophobicContact CB-CD1 3.93Å; A155-L167 HydrophobicContact CB-CB 4.2Å
156	T	96.9	Very high	96.1	Very high	28 Å²	28	46 Å²	46	17%	0.172	24%	0.238	C	C	.	.	H	α-helix	trans	-58.1	-29.3	176.3	-56.1	0	0	0	0	112.5	G144 A152 L154 K160	G144-T156 VanDerWaalsContact CA-OG1 3.3Å; G144-T156 WeakPolarHBondContact CA-OG1 3.32Å; G144-T156 PolarHBondContact N-OG1 3.16Å; G144-T156 VanDerWaalsContact N-OG1 3.15Å; A152-T156 PolarHBondContact O-N 3.05Å; A152-T156 PolarHBondContact O-OG1 3.29Å; L154-T156 VanDerWaalsContact C-N 3.31Å; L154-T156 PolarHBondContact O-N 3.38Å; T156-K160 HydrophobicContact CG2-CD 4.36Å; T156-K160 WeakPolarHBondContact O-CG 3.33Å; T156-K160 PolarHBondContact O-N 3.04Å
157	R	93.8	Very high	96.1	Very high	139 Å²	139	45 Å²	45	53%	0.525	23%	0.227	S	C	.	.	H	α-helix	trans	-72.4	-34.2	175.9	-60.9	-177.7	-178.3	-144.7	4.7	112.6	L154 A155 S183	L154-R157 WeakPolarHBondContact O-CB 3.5Å; L154-R157 PolarHBondContact O-N 3.41Å; L154-R157 VanDerWaalsContact O-N 3.07Å; A155-R157 PolarHBondContact O-N 3.41Å; A155-R157 VanDerWaalsContact O-N 3.12Å; R157-S183 PolarHBondContact NH2-O 3.12Å; R157-S183 VanDerWaalsContact NH2-O 3.09Å
158	K	93.8	Very high	96.1	Very high	114 Å²	114	46.2 Å²	46.2	50%	0.496	22%	0.219	S	C	.	.	H	α-helix	trans	-76.7	-28	174.3	-178	166.2	167.7	-176	0	111.8	A155 Y165 F175	A155-K158 PolarHBondContact O-N 2.91Å; K158-Y165 HydrophobicContact CB-CD1 4.16Å; K158-Y165 HydrophobicContact CB-CG 4.48Å; K158-Y165 HydrophobicContact CD-CD1 3.84Å; K158-Y165 HydrophobicContact CD-CD2 4.33Å; K158-Y165 HydrophobicContact CD-CE1 3.62Å; K158-Y165 HydrophobicContact CD-CE2 4.17Å; K158-Y165 HydrophobicContact CD-CG 4.2Å; K158-Y165 VanDerWaalsContact CE-CZ 3.5Å; K158-Y165 HydrophobicContact CG-CD1 4.11Å; K158-Y165 HydrophobicContact CG-CE1 4.4Å; K158-Y165 HydrophobicContact CG-CG 4.18Å; K158-Y165 PolarHBondContact NZ-OH 3.11Å; K158-F175 HydrophobicContact CD-CD2 4.39Å; K158-F175 HydrophobicContact CD-CE2 3.79Å
159	A	96.5	Very high	95.9	Very high	7 Å²	7	48.9 Å²	48.9	6%	0.058	24%	0.24	C	C	.	.	H	α-helix	trans	-78	-22	176.9	0	0	0	0	0	115.2	A155 G163	A155-A159 PolarHBondContact O-N 3.18Å; A159-G163 CarbonylContact O-C 3.52Å; A159-G163 WeakPolarHBondContact O-CA 3.34Å; A159-G163 PolarHBondContact O-N 3.4Å
160	K	95.9	Very high	95.8	Very high	81 Å²	81	54.9 Å²	54.9	35%	0.352	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	135.2	178.9	-80.6	173.6	178.4	178.5	0	110.1	E106 T156	E106-K160 IonicContact OE1-NZ 3.22Å; E106-K160 PolarHBondContact OE1-NZ 3.35Å; T156-K160 HydrophobicContact CG2-CD 4.36Å; T156-K160 WeakPolarHBondContact O-CG 3.33Å; T156-K160 PolarHBondContact O-N 3.04Å
161	P	95.5	Very high	95.7	Very high	76 Å²	76	57.6 Å²	57.6	49%	0.494	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90	150.9	2.5	34	-33.8	0	0	0	115	Y48 G163	Y48-P161 HydrophobicContact CD1-CB 3.81Å; Y48-P161 HydrophobicContact CD1-CG 4.06Å; Y48-P161 HydrophobicContact CD2-CB 3.8Å; Y48-P161 HydrophobicContact CE1-CB 3.7Å; Y48-P161 HydrophobicContact CE1-CG 4.26Å; Y48-P161 HydrophobicContact CE2-CB 3.69Å; Y48-P161 HydrophobicContact CG-CB 3.85Å; Y48-P161 HydrophobicContact CG-CG 4.29Å; P161-G163 PolarHBondContact O-N 3.22Å
162	N	95	Very high	95.6	Very high	86 Å²	86	58.1 Å²	58.1	46%	0.46	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	40.7	44.6	171.1	-170	30.5	0	0	0	114.9	R130 C140 S142	R130-N162 PolarHBondContact NH2-O 3.08Å; R130-N162 PolarHBondContact NH2-OD1 3.16Å; R130-N162 VanDerWaalsContact NH2-OD1 3.16Å; C140-N162 HydrophobicContact CB-CB 3.97Å; S142-N162 WeakPolarHBondContact OG-CA 3.5Å; S142-N162 PolarHBondContact OG-N 2.95Å
163	G	96.2	Very high	95.4	Very high	19 Å²	19	61.9 Å²	61.9	20%	0.196	30%	0.301	C	S	.	.			trans	-134.3	-179.3	178	0	0	0	0	0	112	S142 V143 A159 P161	S142-G163 CarbonylContact C-O 3.57Å; S142-G163 WeakPolarHBondContact CA-O 3.43Å; S142-G163 WeakPolarHBondContact CB-O 3.45Å; V143-G163 PolarHBondContact N-O 2.78Å; V143-G163 VanDerWaalsContact N-O 3.1Å; A159-G163 CarbonylContact O-C 3.52Å; A159-G163 WeakPolarHBondContact O-CA 3.34Å; A159-G163 PolarHBondContact O-N 3.4Å; P161-G163 PolarHBondContact O-N 3.22Å
164	Q	97.4	Very high	95.2	Very high	43 Å²	43	61.9 Å²	61.9	20%	0.201	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	154.1	168.6	67.6	-163.7	52.2	0	0	109.8	D123 A126 V143 M145	D123-Q164 PolarHBondContact O-NE2 3.02Å; D123-Q164 PolarHBondContact OD1-NE2 3.01Å; A126-Q164 HydrophobicContact CB-CB 4.41Å; V143-Q164 HydrophobicContact CB-CB 4.37Å; V143-Q164 CarbonylContact O-C 3.38Å; V143-Q164 WeakPolarHBondContact O-CA 3.49Å; M145-Q164 HydrophobicContact CE-CB 4.08Å; M145-Q164 HydrophobicContact CE-CG 4.35Å
165	Y	97.6	Very high	95.2	Very high	37 Å²	37	63.5 Å²	63.5	15%	0.145	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	120.2	174.8	-175.8	-111.2	0	0	0	109.9	V143 M145 A155 K158 L167 E171	V143-Y165 PolarHBondContact O-N 3.22Å; M145-Y165 PolarHBondContact N-O 3.13Å; A155-Y165 HydrophobicContact CB-CD1 3.93Å; K158-Y165 HydrophobicContact CB-CD1 4.16Å; K158-Y165 HydrophobicContact CB-CG 4.48Å; K158-Y165 HydrophobicContact CD-CD1 3.84Å; K158-Y165 HydrophobicContact CD-CD2 4.33Å; K158-Y165 HydrophobicContact CD-CE1 3.62Å; K158-Y165 HydrophobicContact CD-CE2 4.17Å; K158-Y165 HydrophobicContact CD-CG 4.2Å; K158-Y165 VanDerWaalsContact CE-CZ 3.5Å; K158-Y165 HydrophobicContact CG-CD1 4.11Å; K158-Y165 HydrophobicContact CG-CE1 4.4Å; K158-Y165 HydrophobicContact CG-CG 4.18Å; K158-Y165 PolarHBondContact NZ-OH 3.11Å; Y165-L167 HydrophobicContact CD1-CB 4.43Å; Y165-L167 HydrophobicContact CE1-CB 3.97Å; Y165-L167 HydrophobicContact CE1-CD1 4.1Å; Y165-E171 PolarHBondContact OH-OE1 3.13Å
166	F	96.9	Very high	95.1	Very high	62 Å²	62	63.5 Å²	63.5	27%	0.272	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	114.7	169.9	179.7	-146.5	0	0	0	109.6	P122 M145 R168	P122-F166 HydrophobicContact CG-CE1 4.31Å; P122-F166 HydrophobicContact CG-CZ 4.3Å; M145-F166 HydrophobicContact CB-CB 4.22Å; M145-F166 HydrophobicContact CB-CD2 3.7Å; M145-F166 HydrophobicContact CB-CG 4.33Å; M145-F166 HydrophobicContact CE-CB 3.94Å; M145-F166 HydrophobicContact SD-CB 4.45Å; F166-R168 HydrophobicContact CD1-CG 3.84Å; F166-R168 HydrophobicContact CE1-CG 3.68Å; F166-R168 HydrophobicContact CG-CG 4.47Å; F166-R168 HydrophobicContact CZ-CG 4.19Å; F166-R168 PolarHBondContact O-N 3.1Å
167	L	96.3	Very high	95	Very high	1 Å²	1	67 Å²	67	1%	0.005	33%	0.325	C	S	.	.			trans	-87.4	99.3	173.4	179.9	61.6	0	0	0	108.9	M145 L151 A155 Y165 E171 V172 F175	M145-L167 PolarHBondContact O-N 2.96Å; L151-L167 HydrophobicContact CB-CD2 4.21Å; L151-L167 HydrophobicContact CD2-CD2 3.81Å; A155-L167 HydrophobicContact CB-CB 4.2Å; Y165-L167 HydrophobicContact CD1-CB 4.43Å; Y165-L167 HydrophobicContact CE1-CB 3.97Å; Y165-L167 HydrophobicContact CE1-CD1 4.1Å; L167-E171 HydrophobicContact CD1-CB 3.91Å; L167-V172 HydrophobicContact CD2-CG2 4.3Å; L167-V172 HydrophobicContact CG-CG2 4.07Å; L167-F175 HydrophobicContact CD1-CB 3.86Å; L167-F175 HydrophobicContact CD1-CD1 3.86Å; L167-F175 HydrophobicContact CD1-CD2 4.46Å; L167-F175 HydrophobicContact CD1-CG 3.8Å; L167-F175 HydrophobicContact CD2-CD1 3.39Å; L167-F175 HydrophobicContact CD2-CE1 3.59Å; L167-F175 HydrophobicContact CD2-CG 4.2Å; L167-F175 HydrophobicContact CG-CD1 4.3Å
168	R	94.6	Very high	94.9	Very high	111 Å²	111	67 Å²	67	42%	0.419	34%	0.335	S	S	.	.			trans	-70.3	151.7	175.8	-67.9	174	-73.1	-115.1	-6.5	111.3	F166 E170 E171 V172	F166-R168 HydrophobicContact CD1-CG 3.84Å; F166-R168 HydrophobicContact CE1-CG 3.68Å; F166-R168 HydrophobicContact CG-CG 4.47Å; F166-R168 HydrophobicContact CZ-CG 4.19Å; F166-R168 PolarHBondContact O-N 3.1Å; R168-E170 VanDerWaalsContact C-N 3.28Å; R168-E170 HydrophobicContact CB-CG 4.4Å; R168-E170 WeakPolarHBondContact CB-OE1 3.44Å; R168-E170 WeakPolarHBondContact CB-OE2 3.39Å; R168-E170 WeakPolarHBondContact CD-OE1 3.46Å; R168-E170 IonicContact NE-OE1 3.77Å; R168-E170 PolarHBondContact O-N 3.38Å; R168-E171 IonicContact CZ-OE2 2.74Å; R168-E171 IonicContact NE-OE2 3.71Å; R168-E171 PolarHBondContact NE-OE2 2.86Å; R168-E171 IonicContact NH2-OE1 2.77Å; R168-E171 IonicContact NH2-OE2 2.73Å; R168-E171 PolarHBondContact NH2-OE2 3.42Å; R168-E171 PolarHBondContact O-N 3.21Å; R168-V172 PolarHBondContact O-N 3.1Å
169	S	92.4	Very high	95	Very high	87 Å²	87	62.9 Å²	62.9	61%	0.608	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-56.9	-39.2	-173	-61.2	0	0	0	0	113.3	E171 V172	S169-E171 VanDerWaalsContact C-N 3.29Å; S169-E171 PolarHBondContact O-N 3.5Å; S169-V172 WeakPolarHBondContact O-CB 3.43Å; S169-V172 WeakPolarHBondContact O-CG2 3.45Å; S169-V172 PolarHBondContact O-N 3.4Å
170	E	94.2	Very high	94.9	Very high	145 Å²	145	65.4 Å²	65.4	68%	0.678	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-68	-21.7	178.1	61.8	-87.4	-157.5	0	0	114.1	R168	R168-E170 VanDerWaalsContact C-N 3.28Å; R168-E170 HydrophobicContact CB-CG 4.4Å; R168-E170 WeakPolarHBondContact CB-OE1 3.44Å; R168-E170 WeakPolarHBondContact CB-OE2 3.39Å; R168-E170 WeakPolarHBondContact CD-OE1 3.46Å; R168-E170 IonicContact NE-OE1 3.77Å; R168-E170 PolarHBondContact O-N 3.38Å
171	E	93.5	Very high	94.9	Very high	57 Å²	57	61.9 Å²	61.9	27%	0.266	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-91	-10.5	176.6	-73.5	172.7	77.3	0	0	112.9	Y165 L167 R168 S169 D173 F175	Y165-E171 PolarHBondContact OH-OE1 3.13Å; L167-E171 HydrophobicContact CD1-CB 3.91Å; R168-E171 IonicContact CZ-OE2 2.74Å; R168-E171 IonicContact NE-OE2 3.71Å; R168-E171 PolarHBondContact NE-OE2 2.86Å; R168-E171 IonicContact NH2-OE1 2.77Å; R168-E171 IonicContact NH2-OE2 2.73Å; R168-E171 PolarHBondContact NH2-OE2 3.42Å; R168-E171 PolarHBondContact O-N 3.21Å; S169-E171 VanDerWaalsContact C-N 3.29Å; S169-E171 PolarHBondContact O-N 3.5Å; E171-D173 PolarHBondContact O-N 3.34Å; E171-F175 WeakPolarHBondContact O-CB 3.32Å; E171-F175 PolarHBondContact O-N 2.86Å
172	V	94.6	Very high	94.8	Very high	13 Å²	13	61.6 Å²	61.6	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-47.6	-169	171.3	0	0	0	0	113	L151 L167 R168 S169 F175 I176	L151-V172 HydrophobicContact CD1-CG1 4.31Å; L151-V172 HydrophobicContact CD1-CG2 3.91Å; L151-V172 HydrophobicContact CD2-CG1 3.73Å; L151-V172 HydrophobicContact CD2-CG2 4.2Å; L167-V172 HydrophobicContact CD2-CG2 4.3Å; L167-V172 HydrophobicContact CG-CG2 4.07Å; R168-V172 PolarHBondContact O-N 3.1Å; S169-V172 WeakPolarHBondContact O-CB 3.43Å; S169-V172 WeakPolarHBondContact O-CG2 3.45Å; S169-V172 PolarHBondContact O-N 3.4Å; V172-F175 PolarHBondContact O-N 3.39Å; V172-I176 HydrophobicContact CG1-CD1 3.8Å; V172-I176 HydrophobicContact CG1-CG1 4.39Å; V172-I176 WeakPolarHBondContact O-CB 3.29Å; V172-I176 WeakPolarHBondContact O-CG1 3.42Å; V172-I176 PolarHBondContact O-N 3.48Å
173	D	92.7	Very high	94.7	Very high	98 Å²	98	58.4 Å²	58.4	52%	0.524	30%	0.3	S	S	.	.	H	α-helix	trans	-65.6	-45.1	-171.8	-83.9	-15.9	0	0	0	112.2	E171 R177	E171-D173 PolarHBondContact O-N 3.34Å; D173-R177 WeakPolarHBondContact O-CB 3.33Å; D173-R177 PolarHBondContact O-N 2.96Å
174	D	93.6	Very high	94.6	Very high	93 Å²	93	57.6 Å²	57.6	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-72.1	-43.8	178	-70.1	-16.1	0	0	0	111	I176 R177	D174-I176 VanDerWaalsContact C-N 3.27Å; D174-I176 PolarHBondContact O-N 3.15Å; D174-R177 PolarHBondContact O-N 3.21Å; D174-R177 IonicContact OD1-CZ 2.76Å; D174-R177 IonicContact OD1-NH1 2.65Å; D174-R177 PolarHBondContact OD1-NH1 3.12Å; D174-R177 IonicContact OD1-NH2 3.16Å; D174-R177 PolarHBondContact OD1-NH2 3.44Å
175	F	94.8	Very high	94.4	Very high	36 Å²	36	57.2 Å²	57.2	16%	0.158	29%	0.293	C	S	.	.	H	α-helix	trans	-56.5	-41.9	175.2	173.2	-103.3	0	0	0	112	L154 K158 L167 E171 V172 L179	L154-F175 HydrophobicContact CB-CE1 3.83Å; L154-F175 HydrophobicContact CB-CZ 4.21Å; K158-F175 HydrophobicContact CD-CD2 4.39Å; K158-F175 HydrophobicContact CD-CE2 3.79Å; L167-F175 HydrophobicContact CD1-CB 3.86Å; L167-F175 HydrophobicContact CD1-CD1 3.86Å; L167-F175 HydrophobicContact CD1-CD2 4.46Å; L167-F175 HydrophobicContact CD1-CG 3.8Å; L167-F175 HydrophobicContact CD2-CD1 3.39Å; L167-F175 HydrophobicContact CD2-CE1 3.59Å; L167-F175 HydrophobicContact CD2-CG 4.2Å; L167-F175 HydrophobicContact CG-CD1 4.3Å; E171-F175 WeakPolarHBondContact O-CB 3.32Å; E171-F175 PolarHBondContact O-N 2.86Å; V172-F175 PolarHBondContact O-N 3.39Å; F175-L179 HydrophobicContact CD1-CD1 4.31Å; F175-L179 HydrophobicContact CE1-CD1 3.88Å; F175-L179 HydrophobicContact CZ-CD1 4.23Å; F175-L179 HydrophobicContact CZ-CD2 4.46Å; F175-L179 WeakPolarHBondContact O-CG 3.18Å
176	I	95.1	Very high	94	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-74	-42.2	-179.9	-73.5	-176.6	0	0	0	112	L151 V172 D174 D178 L179 C203 C230 G232	L151-I176 HydrophobicContact CD2-CD1 3.67Å; L151-I176 HydrophobicContact CD2-CG1 4.46Å; V172-I176 HydrophobicContact CG1-CD1 3.8Å; V172-I176 HydrophobicContact CG1-CG1 4.39Å; V172-I176 WeakPolarHBondContact O-CB 3.29Å; V172-I176 WeakPolarHBondContact O-CG1 3.42Å; V172-I176 PolarHBondContact O-N 3.48Å; D174-I176 VanDerWaalsContact C-N 3.27Å; D174-I176 PolarHBondContact O-N 3.15Å; I176-D178 PolarHBondContact O-N 3.16Å; I176-D178 VanDerWaalsContact O-N 3.16Å; I176-L179 HydrophobicContact CG1-CD1 4.49Å; I176-L179 WeakPolarHBondContact O-CB 3.44Å; I176-L179 PolarHBondContact O-N 3.33Å; I176-C203 HydrophobicContact CG2-CB 3.91Å; I176-C203 WeakPolarHBondContact O-CB 3.39Å; I176-C230 VanDerWaalsContact CG2-O 3.24Å; I176-C230 WeakPolarHBondContact CG2-O 3.44Å; I176-G232 VanDerWaalsContact CD1-N 3.29Å
177	R	94.3	Very high	93.9	Very high	102 Å²	102	56.6 Å²	56.6	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-51.7	-42.8	-174.5	-165.9	179.8	-57.7	122.5	11.7	112.1	D173 D174 G204	D173-R177 WeakPolarHBondContact O-CB 3.33Å; D173-R177 PolarHBondContact O-N 2.96Å; D174-R177 PolarHBondContact O-N 3.21Å; D174-R177 IonicContact OD1-CZ 2.76Å; D174-R177 IonicContact OD1-NH1 2.65Å; D174-R177 PolarHBondContact OD1-NH1 3.12Å; D174-R177 IonicContact OD1-NH2 3.16Å; D174-R177 PolarHBondContact OD1-NH2 3.44Å; R177-G204 PolarHBondContact O-N 3.47Å
178	D	92.8	Very high	93.7	Very high	138 Å²	138	58.5 Å²	58.5	74%	0.738	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.6	-176.5	-69.9	-8.4	0	0	0	114.4	I176	I176-D178 PolarHBondContact O-N 3.16Å; I176-D178 VanDerWaalsContact O-N 3.16Å
179	L	94.7	Very high	93.6	Very high	29 Å²	29	61 Å²	61	15%	0.152	35%	0.349	C	S	.	.	S	Bend	trans	-68.8	139.3	-180	-72.3	173	0	0	0	111.7	L154 F175 I176 S202 C203	L154-L179 HydrophobicContact CB-CD1 4.49Å; L154-L179 HydrophobicContact CD1-CD1 3.77Å; L154-L179 HydrophobicContact CD2-CD1 4.02Å; L154-L179 HydrophobicContact CG-CD1 4.31Å; F175-L179 HydrophobicContact CD1-CD1 4.31Å; F175-L179 HydrophobicContact CE1-CD1 3.88Å; F175-L179 HydrophobicContact CZ-CD1 4.23Å; F175-L179 HydrophobicContact CZ-CD2 4.46Å; F175-L179 WeakPolarHBondContact O-CG 3.18Å; I176-L179 HydrophobicContact CG1-CD1 4.49Å; I176-L179 WeakPolarHBondContact O-CB 3.44Å; I176-L179 PolarHBondContact O-N 3.33Å; L179-S202 CarbonylContact O-C 3.59Å; L179-S202 WeakPolarHBondContact O-CA 3.48Å; L179-C203 PolarHBondContact O-N 2.93Å; L179-C203 PolarHBondContact O-SG 3.07Å
180	P	95.3	Very high	93.6	Very high	60 Å²	60	61.9 Å²	61.9	39%	0.39	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-69.2	142.5	169.5	30	-34.3	0	0	0	109.9	T182 S183 K201	P180-T182 PolarHBondContact O-N 2.58Å; P180-S183 WeakPolarHBondContact O-CB 3.13Å; P180-S183 PolarHBondContact O-N 3.46Å; P180-K201 WeakPolarHBondContact CA-O 3.37Å
181	V	94.6	Very high	93.6	Very high	6 Å²	6	56.9 Å²	56.9	4%	0.036	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-58.8	-25.1	-176.7	-64.7	0	0	0	0	113.9	S183 L184 V187 L195 V200 K201 S202 L206	V181-S183 PolarHBondContact O-N 3.39Å; V181-L184 WeakPolarHBondContact O-CB 3.44Å; V181-L184 PolarHBondContact O-N 2.94Å; V181-L184 VanDerWaalsContact O-N 3.13Å; V181-V187 HydrophobicContact CB-CG1 4.49Å; V181-V187 HydrophobicContact CG2-CG1 4.43Å; V181-V187 VanDerWaalsContact O-CB 3.25Å; V181-V187 WeakPolarHBondContact O-CB 3.23Å; V181-V187 WeakPolarHBondContact O-CG1 3.21Å; V181-L195 HydrophobicContact CB-CD1 4.16Å; V181-L195 HydrophobicContact CG2-CB 4.44Å; V181-L195 HydrophobicContact CG2-CD1 3.93Å; V181-V200 HydrophobicContact CG1-CG1 3.67Å; V181-K201 PolarHBondContact N-O 3.27Å; V181-S202 WeakPolarHBondContact CG1-O 3.32Å; V181-L206 HydrophobicContact CG1-CB 4.14Å; V181-L206 HydrophobicContact CG1-CD2 3.98Å
182	T	94.1	Very high	93.6	Very high	71 Å²	71	55 Å²	55	44%	0.436	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-64.1	-13	172.6	47.9	0	0	0	0	114.4	P180 A192	P180-T182 PolarHBondContact O-N 2.58Å; T182-A192 HydrophobicContact CG2-CB 3.5Å; T182-A192 VanDerWaalsContact CG2-CB 3.5Å
183	S	93.3	Very high	93.6	Very high	18 Å²	18	61.9 Å²	61.9	13%	0.126	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-79.5	-22	173.2	-72.1	0	0	0	0	113.1	R157 P180 V181	R157-S183 PolarHBondContact NH2-O 3.12Å; R157-S183 VanDerWaalsContact NH2-O 3.09Å; P180-S183 WeakPolarHBondContact O-CB 3.13Å; P180-S183 PolarHBondContact O-N 3.46Å; V181-S183 PolarHBondContact O-N 3.39Å
184	L	94	Very high	93.7	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	35%	0.35	C	S	.	.	S	Bend	trans	-69.7	135	-179.7	-62.5	-178.9	0	0	0	111.4	L150 V181 G186 V187 L206 F229 C230	L150-L184 HydrophobicContact CD1-CD2 4.43Å; V181-L184 WeakPolarHBondContact O-CB 3.44Å; V181-L184 PolarHBondContact O-N 2.94Å; V181-L184 VanDerWaalsContact O-N 3.13Å; L184-G186 PolarHBondContact O-N 3.1Å; L184-V187 HydrophobicContact CB-CB 4.46Å; L184-V187 HydrophobicContact CB-CG2 3.79Å; L184-V187 PolarHBondContact O-N 2.97Å; L184-V187 VanDerWaalsContact O-N 3.11Å; L184-L206 HydrophobicContact CD1-CD2 4.07Å; L184-F229 HydrophobicContact CD1-CB 4.3Å; L184-F229 HydrophobicContact CD2-CB 4.31Å; L184-C230 HydrophobicContact CD1-CB 4.44Å
185	P	92.7	Very high	93.8	Very high	35 Å²	35	58.3 Å²	58.3	23%	0.227	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	130.9	173.2	-24.2	34	0	0	0	111.7	L150 F229	L150-P185 HydrophobicContact CD1-CG 3.79Å; P185-F229 HydrophobicContact CB-CE2 4.22Å
186	G	90.4	Very high	93.8	Very high	75 Å²	75	59.1 Å²	59.1	77%	0.773	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-11.1	-177.2	0	0	0	0	0	115.6	L184 G188	L184-G186 PolarHBondContact O-N 3.1Å; G186-G188 PolarHBondContact O-N 2.9Å; G186-G188 VanDerWaalsContact O-N 3.13Å
187	V	93.8	Very high	93.7	Very high	10 Å²	10	65.4 Å²	65.4	6%	0.061	38%	0.377	C	S	.	.			trans	-88.8	74.5	178	-172.1	0	0	0	0	111.4	V181 L184 M191 A192 L195 L226	V181-V187 HydrophobicContact CB-CG1 4.49Å; V181-V187 HydrophobicContact CG2-CG1 4.43Å; V181-V187 VanDerWaalsContact O-CB 3.25Å; V181-V187 WeakPolarHBondContact O-CB 3.23Å; V181-V187 WeakPolarHBondContact O-CG1 3.21Å; L184-V187 HydrophobicContact CB-CB 4.46Å; L184-V187 HydrophobicContact CB-CG2 3.79Å; L184-V187 PolarHBondContact O-N 2.97Å; L184-V187 VanDerWaalsContact O-N 3.11Å; V187-M191 HydrophobicContact CG1-CB 4.06Å; V187-M191 HydrophobicContact CG1-CG 4.07Å; V187-A192 HydrophobicContact CG1-CB 4.31Å; V187-L195 HydrophobicContact CG1-CD1 3.97Å; V187-L226 HydrophobicContact CG2-CD2 3.63Å
188	G	92.4	Very high	93.7	Very high	42 Å²	42	63.3 Å²	63.3	43%	0.433	37%	0.373	S	S	.	.			trans	-72.3	173.3	172	0	0	0	0	0	113.7	G186 V190 M191 A192	G186-G188 PolarHBondContact O-N 2.9Å; G186-G188 VanDerWaalsContact O-N 3.13Å; G188-V190 VanDerWaalsContact C-N 3.26Å; G188-V190 PolarHBondContact O-N 2.6Å; G188-V190 VanDerWaalsContact O-N 3.08Å; G188-M191 WeakPolarHBondContact O-CA 3.39Å; G188-M191 WeakPolarHBondContact O-CB 3.46Å; G188-M191 PolarHBondContact O-N 3.14Å; G188-A192 PolarHBondContact O-N 3.39Å
189	H	91.4	Very high	93.8	Very high	163 Å²	163	59.1 Å²	59.1	76%	0.755	36%	0.363	S	S	*	.	H	α-helix	trans	-52	-36.6	-175.3	-60.2	-58.6	0	0	0	115.1	K193	H189-K193 WeakPolarHBondContact O-CB 3.4Å; H189-K193 WeakPolarHBondContact O-CG 3.46Å; H189-K193 PolarHBondContact O-N 3.4Å
190	V	93.3	Very high	93.8	Very high	105 Å²	105	58 Å²	58	64%	0.636	36%	0.357	S	S	*	.	H	α-helix	trans	-68.6	-40.1	177.8	179.7	0	0	0	0	111.2	G188 K194	G188-V190 VanDerWaalsContact C-N 3.26Å; G188-V190 PolarHBondContact O-N 2.6Å; G188-V190 VanDerWaalsContact O-N 3.08Å; V190-K194 WeakPolarHBondContact O-CG 3.31Å; V190-K194 PolarHBondContact O-N 3.45Å
191	M	93.6	Very high	93.8	Very high	41 Å²	41	62.5 Å²	62.5	20%	0.202	37%	0.37	C	S	.	.	H	α-helix	trans	-68	-46.9	177.1	-165.1	66.8	78.9	0	0	110.6	V187 G188 K193 K194 L195 F218 T222	V187-M191 HydrophobicContact CG1-CB 4.06Å; V187-M191 HydrophobicContact CG1-CG 4.07Å; G188-M191 WeakPolarHBondContact O-CA 3.39Å; G188-M191 WeakPolarHBondContact O-CB 3.46Å; G188-M191 PolarHBondContact O-N 3.14Å; M191-K193 VanDerWaalsContact C-N 3.32Å; M191-K193 PolarHBondContact O-N 3.44Å; M191-K194 WeakPolarHBondContact O-CB 3.42Å; M191-K194 PolarHBondContact O-N 3.13Å; M191-L195 HydrophobicContact CG-CD1 4.21Å; M191-L195 WeakPolarHBondContact O-CG 3.43Å; M191-L195 PolarHBondContact O-N 3.05Å; M191-F218 HydrophobicContact CE-CD1 4.25Å; M191-F218 HydrophobicContact SD-CD1 3.26Å; M191-F218 WeakPolarHBondContact SD-CD1 3.43Å; M191-F218 HydrophobicContact SD-CE1 3.37Å; M191-F218 WeakPolarHBondContact SD-CE1 3.29Å; M191-F218 HydrophobicContact SD-CG 4.1Å; M191-F218 HydrophobicContact SD-CZ 4.29Å; M191-T222 HydrophobicContact CE-CG2 3.65Å
192	A	94	Very high	93.8	Very high	16 Å²	16	63.5 Å²	63.5	13%	0.132	38%	0.378	C	S	.	.	H	α-helix	trans	-57.7	-41.1	176.7	0	0	0	0	0	112.5	T182 V187 G188 L195 A196	T182-A192 HydrophobicContact CG2-CB 3.5Å; T182-A192 VanDerWaalsContact CG2-CB 3.5Å; V187-A192 HydrophobicContact CG1-CB 4.31Å; G188-A192 PolarHBondContact O-N 3.39Å; A192-L195 PolarHBondContact O-N 3.4Å; A192-A196 WeakPolarHBondContact O-CB 3.46Å; A192-A196 PolarHBondContact O-N 3.48Å
193	K	94.6	Very high	93.9	Very high	158 Å²	158	60.1 Å²	60.1	69%	0.687	36%	0.357	S	S	*	.	H	α-helix	trans	-62.1	-41.6	173.3	-76.8	176.3	179.6	-176.6	0	112.6	H189 M191 A196 V197	H189-K193 WeakPolarHBondContact O-CB 3.4Å; H189-K193 WeakPolarHBondContact O-CG 3.46Å; H189-K193 PolarHBondContact O-N 3.4Å; M191-K193 VanDerWaalsContact C-N 3.32Å; M191-K193 PolarHBondContact O-N 3.44Å; K193-A196 PolarHBondContact O-N 2.88Å; K193-V197 WeakPolarHBondContact O-CG2 3.03Å; K193-V197 PolarHBondContact O-N 3.09Å; K193-V197 VanDerWaalsContact O-N 3.16Å
194	K	94.5	Very high	94.1	Very high	116 Å²	116	59.8 Å²	59.8	50%	0.504	36%	0.356	S	S	.	.	H	α-helix	trans	-66.5	-40.6	177	-71.7	178.6	177.8	-174.3	0	112.2	V190 M191 V197 M198 F218	V190-K194 WeakPolarHBondContact O-CG 3.31Å; V190-K194 PolarHBondContact O-N 3.45Å; M191-K194 WeakPolarHBondContact O-CB 3.42Å; M191-K194 PolarHBondContact O-N 3.13Å; K194-V197 PolarHBondContact O-N 3.37Å; K194-M198 PolarHBondContact O-N 3.35Å; K194-F218 HydrophobicContact CB-CE1 3.72Å; K194-F218 HydrophobicContact CB-CZ 4.14Å; K194-F218 HydrophobicContact CD-CD1 4.48Å; K194-F218 HydrophobicContact CD-CE1 3.94Å
195	L	95.3	Very high	94.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-65.5	-43.1	175.1	-71.5	170.2	0	0	0	111.6	V181 V187 M191 A192 V197 M198 G199 V200 L206 F218	V181-L195 HydrophobicContact CB-CD1 4.16Å; V181-L195 HydrophobicContact CG2-CB 4.44Å; V181-L195 HydrophobicContact CG2-CD1 3.93Å; V187-L195 HydrophobicContact CG1-CD1 3.97Å; M191-L195 HydrophobicContact CG-CD1 4.21Å; M191-L195 WeakPolarHBondContact O-CG 3.43Å; M191-L195 PolarHBondContact O-N 3.05Å; A192-L195 PolarHBondContact O-N 3.4Å; L195-V197 VanDerWaalsContact C-N 3.27Å; L195-V197 PolarHBondContact O-N 3.25Å; L195-M198 CarbonylContact O-C 3.58Å; L195-M198 WeakPolarHBondContact O-CA 3.29Å; L195-M198 WeakPolarHBondContact O-CB 3.42Å; L195-M198 PolarHBondContact O-N 3.43Å; L195-G199 PolarHBondContact O-N 2.9Å; L195-V200 CarbonylContact C-O 3.18Å; L195-V200 HydrophobicContact CB-CB 4.17Å; L195-V200 HydrophobicContact CB-CG1 4.24Å; L195-V200 HydrophobicContact CD2-CB 4.5Å; L195-V200 HydrophobicContact CD2-CG1 4.32Å; L195-V200 PolarHBondContact O-N 3.32Å; L195-L206 HydrophobicContact CD2-CD1 4.07Å; L195-F218 HydrophobicContact CD2-CE2 3.69Å; L195-F218 HydrophobicContact CD2-CZ 3.62Å; L195-F218 HydrophobicContact CG-CZ 3.99Å
196	A	94.7	Very high	94.3	Very high	53 Å²	53	61 Å²	61	44%	0.438	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-33.5	176.1	0	0	0	0	0	113	A192 K193 M198 G199 V200	A192-A196 WeakPolarHBondContact O-CB 3.46Å; A192-A196 PolarHBondContact O-N 3.48Å; K193-A196 PolarHBondContact O-N 2.88Å; A196-M198 PolarHBondContact O-N 3.12Å; A196-G199 PolarHBondContact O-N 2.96Å; A196-V200 WeakPolarHBondContact CA-O 3.46Å; A196-V200 PolarHBondContact N-O 2.88Å
197	V	94.9	Very high	94.6	Very high	132 Å²	132	59.1 Å²	59.1	80%	0.8	33%	0.332	S	S	*	.	H	α-helix	trans	-68	-23.9	172	170.1	0	0	0	0	112.4	K193 K194 L195 G199	K193-V197 WeakPolarHBondContact O-CG2 3.03Å; K193-V197 PolarHBondContact O-N 3.09Å; K193-V197 VanDerWaalsContact O-N 3.16Å; K194-V197 PolarHBondContact O-N 3.37Å; L195-V197 VanDerWaalsContact C-N 3.27Å; L195-V197 PolarHBondContact O-N 3.25Å; V197-G199 VanDerWaalsContact C-N 3.27Å
198	M	93.8	Very high	94.7	Very high	58 Å²	58	66.3 Å²	66.3	29%	0.286	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	6.2	170.3	-63.7	174.5	54.6	0	0	112.9	K194 L195 A196 V200 V209 K217 F218	K194-M198 PolarHBondContact O-N 3.35Å; L195-M198 CarbonylContact O-C 3.58Å; L195-M198 WeakPolarHBondContact O-CA 3.29Å; L195-M198 WeakPolarHBondContact O-CB 3.42Å; L195-M198 PolarHBondContact O-N 3.43Å; A196-M198 PolarHBondContact O-N 3.12Å; M198-V200 VanDerWaalsContact C-N 3.26Å; M198-V200 HydrophobicContact CB-CG2 4.45Å; M198-V200 PolarHBondContact O-N 2.99Å; M198-V209 HydrophobicContact CE-CG1 3.84Å; M198-K217 HydrophobicContact CE-CG 4.37Å; M198-K217 HydrophobicContact SD-CB 4.31Å; M198-K217 HydrophobicContact SD-CD 4.45Å; M198-K217 HydrophobicContact SD-CG 3.98Å; M198-F218 HydrophobicContact SD-CE2 3.9Å; M198-F218 HydrophobicContact SD-CZ 3.93Å
199	G	94.3	Very high	94.8	Very high	51 Å²	51	64.9 Å²	64.9	53%	0.526	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-4.8	-175.9	0	0	0	0	0	114.9	L195 A196 V197	L195-G199 PolarHBondContact O-N 2.9Å; A196-G199 PolarHBondContact O-N 2.96Å; V197-G199 VanDerWaalsContact C-N 3.27Å
200	V	95.5	Very high	95.1	Very high	5 Å²	5	59.3 Å²	59.3	3%	0.03	33%	0.327	C	S	.	.			trans	-83.3	123.1	-174.7	173.2	0	0	0	0	111.3	V181 L195 A196 M198 D205 L206 V209	V181-V200 HydrophobicContact CG1-CG1 3.67Å; L195-V200 CarbonylContact C-O 3.18Å; L195-V200 HydrophobicContact CB-CB 4.17Å; L195-V200 HydrophobicContact CB-CG1 4.24Å; L195-V200 HydrophobicContact CD2-CB 4.5Å; L195-V200 HydrophobicContact CD2-CG1 4.32Å; L195-V200 PolarHBondContact O-N 3.32Å; A196-V200 WeakPolarHBondContact CA-O 3.46Å; A196-V200 PolarHBondContact N-O 2.88Å; M198-V200 VanDerWaalsContact C-N 3.26Å; M198-V200 HydrophobicContact CB-CG2 4.45Å; M198-V200 PolarHBondContact O-N 2.99Å; V200-D205 HydrophobicContact CB-CB 4.31Å; V200-D205 HydrophobicContact CG1-CB 4.15Å; V200-D205 HydrophobicContact CG2-CB 4.31Å; V200-L206 HydrophobicContact CG1-CB 3.72Å; V200-L206 HydrophobicContact CG1-CD1 4.25Å; V200-L206 HydrophobicContact CG1-CG 4.45Å; V200-V209 HydrophobicContact CG2-CG2 3.65Å
201	K	94.1	Very high	95.2	Very high	154 Å²	154	56.6 Å²	56.6	67%	0.67	31%	0.308	S	S	*	.			trans	-125.8	-41.5	175.7	-62.3	175.6	-174.4	169.4	0	112.3	P180 V181 D205	P180-K201 WeakPolarHBondContact CA-O 3.37Å; V181-K201 PolarHBondContact N-O 3.27Å; K201-D205 WeakPolarHBondContact CA-OD2 3.32Å; K201-D205 PolarHBondContact N-OD2 3.24Å
202	S	96.3	Very high	95.4	Very high	28 Å²	28	58.5 Å²	58.5	20%	0.196	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-97.1	162.4	175.6	76.7	0	0	0	0	112	L179 V181 G204 D205 L206	L179-S202 CarbonylContact O-C 3.59Å; L179-S202 WeakPolarHBondContact O-CA 3.48Å; V181-S202 WeakPolarHBondContact CG1-O 3.32Å; S202-G204 VanDerWaalsContact C-N 3.26Å; S202-G204 PolarHBondContact OG-N 3.4Å; S202-D205 PolarHBondContact N-OD2 2.99Å; S202-D205 PolarHBondContact O-N 3.35Å; S202-D205 PolarHBondContact OG-N 3.3Å; S202-D205 PolarHBondContact OG-OD1 2.87Å; S202-D205 PolarHBondContact OG-OD2 3.17Å; S202-L206 PolarHBondContact O-N 2.93Å; S202-L206 VanDerWaalsContact O-N 3.15Å
203	C	95.9	Very high	95.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-63.6	-34	167.7	-69.3	0	0	0	0	111.4	I176 L179 D205 L206 Q207 C230	I176-C203 HydrophobicContact CG2-CB 3.91Å; I176-C203 WeakPolarHBondContact O-CB 3.39Å; L179-C203 PolarHBondContact O-N 2.93Å; L179-C203 PolarHBondContact O-SG 3.07Å; C203-D205 VanDerWaalsContact C-N 3.35Å; C203-D205 PolarHBondContact O-N 3.41Å; C203-L206 CarbonylContact O-C 3.57Å; C203-L206 WeakPolarHBondContact O-CA 3.35Å; C203-L206 WeakPolarHBondContact O-CB 3.26Å; C203-L206 PolarHBondContact O-N 3.11Å; C203-L206 VanDerWaalsContact O-N 3.11Å; C203-Q207 WeakPolarHBondContact O-CG 3.43Å; C203-Q207 PolarHBondContact O-N 3.01Å; C203-C230 HydrophobicContact CB-CB 4.3Å
204	G	95.9	Very high	95.6	Very high	10 Å²	10	55.3 Å²	55.3	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-42.7	171	0	0	0	0	0	113.2	R177 S202 L206 Q207	R177-G204 PolarHBondContact O-N 3.47Å; S202-G204 VanDerWaalsContact C-N 3.26Å; S202-G204 PolarHBondContact OG-N 3.4Å; G204-L206 VanDerWaalsContact C-N 3.3Å; G204-L206 PolarHBondContact O-N 3.39Å; G204-Q207 WeakPolarHBondContact O-CB 3.47Å; G204-Q207 PolarHBondContact O-N 3.06Å
205	D	95.8	Very high	95.7	Very high	64 Å²	64	53 Å²	53	34%	0.342	30%	0.302	S	S	.	.	H	α-helix	trans	-63.6	-39.8	174	-47.1	-22.3	0	0	0	110.5	V200 K201 S202 C203 Q207 Q208	V200-D205 HydrophobicContact CB-CB 4.31Å; V200-D205 HydrophobicContact CG1-CB 4.15Å; V200-D205 HydrophobicContact CG2-CB 4.31Å; K201-D205 WeakPolarHBondContact CA-OD2 3.32Å; K201-D205 PolarHBondContact N-OD2 3.24Å; S202-D205 PolarHBondContact N-OD2 2.99Å; S202-D205 PolarHBondContact O-N 3.35Å; S202-D205 PolarHBondContact OG-N 3.3Å; S202-D205 PolarHBondContact OG-OD1 2.87Å; S202-D205 PolarHBondContact OG-OD2 3.17Å; C203-D205 VanDerWaalsContact C-N 3.35Å; C203-D205 PolarHBondContact O-N 3.41Å; D205-Q207 VanDerWaalsContact C-N 3.34Å; D205-Q208 WeakPolarHBondContact O-CB 3.48Å; D205-Q208 PolarHBondContact O-N 3.25Å
206	L	96.2	Very high	95.7	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-68.6	-31.2	-180	-174.8	51.9	0	0	0	112.3	V181 L184 L195 V200 S202 C203 G204 Q208 V209 L214 L226 C230	V181-L206 HydrophobicContact CG1-CB 4.14Å; V181-L206 HydrophobicContact CG1-CD2 3.98Å; L184-L206 HydrophobicContact CD1-CD2 4.07Å; L195-L206 HydrophobicContact CD2-CD1 4.07Å; V200-L206 HydrophobicContact CG1-CB 3.72Å; V200-L206 HydrophobicContact CG1-CD1 4.25Å; V200-L206 HydrophobicContact CG1-CG 4.45Å; S202-L206 PolarHBondContact O-N 2.93Å; S202-L206 VanDerWaalsContact O-N 3.15Å; C203-L206 CarbonylContact O-C 3.57Å; C203-L206 WeakPolarHBondContact O-CA 3.35Å; C203-L206 WeakPolarHBondContact O-CB 3.26Å; C203-L206 PolarHBondContact O-N 3.11Å; C203-L206 VanDerWaalsContact O-N 3.11Å; G204-L206 VanDerWaalsContact C-N 3.3Å; G204-L206 PolarHBondContact O-N 3.39Å; L206-Q208 PolarHBondContact O-N 2.98Å; L206-V209 HydrophobicContact CD1-CG2 4.46Å; L206-V209 PolarHBondContact O-N 3.48Å; L206-L214 HydrophobicContact CD1-CD1 4.07Å; L206-L214 HydrophobicContact CD1-CD2 3.65Å; L206-L214 HydrophobicContact CD1-CG 4.49Å; L206-L226 HydrophobicContact CD2-CB 4.43Å; L206-L226 HydrophobicContact CD2-CD2 4.3Å; L206-C230 HydrophobicContact CB-CB 4.02Å; L206-C230 HydrophobicContact CD2-CB 3.83Å; L206-C230 HydrophobicContact CG-CB 3.81Å
207	Q	96.1	Very high	95.7	Very high	36 Å²	36	66.1 Å²	66.1	17%	0.168	35%	0.349	C	S	.	.	H	α-helix	trans	-61.5	-31.8	173.3	-72.4	170.1	1.7	0	0	112	C203 G204 D205 V209 C230 R231	C203-Q207 WeakPolarHBondContact O-CG 3.43Å; C203-Q207 PolarHBondContact O-N 3.01Å; G204-Q207 WeakPolarHBondContact O-CB 3.47Å; G204-Q207 PolarHBondContact O-N 3.06Å; D205-Q207 VanDerWaalsContact C-N 3.34Å; Q207-V209 VanDerWaalsContact C-N 3.26Å; Q207-V209 PolarHBondContact O-N 3.3Å; Q207-C230 HydrophobicContact CG-CB 4.3Å; Q207-C230 WeakPolarHBondContact CG-O 3.4Å; Q207-C230 PolarHBondContact NE2-O 3.39Å; Q207-R231 HydrophobicContact CG-CG 4.14Å; Q207-R231 PolarHBondContact O-NH2 2.85Å
208	Q	95.8	Very high	95.6	Very high	160 Å²	160	61.2 Å²	61.2	75%	0.748	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-12.9	178.3	-54.4	-54.9	-43.6	0	0	113.7	D205 L206	D205-Q208 WeakPolarHBondContact O-CB 3.48Å; D205-Q208 PolarHBondContact O-N 3.25Å; L206-Q208 PolarHBondContact O-N 2.98Å
209	V	95.8	Very high	95.7	Very high	13 Å²	13	59.8 Å²	59.8	8%	0.079	32%	0.317	C	S	.	.	S	Bend	trans	-85.6	129.1	179.7	-170.2	0	0	0	0	110.1	M198 V200 L206 Q207 Q213 L214	M198-V209 HydrophobicContact CE-CG1 3.84Å; V200-V209 HydrophobicContact CG2-CG2 3.65Å; L206-V209 HydrophobicContact CD1-CG2 4.46Å; L206-V209 PolarHBondContact O-N 3.48Å; Q207-V209 VanDerWaalsContact C-N 3.26Å; Q207-V209 PolarHBondContact O-N 3.3Å; V209-Q213 HydrophobicContact CG1-CB 3.9Å; V209-L214 HydrophobicContact CB-CD1 4.48Å; V209-L214 HydrophobicContact CB-CD2 4.2Å; V209-L214 HydrophobicContact CB-CG 4.2Å; V209-L214 HydrophobicContact CG1-CD2 3.75Å; V209-L214 HydrophobicContact CG1-CG 3.74Å
210	S	96.6	Very high	95.8	Very high	45 Å²	45	62 Å²	62	32%	0.315	32%	0.322	S	S	.	.			trans	-66	148.4	178.9	80.1	0	0	0	0	112	S212 Q213 L214	S210-S212 PolarHBondContact O-N 3.15Å; S210-S212 PolarHBondContact OG-OG 2.98Å; S210-Q213 PolarHBondContact O-N 3.46Å; S210-Q213 VanDerWaalsContact O-N 3.1Å; S210-Q213 VanDerWaalsContact OG-CG 3.29Å; S210-Q213 WeakPolarHBondContact OG-CG 3.36Å; S210-Q213 PolarHBondContact OG-N 3.31Å; S210-L214 PolarHBondContact O-N 3.05Å
211	L	96.6	Very high	95.8	Very high	48 Å²	48	71.8 Å²	71.8	25%	0.251	36%	0.358	S	S	.	.	H	α-helix	trans	-54.5	-42.7	175.5	176.7	60.8	0	0	0	111.9	Q213 L214 Q215 Q224 F227	L211-Q213 VanDerWaalsContact C-N 3.34Å; L211-Q213 PolarHBondContact O-N 3.28Å; L211-L214 PolarHBondContact O-N 3.22Å; L211-Q215 HydrophobicContact CD1-CG 3.84Å; L211-Q215 HydrophobicContact CG-CG 4.19Å; L211-Q215 WeakPolarHBondContact O-CB 3.3Å; L211-Q215 WeakPolarHBondContact O-CG 3.48Å; L211-Q215 PolarHBondContact O-N 2.66Å; L211-Q224 VanDerWaalsContact CD2-OE1 3.31Å; L211-F227 HydrophobicContact CB-CD1 4.49Å; L211-F227 HydrophobicContact CB-CD2 3.91Å; L211-F227 HydrophobicContact CB-CE2 4.1Å; L211-F227 HydrophobicContact CB-CG 4.12Å; L211-F227 HydrophobicContact CB-CZ 4.47Å; L211-F227 HydrophobicContact CD1-CB 3.72Å; L211-F227 HydrophobicContact CD1-CD1 4.29Å; L211-F227 HydrophobicContact CD1-CD2 4.44Å; L211-F227 HydrophobicContact CD1-CG 3.9Å
212	S	96.8	Very high	95.8	Very high	81 Å²	81	67.1 Å²	67.1	57%	0.566	34%	0.343	S	S	*	.	H	α-helix	trans	-61.7	-37.3	178.5	54.8	0	0	0	0	113.1	S210 K216	S210-S212 PolarHBondContact O-N 3.15Å; S210-S212 PolarHBondContact OG-OG 2.98Å; S212-K216 WeakPolarHBondContact O-CB 3.47Å; S212-K216 PolarHBondContact O-N 3.06Å
213	Q	96	Very high	95.8	Very high	107 Å²	107	65.8 Å²	65.8	50%	0.5	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-42.7	174.1	-72.6	174.8	10.6	0	0	111.7	V209 S210 L211 K216 K217	V209-Q213 HydrophobicContact CG1-CB 3.9Å; S210-Q213 PolarHBondContact O-N 3.46Å; S210-Q213 VanDerWaalsContact O-N 3.1Å; S210-Q213 VanDerWaalsContact OG-CG 3.29Å; S210-Q213 WeakPolarHBondContact OG-CG 3.36Å; S210-Q213 PolarHBondContact OG-N 3.31Å; L211-Q213 VanDerWaalsContact C-N 3.34Å; L211-Q213 PolarHBondContact O-N 3.28Å; Q213-K216 PolarHBondContact O-N 2.92Å; Q213-K217 WeakPolarHBondContact O-CB 3.46Å; Q213-K217 WeakPolarHBondContact O-CG 3.28Å; Q213-K217 PolarHBondContact O-N 2.82Å
214	L	95.9	Very high	95.8	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-47.9	177.2	-68.4	175.1	0	0	0	111.7	L206 V209 S210 L211 K216 K217 F218 L226 F227	L206-L214 HydrophobicContact CD1-CD1 4.07Å; L206-L214 HydrophobicContact CD1-CD2 3.65Å; L206-L214 HydrophobicContact CD1-CG 4.49Å; V209-L214 HydrophobicContact CB-CD1 4.48Å; V209-L214 HydrophobicContact CB-CD2 4.2Å; V209-L214 HydrophobicContact CB-CG 4.2Å; V209-L214 HydrophobicContact CG1-CD2 3.75Å; V209-L214 HydrophobicContact CG1-CG 3.74Å; S210-L214 PolarHBondContact O-N 3.05Å; L211-L214 PolarHBondContact O-N 3.22Å; L214-K216 PolarHBondContact O-N 3.43Å; L214-K217 PolarHBondContact O-N 3.2Å; L214-F218 HydrophobicContact CD2-CD2 4.05Å; L214-F218 HydrophobicContact CD2-CE2 3.9Å; L214-F218 WeakPolarHBondContact O-CB 3.31Å; L214-F218 WeakPolarHBondContact O-CD2 3.29Å; L214-F218 PolarHBondContact O-N 3.39Å; L214-L226 HydrophobicContact CD1-CB 4.38Å; L214-F227 HydrophobicContact CD1-CB 3.9Å; L214-F227 HydrophobicContact CD1-CD2 4.19Å
215	Q	96.8	Very high	95.8	Very high	68 Å²	68	71 Å²	71	32%	0.318	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-41.6	177	-68.4	179.8	-18	0	0	111.7	L211 K217 G219	L211-Q215 HydrophobicContact CD1-CG 3.84Å; L211-Q215 HydrophobicContact CG-CG 4.19Å; L211-Q215 WeakPolarHBondContact O-CB 3.3Å; L211-Q215 WeakPolarHBondContact O-CG 3.48Å; L211-Q215 PolarHBondContact O-N 2.66Å; Q215-K217 VanDerWaalsContact C-N 3.29Å; Q215-K217 PolarHBondContact O-N 3.07Å; Q215-G219 CarbonylContact O-C 3.46Å; Q215-G219 WeakPolarHBondContact O-CA 3.24Å; Q215-G219 PolarHBondContact O-N 2.92Å
216	K	95.7	Very high	95.8	Very high	190 Å²	190	68.4 Å²	68.4	83%	0.826	35%	0.345	S	S	*	.	H	α-helix	trans	-64.1	-29.6	176	-175.5	172.4	-176.6	172.8	0	113.6	S212 Q213 L214	S212-K216 WeakPolarHBondContact O-CB 3.47Å; S212-K216 PolarHBondContact O-N 3.06Å; Q213-K216 PolarHBondContact O-N 2.92Å; L214-K216 PolarHBondContact O-N 3.43Å
217	K	94.5	Very high	95.9	Very high	139 Å²	139	70.9 Å²	70.9	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-93	-32.7	-178.4	-72.2	-72.8	-172.8	174.6	0	114.1	M198 Q213 L214 Q215	M198-K217 HydrophobicContact CE-CG 4.37Å; M198-K217 HydrophobicContact SD-CB 4.31Å; M198-K217 HydrophobicContact SD-CD 4.45Å; M198-K217 HydrophobicContact SD-CG 3.98Å; Q213-K217 WeakPolarHBondContact O-CB 3.46Å; Q213-K217 WeakPolarHBondContact O-CG 3.28Å; Q213-K217 PolarHBondContact O-N 2.82Å; L214-K217 PolarHBondContact O-N 3.2Å; Q215-K217 VanDerWaalsContact C-N 3.29Å; Q215-K217 PolarHBondContact O-N 3.07Å
218	F	94.2	Very high	95.9	Very high	28 Å²	28	72.7 Å²	72.7	12%	0.123	36%	0.361	C	S	.	.	H	α-helix	trans	-120.3	-4.2	-170	-57.4	-65.9	0	0	0	114.3	M191 K194 L195 M198 L214 T222 L226	M191-F218 HydrophobicContact CE-CD1 4.25Å; M191-F218 HydrophobicContact SD-CD1 3.26Å; M191-F218 WeakPolarHBondContact SD-CD1 3.43Å; M191-F218 HydrophobicContact SD-CE1 3.37Å; M191-F218 WeakPolarHBondContact SD-CE1 3.29Å; M191-F218 HydrophobicContact SD-CG 4.1Å; M191-F218 HydrophobicContact SD-CZ 4.29Å; K194-F218 HydrophobicContact CB-CE1 3.72Å; K194-F218 HydrophobicContact CB-CZ 4.14Å; K194-F218 HydrophobicContact CD-CD1 4.48Å; K194-F218 HydrophobicContact CD-CE1 3.94Å; L195-F218 HydrophobicContact CD2-CE2 3.69Å; L195-F218 HydrophobicContact CD2-CZ 3.62Å; L195-F218 HydrophobicContact CG-CZ 3.99Å; M198-F218 HydrophobicContact SD-CE2 3.9Å; M198-F218 HydrophobicContact SD-CZ 3.93Å; L214-F218 HydrophobicContact CD2-CD2 4.05Å; L214-F218 HydrophobicContact CD2-CE2 3.9Å; L214-F218 WeakPolarHBondContact O-CB 3.31Å; L214-F218 WeakPolarHBondContact O-CD2 3.29Å; L214-F218 PolarHBondContact O-N 3.39Å; F218-T222 HydrophobicContact CB-CG2 4.02Å; F218-T222 WeakPolarHBondContact O-CB 3.27Å; F218-L226 HydrophobicContact CB-CD1 4.44Å; F218-L226 HydrophobicContact CD2-CD1 3.75Å; F218-L226 HydrophobicContact CE2-CD1 4.19Å; F218-L226 HydrophobicContact CG-CD1 4.05Å
219	G	95.6	Very high	95.9	Very high	28 Å²	28	65.8 Å²	65.8	29%	0.289	33%	0.329	S	S	.	.			trans	88.7	158.8	-172.2	0	0	0	0	0	112	Q215 R221 G223	Q215-G219 CarbonylContact O-C 3.46Å; Q215-G219 WeakPolarHBondContact O-CA 3.24Å; Q215-G219 PolarHBondContact O-N 2.92Å; G219-R221 PolarHBondContact O-N 3.1Å; G219-G223 PolarHBondContact O-N 3.26Å
220	P	95.5	Very high	95.9	Very high	97 Å²	97	65.2 Å²	65.2	63%	0.63	33%	0.325	S	S	*	.	H	α-helix	trans	-58.8	-52.7	-168.9	20.9	-32.4	0	0	0	112.5	G223 Q224	P220-G223 PolarHBondContact O-N 2.92Å; P220-Q224 WeakPolarHBondContact O-CB 3.45Å; P220-Q224 PolarHBondContact O-N 2.94Å
221	R	94.9	Very high	95.9	Very high	211 Å²	211	66.4 Å²	66.4	80%	0.796	32%	0.323	S	S	*	.	H	α-helix	trans	-61.6	-51.1	-178.3	-171.3	175.8	-175.1	164	5.1	112.6	G219 Q224 T225	G219-R221 PolarHBondContact O-N 3.1Å; R221-Q224 PolarHBondContact O-N 3.37Å; R221-T225 PolarHBondContact O-N 3.44Å; R221-T225 PolarHBondContact O-OG1 3.02Å
222	T	95.4	Very high	95.8	Very high	57 Å²	57	64.3 Å²	64.3	35%	0.35	31%	0.312	S	S	.	.	H	α-helix	trans	-69	-36.6	-178.4	-56	0	0	0	0	112.1	M191 F218 T225 L226	M191-T222 HydrophobicContact CE-CG2 3.65Å; F218-T222 HydrophobicContact CB-CG2 4.02Å; F218-T222 WeakPolarHBondContact O-CB 3.27Å; T222-T225 PolarHBondContact O-N 3.2Å; T222-L226 HydrophobicContact CG2-CD1 4.21Å; T222-L226 HydrophobicContact CG2-CG 4.46Å; T222-L226 WeakPolarHBondContact O-CB 3.41Å; T222-L226 VanDerWaalsContact O-CG 3.3Å; T222-L226 WeakPolarHBondContact O-CG 3.32Å; T222-L226 PolarHBondContact O-N 2.85Å
223	G	96	Very high	95.8	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-44.8	172.7	0	0	0	0	0	112.2	G219 P220 L226 F227	G219-G223 PolarHBondContact O-N 3.26Å; P220-G223 PolarHBondContact O-N 2.92Å; G223-L226 PolarHBondContact O-N 2.99Å; G223-F227 WeakPolarHBondContact O-CB 3.29Å; G223-F227 PolarHBondContact O-N 3.44Å
224	Q	96.3	Very high	95.8	Very high	69 Å²	69	60.2 Å²	60.2	32%	0.322	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-47.5	174	-167.7	67.8	20.3	0	0	111.9	L211 P220 R221 L226 F227 R228	L211-Q224 VanDerWaalsContact CD2-OE1 3.31Å; P220-Q224 WeakPolarHBondContact O-CB 3.45Å; P220-Q224 PolarHBondContact O-N 2.94Å; R221-Q224 PolarHBondContact O-N 3.37Å; Q224-L226 PolarHBondContact O-N 3.31Å; Q224-F227 PolarHBondContact O-N 2.95Å; Q224-R228 WeakPolarHBondContact O-CG 3.35Å; Q224-R228 PolarHBondContact O-N 3.48Å
225	T	96.1	Very high	95.7	Very high	51 Å²	51	65.5 Å²	65.5	31%	0.313	32%	0.315	S	S	.	.	H	α-helix	trans	-60.2	-45.3	178.6	-56.8	0	0	0	0	111.7	R221 T222 R228 F229	R221-T225 PolarHBondContact O-N 3.44Å; R221-T225 PolarHBondContact O-OG1 3.02Å; T222-T225 PolarHBondContact O-N 3.2Å; T225-R228 PolarHBondContact O-N 3.22Å; T225-F229 HydrophobicContact CG2-CD1 4.1Å; T225-F229 HydrophobicContact CG2-CD2 3.65Å; T225-F229 HydrophobicContact CG2-CE1 3.91Å; T225-F229 HydrophobicContact CG2-CE2 3.42Å; T225-F229 VanDerWaalsContact CG2-CE2 3.42Å; T225-F229 HydrophobicContact CG2-CG 3.99Å; T225-F229 HydrophobicContact CG2-CZ 3.57Å; T225-F229 VanDerWaalsContact O-CB 3.24Å; T225-F229 WeakPolarHBondContact O-CB 3.37Å; T225-F229 VanDerWaalsContact O-CG 3.29Å; T225-F229 WeakPolarHBondContact O-CG 3.23Å; T225-F229 PolarHBondContact O-N 2.87Å
226	L	96	Very high	95.6	Very high	8 Å²	8	67.4 Å²	67.4	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-62.1	-44.9	176.7	-72.2	171	0	0	0	112	V187 L206 L214 F218 T222 G223 Q224 R228 F229 C230	V187-L226 HydrophobicContact CG2-CD2 3.63Å; L206-L226 HydrophobicContact CD2-CB 4.43Å; L206-L226 HydrophobicContact CD2-CD2 4.3Å; L214-L226 HydrophobicContact CD1-CB 4.38Å; F218-L226 HydrophobicContact CB-CD1 4.44Å; F218-L226 HydrophobicContact CD2-CD1 3.75Å; F218-L226 HydrophobicContact CE2-CD1 4.19Å; F218-L226 HydrophobicContact CG-CD1 4.05Å; T222-L226 HydrophobicContact CG2-CD1 4.21Å; T222-L226 HydrophobicContact CG2-CG 4.46Å; T222-L226 WeakPolarHBondContact O-CB 3.41Å; T222-L226 VanDerWaalsContact O-CG 3.3Å; T222-L226 WeakPolarHBondContact O-CG 3.32Å; T222-L226 PolarHBondContact O-N 2.85Å; G223-L226 PolarHBondContact O-N 2.99Å; Q224-L226 PolarHBondContact O-N 3.31Å; L226-R228 VanDerWaalsContact C-N 3.32Å; L226-R228 PolarHBondContact O-N 3.47Å; L226-F229 PolarHBondContact O-N 2.73Å; L226-C230 PolarHBondContact O-N 3.33Å; L226-C230 VanDerWaalsContact O-N 3.1Å; L226-C230 PolarHBondContact O-SG 2.74Å
227	F	96.7	Very high	95.5	Very high	52 Å²	52	62.7 Å²	62.7	23%	0.228	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-37.1	-179.6	-175.7	-95.8	0	0	0	113	L211 L214 G223 Q224 C230 R231	L211-F227 HydrophobicContact CB-CD1 4.49Å; L211-F227 HydrophobicContact CB-CD2 3.91Å; L211-F227 HydrophobicContact CB-CE2 4.1Å; L211-F227 HydrophobicContact CB-CG 4.12Å; L211-F227 HydrophobicContact CB-CZ 4.47Å; L211-F227 HydrophobicContact CD1-CB 3.72Å; L211-F227 HydrophobicContact CD1-CD1 4.29Å; L211-F227 HydrophobicContact CD1-CD2 4.44Å; L211-F227 HydrophobicContact CD1-CG 3.9Å; L214-F227 HydrophobicContact CD1-CB 3.9Å; L214-F227 HydrophobicContact CD1-CD2 4.19Å; G223-F227 WeakPolarHBondContact O-CB 3.29Å; G223-F227 PolarHBondContact O-N 3.44Å; Q224-F227 PolarHBondContact O-N 2.95Å; F227-C230 PolarHBondContact O-SG 3.45Å; F227-R231 VanDerWaalsContact CE2-NH1 3.32Å; F227-R231 PolarHBondContact O-NH1 3.44Å
228	R	96.8	Very high	95.4	Very high	74 Å²	74	56.9 Å²	56.9	28%	0.279	28%	0.284	S	S	.	.	H	α-helix	trans	-77.7	-46.8	175.7	-70.4	-175.3	67.8	127.1	-8	112.7	Q224 T225 L226 C230 R231 G232 L233 D235	Q224-R228 WeakPolarHBondContact O-CG 3.35Å; Q224-R228 PolarHBondContact O-N 3.48Å; T225-R228 PolarHBondContact O-N 3.22Å; L226-R228 VanDerWaalsContact C-N 3.32Å; L226-R228 PolarHBondContact O-N 3.47Å; R228-C230 PolarHBondContact O-N 2.66Å; R228-R231 CarbonylContact O-C 3.44Å; R228-R231 WeakPolarHBondContact O-CA 3.34Å; R228-R231 WeakPolarHBondContact O-CB 3.21Å; R228-R231 PolarHBondContact O-N 2.85Å; R228-G232 PolarHBondContact O-N 2.99Å; R228-L233 HydrophobicContact CB-CB 4.08Å; R228-L233 WeakPolarHBondContact CB-O 3.35Å; R228-L233 PolarHBondContact O-N 2.95Å; R228-L233 VanDerWaalsContact O-N 3.1Å; R228-D235 IonicContact CZ-OD2 2.81Å; R228-D235 IonicContact NE-OD2 3.39Å; R228-D235 IonicContact NH1-OD2 2.89Å; R228-D235 PolarHBondContact NH1-OD2 3.41Å; R228-D235 IonicContact NH2-OD1 3.9Å; R228-D235 IonicContact NH2-OD2 3.97Å; R228-D235 PolarHBondContact NH2-OD2 3.24Å
229	F	96.5	Very high	95.1	Very high	16 Å²	16	62.9 Å²	62.9	7%	0.07	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-33.2	-176	-76	7.7	0	0	0	113.2	L150 L184 P185 T225 L226 R231 G232 D234	L150-F229 HydrophobicContact CD1-CD2 4.25Å; L150-F229 HydrophobicContact CD1-CG 4.31Å; L150-F229 HydrophobicContact CD2-CB 3.84Å; L150-F229 HydrophobicContact CD2-CD1 3.81Å; L150-F229 HydrophobicContact CD2-CG 3.84Å; L184-F229 HydrophobicContact CD1-CB 4.3Å; L184-F229 HydrophobicContact CD2-CB 4.31Å; P185-F229 HydrophobicContact CB-CE2 4.22Å; T225-F229 HydrophobicContact CG2-CD1 4.1Å; T225-F229 HydrophobicContact CG2-CD2 3.65Å; T225-F229 HydrophobicContact CG2-CE1 3.91Å; T225-F229 HydrophobicContact CG2-CE2 3.42Å; T225-F229 VanDerWaalsContact CG2-CE2 3.42Å; T225-F229 HydrophobicContact CG2-CG 3.99Å; T225-F229 HydrophobicContact CG2-CZ 3.57Å; T225-F229 VanDerWaalsContact O-CB 3.24Å; T225-F229 WeakPolarHBondContact O-CB 3.37Å; T225-F229 VanDerWaalsContact O-CG 3.29Å; T225-F229 WeakPolarHBondContact O-CG 3.23Å; T225-F229 PolarHBondContact O-N 2.87Å; L226-F229 PolarHBondContact O-N 2.73Å; F229-R231 PolarHBondContact O-N 2.67Å; F229-R231 VanDerWaalsContact O-N 3.13Å; F229-G232 PolarHBondContact O-N 2.72Å; F229-D234 HydrophobicContact CE1-CB 4.17Å
230	C	95.8	Very high	94.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-3.6	172.5	67.4	0	0	0	0	114.1	I176 L184 C203 L206 Q207 L226 F227 R228	I176-C230 VanDerWaalsContact CG2-O 3.24Å; I176-C230 WeakPolarHBondContact CG2-O 3.44Å; L184-C230 HydrophobicContact CD1-CB 4.44Å; C203-C230 HydrophobicContact CB-CB 4.3Å; L206-C230 HydrophobicContact CB-CB 4.02Å; L206-C230 HydrophobicContact CD2-CB 3.83Å; L206-C230 HydrophobicContact CG-CB 3.81Å; Q207-C230 HydrophobicContact CG-CB 4.3Å; Q207-C230 WeakPolarHBondContact CG-O 3.4Å; Q207-C230 PolarHBondContact NE2-O 3.39Å; L226-C230 PolarHBondContact O-N 3.33Å; L226-C230 VanDerWaalsContact O-N 3.1Å; L226-C230 PolarHBondContact O-SG 2.74Å; F227-C230 PolarHBondContact O-SG 3.45Å; R228-C230 PolarHBondContact O-N 2.66Å
231	R	95.1	Very high	94	Very high	71 Å²	71	69.6 Å²	69.6	27%	0.268	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	13.8	176	-64.9	172.5	168.8	71.2	6.7	112.5	Q207 F227 R228 F229 L233	Q207-R231 HydrophobicContact CG-CG 4.14Å; Q207-R231 PolarHBondContact O-NH2 2.85Å; F227-R231 VanDerWaalsContact CE2-NH1 3.32Å; F227-R231 PolarHBondContact O-NH1 3.44Å; R228-R231 CarbonylContact O-C 3.44Å; R228-R231 WeakPolarHBondContact O-CA 3.34Å; R228-R231 WeakPolarHBondContact O-CB 3.21Å; R228-R231 PolarHBondContact O-N 2.85Å; F229-R231 PolarHBondContact O-N 2.67Å; F229-R231 VanDerWaalsContact O-N 3.13Å; R231-L233 HydrophobicContact CB-CD1 4.3Å; R231-L233 HydrophobicContact CB-CG 4.12Å; R231-L233 PolarHBondContact O-N 2.83Å; R231-L233 VanDerWaalsContact O-N 3.15Å
232	G	95.6	Very high	93.5	Very high	3 Å²	3	65 Å²	65	3%	0.031	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	4.9	-178.9	0	0	0	0	0	115.7	N148 I176 R228 F229 D234	N148-G232 PolarHBondContact ND2-O 2.96Å; I176-G232 VanDerWaalsContact CD1-N 3.29Å; R228-G232 PolarHBondContact O-N 2.99Å; F229-G232 PolarHBondContact O-N 2.72Å; G232-D234 PolarHBondContact O-N 2.98Å
233	L	95.8	Very high	93.1	Very high	88 Å²	88	70.3 Å²	70.3	46%	0.461	33%	0.327	S	S	.	.			trans	-85.7	112.2	-174.8	-56.7	179.7	0	0	0	110.8	R228 R231	R228-L233 HydrophobicContact CB-CB 4.08Å; R228-L233 WeakPolarHBondContact CB-O 3.35Å; R228-L233 PolarHBondContact O-N 2.95Å; R228-L233 VanDerWaalsContact O-N 3.1Å; R231-L233 HydrophobicContact CB-CD1 4.3Å; R231-L233 HydrophobicContact CB-CG 4.12Å; R231-L233 PolarHBondContact O-N 2.83Å; R231-L233 VanDerWaalsContact O-N 3.15Å
234	D	96	Very high	93	Very high	14 Å²	14	77.8 Å²	77.8	8%	0.075	36%	0.355	C	S	.	.			trans	-138.9	118.3	173.7	-167.2	8.9	0	0	0	109.1	N148 L150 F229 G232 R236	N148-D234 HydrophobicContact CB-CB 4.24Å; N148-D234 WeakPolarHBondContact CB-O 3.37Å; L150-D234 HydrophobicContact CB-CB 3.64Å; L150-D234 WeakPolarHBondContact CB-OD2 3.49Å; L150-D234 HydrophobicContact CD2-CB 4.45Å; L150-D234 PolarHBondContact N-OD2 2.89Å; L150-D234 VanDerWaalsContact N-OD2 3.16Å; F229-D234 HydrophobicContact CE1-CB 4.17Å; G232-D234 PolarHBondContact O-N 2.98Å; D234-R236 WeakPolarHBondContact OD1-CG 3.49Å; D234-R236 IonicContact OD1-CZ 3.31Å; D234-R236 PolarHBondContact OD1-N 3.04Å; D234-R236 IonicContact OD1-NE 2.95Å; D234-R236 PolarHBondContact OD1-NE 3.13Å; D234-R236 IonicContact OD1-NH2 2.82Å; D234-R236 IonicContact OD2-CZ 3.48Å; D234-R236 IonicContact OD2-NE 3.81Å; D234-R236 PolarHBondContact OD2-NE 2.84Å; D234-R236 IonicContact OD2-NH2 3.28Å; D234-R236 PolarHBondContact OD2-NH2 3.26Å
235	D	94.4	Very high	92.9	Very high	112 Å²	112	82.7 Å²	82.7	60%	0.599	38%	0.375	S	S	*	.			trans	-103.2	7.3	-175.7	48.7	4.3	0	0	0	112.8	R228 P237	R228-D235 IonicContact CZ-OD2 2.81Å; R228-D235 IonicContact NE-OD2 3.39Å; R228-D235 IonicContact NH1-OD2 2.89Å; R228-D235 PolarHBondContact NH1-OD2 3.41Å; R228-D235 IonicContact NH2-OD1 3.9Å; R228-D235 IonicContact NH2-OD2 3.97Å; R228-D235 PolarHBondContact NH2-OD2 3.24Å; D235-P237 WeakPolarHBondContact O-CD 3.26Å
236	R	94.2	Very high	92.9	Very high	108 Å²	108	82.1 Å²	82.1	41%	0.408	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-76.8	122	-179.4	-63.1	177.7	-64.1	147.2	6.4	109.9	I149 D234	I149-R236 HydrophobicContact CD1-CB 4.42Å; I149-R236 VanDerWaalsContact CD1-O 3.23Å; I149-R236 WeakPolarHBondContact CD1-O 3.45Å; D234-R236 WeakPolarHBondContact OD1-CG 3.49Å; D234-R236 IonicContact OD1-CZ 3.31Å; D234-R236 PolarHBondContact OD1-N 3.04Å; D234-R236 IonicContact OD1-NE 2.95Å; D234-R236 PolarHBondContact OD1-NE 3.13Å; D234-R236 IonicContact OD1-NH2 2.82Å; D234-R236 IonicContact OD2-CZ 3.48Å; D234-R236 IonicContact OD2-NE 3.81Å; D234-R236 PolarHBondContact OD2-NE 2.84Å; D234-R236 IonicContact OD2-NH2 3.28Å; D234-R236 PolarHBondContact OD2-NH2 3.26Å
237	P	93.8	Very high	92.9	Very high	90 Å²	90	82.1 Å²	82.1	58%	0.584	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-71.4	158.7	169.6	31.6	-35.5	0	0	0	110.6	D235 R239	D235-P237 WeakPolarHBondContact O-CD 3.26Å; P237-R239 PolarHBondContact O-N 2.93Å
238	V	92.4	Very high	92.9	Very high	17 Å²	17	81.8 Å²	81.8	10%	0.103	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-62.6	130.3	169.6	-179.4	0	0	0	0	108.5	E100 L108 D110 I149 F240	E100-V238 HydrophobicContact CB-CG1 3.43Å; E100-V238 VanDerWaalsContact CB-CG1 3.43Å; L108-V238 HydrophobicContact CB-CG1 4.46Å; D110-V238 HydrophobicContact CB-CB 4.4Å; D110-V238 HydrophobicContact CB-CG2 4.09Å; I149-V238 HydrophobicContact CD1-CG2 4.15Å; I149-V238 HydrophobicContact CG1-CG2 4.26Å; V238-F240 HydrophobicContact CB-CE1 3.78Å; V238-F240 HydrophobicContact CB-CZ 4.37Å; V238-F240 HydrophobicContact CG1-CD1 3.9Å; V238-F240 HydrophobicContact CG1-CE1 3.51Å
239	R	89.3	Confident	93	Very high	155 Å²	155	78.4 Å²	78.4	59%	0.585	37%	0.366	S	S	*	.			trans	-105.5	95.6	-175.4	-64	-176.1	180	-151.2	-6.9	111.6	E100 P237	E100-R239 WeakPolarHBondContact CG-O 3.47Å; E100-R239 PolarHBondContact OE2-N 3.23Å; P237-R239 PolarHBondContact O-N 2.93Å
240	F	84.1	Confident	93	Very high	98 Å²	98	82.9 Å²	82.9	43%	0.43	39%	0.387	S	S	.	.	S	Bend	trans	-63.4	-45.6	178.9	-37.6	-50.9	0	0	0	111.5	D98 V238	D98-F240 VanDerWaalsContact C-CD1 3.45Å; D98-F240 HydrophobicContact CB-CD1 4.3Å; D98-F240 HydrophobicContact CB-CE1 3.56Å; D98-F240 HydrophobicContact CB-CZ 3.84Å; V238-F240 HydrophobicContact CB-CE1 3.78Å; V238-F240 HydrophobicContact CB-CZ 4.37Å; V238-F240 HydrophobicContact CG1-CD1 3.9Å; V238-F240 HydrophobicContact CG1-CE1 3.51Å
241	E	82.1	Confident	93	Very high	168 Å²	168	87.2 Å²	87.2	79%	0.785	41%	0.408	S	S	*	.			trans	-101.7	132.3	178.6	-62.3	-167	167.6	0	0	112.5
242	K	85.1	Confident	93	Very high	113 Å²	113	85.7 Å²	85.7	49%	0.491	41%	0.406	S	S	.	.			trans	-132.2	94.9	-179.9	-70.7	178.8	-179.1	175.1	0	111.3	E100 A101 R244	E100-K242 VanDerWaalsContact CD-NZ 3.31Å; E100-K242 VanDerWaalsContact CG-CE 3.45Å; E100-K242 WeakPolarHBondContact OE1-CE 3.31Å; E100-K242 IonicContact OE1-NZ 3.92Å; E100-K242 PolarHBondContact OE1-NZ 2.86Å; A101-K242 PolarHBondContact O-NZ 3.36Å; K242-R244 PolarHBondContact O-N 2.7Å
243	E	88.3	Confident	93	Very high	170 Å²	170	91 Å²	91	79%	0.794	43%	0.425	S	S	*	.			trans	-59.7	130.3	172.1	-64	-172.3	146.6	0	0	112.1	K245	E243-K245 PolarHBondContact O-N 3.21Å
244	R	92.3	Very high	93	Very high	157 Å²	157	91.7 Å²	91.7	59%	0.592	43%	0.429	S	S	*	.			trans	-76.6	114	179.1	-177.2	171.2	-70.8	161.5	-1.3	110.4	K242 S246 V247 L283 L359	K242-R244 PolarHBondContact O-N 2.7Å; R244-S246 WeakPolarHBondContact CG-O 3.2Å; R244-V247 HydrophobicContact CG-CG2 4.47Å; R244-L283 HydrophobicContact CB-CD1 4.22Å; R244-L283 HydrophobicContact CG-CD1 4.39Å; R244-L359 HydrophobicContact CG-CD1 4.27Å
245	K	93.8	Very high	93	Very high	171 Å²	171	91.2 Å²	91.2	74%	0.743	43%	0.427	S	S	*	.			trans	-89.2	-15.6	-176.5	-53.8	-162.6	177.5	-158.9	0	115.2	E243	E243-K245 PolarHBondContact O-N 3.21Å
246	S	96.4	Very high	93	Very high	40 Å²	40	89.2 Å²	89.2	28%	0.28	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	151.4	174.6	65.3	0	0	0	0	112.2	R244 Q355 V356	R244-S246 WeakPolarHBondContact CG-O 3.2Å; S246-Q355 PolarHBondContact OG-NE2 3.08Å; S246-V356 CarbonylContact C-O 3.53Å; S246-V356 WeakPolarHBondContact CA-O 3.18Å; S246-V356 WeakPolarHBondContact CB-O 3.41Å
247	V	96.9	Very high	93.1	Very high	8 Å²	8	85 Å²	85	5%	0.048	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.9	168.5	169.3	0	0	0	0	107.7	R244 R277 L278 V356 L359	R244-V247 HydrophobicContact CG-CG2 4.47Å; V247-R277 HydrophobicContact CG1-CB 3.56Å; V247-L278 HydrophobicContact CB-CD2 3.88Å; V247-L278 HydrophobicContact CB-CG 4.29Å; V247-L278 HydrophobicContact CG1-CD2 4.26Å; V247-L278 HydrophobicContact CG1-CG 4.12Å; V247-L278 HydrophobicContact CG2-CD2 3.95Å; V247-V356 PolarHBondContact N-O 3.47Å; V247-V356 PolarHBondContact O-N 3.47Å; V247-L359 HydrophobicContact CG2-CD1 3.9Å
248	S	96.9	Very high	93.1	Very high	44 Å²	44	83.9 Å²	83.9	31%	0.308	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155.3	178.2	51.6	0	0	0	0	112.4	R277 I354	S248-R277 PolarHBondContact O-NH1 2.84Å; S248-I354 WeakPolarHBondContact CA-O 3.23Å; S248-I354 WeakPolarHBondContact CB-O 3.38Å
249	A	97.6	Very high	93.2	Very high	3 Å²	3	86 Å²	86	3%	0.025	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.2	163.2	0	0	0	0	0	107.7	L270 E273 V274 G353 I354	A249-L270 HydrophobicContact CB-CD1 3.57Å; A249-L270 HydrophobicContact CB-CG 4.35Å; A249-E273 HydrophobicContact CB-CG 3.96Å; A249-V274 HydrophobicContact CB-CG2 3.73Å; A249-G353 WeakPolarHBondContact O-CA 3.48Å; A249-I354 PolarHBondContact N-O 3.01Å; A249-I354 PolarHBondContact O-N 2.75Å
250	E	96.8	Very high	93.5	Very high	111 Å²	111	81.4 Å²	81.4	52%	0.519	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	144.6	179	64.6	-175.8	176.8	0	0	110.7	V352	E250-V352 WeakPolarHBondContact CA-O 3.37Å
251	M	96.4	Very high	94	Very high	90 Å²	90	82.5 Å²	82.5	44%	0.443	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	108.5	177.5	-173.1	63.5	75.2	0	0	107.9	Y253 I255 F266 G351 V352	M251-Y253 WeakPolarHBondContact CG-O 3.43Å; M251-I255 HydrophobicContact CB-CD1 4.09Å; M251-I255 HydrophobicContact CB-CG1 4.5Å; M251-I255 HydrophobicContact CG-CD1 3.66Å; M251-I255 HydrophobicContact CG-CG1 4.13Å; M251-I255 WeakPolarHBondContact O-CG1 3.36Å; M251-F266 HydrophobicContact CB-CE1 4.38Å; M251-F266 HydrophobicContact CB-CZ 3.82Å; M251-F266 HydrophobicContact CG-CZ 4.05Å; M251-G351 CarbonylContact O-C 3.57Å; M251-G351 VanDerWaalsContact O-CA 3.31Å; M251-G351 WeakPolarHBondContact O-CA 3.24Å; M251-V352 PolarHBondContact N-O 3.36Å; M251-V352 PolarHBondContact O-N 3.03Å
252	N	96.1	Very high	94.7	Very high	40 Å²	40	78.3 Å²	78.3	21%	0.214	39%	0.387	C	S	.	.			trans	-115.5	19.8	-178.6	-58.6	-45.4	0	0	0	111.5	M293 H309 G351	N252-M293 HydrophobicContact CB-CE 4.29Å; N252-M293 HydrophobicContact CB-SD 4.12Å; N252-H309 PolarHBondContact O-CD2 3.39Å; N252-G351 WeakPolarHBondContact OD1-CA 3.08Å
253	Y	95.6	Very high	95.2	Very high	114 Å²	114	73 Å²	73	45%	0.447	36%	0.364	S	S	.	.	S	Bend	trans	-134.2	142.3	178.6	-173.4	-100.8	0	0	0	109.2	M251 I255 Y306 G307	M251-Y253 WeakPolarHBondContact CG-O 3.43Å; Y253-I255 PolarHBondContact O-N 3.02Å; Y253-I255 VanDerWaalsContact O-N 3.14Å; Y253-Y306 VanDerWaalsContact CE2-O 3.27Å; Y253-Y306 WeakPolarHBondContact CE2-O 3.25Å; Y253-Y306 PolarHBondContact OH-O 3.35Å; Y253-G307 VanDerWaalsContact CD2-O 3.29Å; Y253-G307 WeakPolarHBondContact CD2-O 3.31Å; Y253-G307 VanDerWaalsContact CE2-C 3.48Å
254	N	94.6	Very high	95.6	Very high	102 Å²	102	67.2 Å²	67.2	55%	0.545	34%	0.337	S	S	.	.	S	Bend	trans	52.3	25.3	-176.9	-150	40.7	0	0	0	116.3	R256 G307	N254-R256 PolarHBondContact O-N 2.87Å; N254-G307 WeakPolarHBondContact CA-O 3.22Å; N254-G307 PolarHBondContact N-O 3.04Å
255	I	95.8	Very high	95.8	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.026	33%	0.332	C	S	.	.			trans	-80.4	114.9	172.9	-60.7	-55.4	0	0	0	109.7	M251 Y253 F257 F266 L349 V352	M251-I255 HydrophobicContact CB-CD1 4.09Å; M251-I255 HydrophobicContact CB-CG1 4.5Å; M251-I255 HydrophobicContact CG-CD1 3.66Å; M251-I255 HydrophobicContact CG-CG1 4.13Å; M251-I255 WeakPolarHBondContact O-CG1 3.36Å; Y253-I255 PolarHBondContact O-N 3.02Å; Y253-I255 VanDerWaalsContact O-N 3.14Å; I255-F257 HydrophobicContact CD1-CZ 4.42Å; I255-F257 HydrophobicContact CG2-CD2 4.07Å; I255-F257 HydrophobicContact CG2-CE2 3.51Å; I255-F257 HydrophobicContact CG2-CZ 3.95Å; I255-F266 HydrophobicContact CD1-CE1 3.91Å; I255-F266 HydrophobicContact CD1-CE2 4.06Å; I255-F266 HydrophobicContact CD1-CZ 3.6Å; I255-L349 HydrophobicContact CG2-CB 4.42Å; I255-V352 HydrophobicContact CG2-CG2 4.35Å
256	R	95.2	Very high	96	Very high	70 Å²	70	57.8 Å²	57.8	26%	0.264	31%	0.308	S	S	.	.			trans	-145.4	129.4	167.8	-60.8	-65.8	-174.4	-80.4	-6	106.7	N254 E302 G308 R350	N254-R256 PolarHBondContact O-N 2.87Å; R256-E302 IonicContact CZ-OE2 3.67Å; R256-E302 IonicContact NE-OE1 3.41Å; R256-E302 IonicContact NE-OE2 3.53Å; R256-E302 IonicContact NH2-OE1 3.41Å; R256-E302 IonicContact NH2-OE2 2.68Å; R256-E302 PolarHBondContact NH2-OE2 3.03Å; R256-G308 PolarHBondContact NH1-O 2.85Å; R256-G308 PolarHBondContact NH2-O 2.74Å; R256-R350 VanDerWaalsContact NH1-CD 3.27Å
257	F	95.4	Very high	96	Very high	20 Å²	20	56 Å²	56	9%	0.088	30%	0.296	C	S	.	.			trans	-125.4	131.7	175.3	-57.7	-61	0	0	0	109.1	I255 E262 A263 F266 V346 Q347 L349 V352	I255-F257 HydrophobicContact CD1-CZ 4.42Å; I255-F257 HydrophobicContact CG2-CD2 4.07Å; I255-F257 HydrophobicContact CG2-CE2 3.51Å; I255-F257 HydrophobicContact CG2-CZ 3.95Å; F257-E262 HydrophobicContact CD1-CB 3.98Å; F257-A263 HydrophobicContact CB-CB 4.36Å; F257-A263 HydrophobicContact CD1-CB 4.28Å; F257-A263 HydrophobicContact CD2-CB 3.74Å; F257-A263 HydrophobicContact CE2-CB 4.02Å; F257-A263 HydrophobicContact CG-CB 3.88Å; F257-A263 HydrophobicContact CZ-CB 4.41Å; F257-F266 HydrophobicContact CE1-CB 3.67Å; F257-F266 HydrophobicContact CE1-CD1 4.43Å; F257-F266 HydrophobicContact CE1-CD2 4.37Å; F257-F266 AromaticContact CE1-CG 3.91Å; F257-F266 HydrophobicContact CE1-CG 3.91Å; F257-F266 HydrophobicContact CZ-CB 3.77Å; F257-F266 AromaticContact CZ-CD1 3.77Å; F257-F266 HydrophobicContact CZ-CD1 3.77Å; F257-F266 HydrophobicContact CZ-CD2 4.4Å; F257-F266 AromaticContact CZ-CG 3.7Å; F257-F266 HydrophobicContact CZ-CG 3.7Å; F257-V346 HydrophobicContact CB-CB 4.33Å; F257-Q347 WeakPolarHBondContact O-CA 3.45Å; F257-L349 HydrophobicContact CD2-CB 4.07Å; F257-L349 HydrophobicContact CD2-CD1 3.86Å; F257-L349 HydrophobicContact CE2-CB 4.4Å; F257-L349 HydrophobicContact CE2-CD1 4.17Å; F257-V352 HydrophobicContact CE2-CG2 4.15Å
258	A	94.3	Very high	96	Very high	65 Å²	65	58.1 Å²	58.1	54%	0.537	31%	0.309	S	S	.	.	S	Bend	trans	-84.7	-40.7	172.5	0	0	0	0	0	110.8	E262	A258-E262 PolarHBondContact N-OE2 2.87Å
259	T	95.6	Very high	96	Very high	61 Å²	61	60.8 Å²	60.8	37%	0.374	32%	0.319	S	S	.	.	S	Bend	trans	-116.9	166	-176	65.3	0	0	0	0	113.1	E262	T259-E262 WeakPolarHBondContact CB-OE1 3.41Å; T259-E262 WeakPolarHBondContact CG2-OE1 3.42Å; T259-E262 PolarHBondContact N-OE1 2.73Å; T259-E262 VanDerWaalsContact OG1-CG 3.26Å; T259-E262 WeakPolarHBondContact OG1-CG 3.5Å; T259-E262 PolarHBondContact OG1-N 2.86Å; T259-E262 PolarHBondContact OG1-OE1 2.95Å
260	V	94.8	Very high	96	Very high	60 Å²	60	61.5 Å²	61.5	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-71.8	-39.7	174.1	-177.4	0	0	0	0	110.5	E262 A263 E264 V346	V260-E262 VanDerWaalsContact C-N 3.31Å; V260-E262 PolarHBondContact O-N 2.93Å; V260-A263 WeakPolarHBondContact O-CA 3.2Å; V260-A263 WeakPolarHBondContact O-CB 3.4Å; V260-A263 PolarHBondContact O-N 3.28Å; V260-E264 HydrophobicContact CG1-CG 4.33Å; V260-E264 PolarHBondContact O-N 3.35Å; V260-V346 HydrophobicContact CG2-CG1 4.01Å; V260-V346 HydrophobicContact CG2-CG2 4.3Å
261	D	95.2	Very high	96.1	Very high	120 Å²	120	56.2 Å²	56.2	64%	0.642	30%	0.298	S	S	*	.	H	α-helix	trans	-60.2	-38.6	-179	-55.6	-19.1	0	0	0	112.1	E264 C265	D261-E264 PolarHBondContact O-N 3.35Å; D261-C265 VanDerWaalsContact O-CB 3.26Å; D261-C265 WeakPolarHBondContact O-CB 3.1Å; D261-C265 PolarHBondContact O-N 3.11Å
262	E	96	Very high	96.2	Very high	80 Å²	80	55.5 Å²	55.5	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-44.9	170.8	-77.2	155.8	-127.3	0	0	112.4	F257 A258 T259 V260 C265 F266	F257-E262 HydrophobicContact CD1-CB 3.98Å; A258-E262 PolarHBondContact N-OE2 2.87Å; T259-E262 WeakPolarHBondContact CB-OE1 3.41Å; T259-E262 WeakPolarHBondContact CG2-OE1 3.42Å; T259-E262 PolarHBondContact N-OE1 2.73Å; T259-E262 VanDerWaalsContact OG1-CG 3.26Å; T259-E262 WeakPolarHBondContact OG1-CG 3.5Å; T259-E262 PolarHBondContact OG1-N 2.86Å; T259-E262 PolarHBondContact OG1-OE1 2.95Å; V260-E262 VanDerWaalsContact C-N 3.31Å; V260-E262 PolarHBondContact O-N 2.93Å; E262-C265 PolarHBondContact O-N 3.47Å; E262-F266 WeakPolarHBondContact O-CB 3.49Å; E262-F266 PolarHBondContact O-N 3.44Å
263	A	95.5	Very high	96.2	Very high	1 Å²	1	56 Å²	56	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-68.4	-38.4	-179.5	0	0	0	0	0	111.6	F257 V260 L267 L339 V346	F257-A263 HydrophobicContact CB-CB 4.36Å; F257-A263 HydrophobicContact CD1-CB 4.28Å; F257-A263 HydrophobicContact CD2-CB 3.74Å; F257-A263 HydrophobicContact CE2-CB 4.02Å; F257-A263 HydrophobicContact CG-CB 3.88Å; F257-A263 HydrophobicContact CZ-CB 4.41Å; V260-A263 WeakPolarHBondContact O-CA 3.2Å; V260-A263 WeakPolarHBondContact O-CB 3.4Å; V260-A263 PolarHBondContact O-N 3.28Å; A263-L267 WeakPolarHBondContact O-CB 3.17Å; A263-L267 VanDerWaalsContact O-CG 3.23Å; A263-L267 WeakPolarHBondContact O-CG 3.34Å; A263-L267 PolarHBondContact O-N 3.22Å; A263-L339 HydrophobicContact CB-CD2 4.46Å; A263-V346 HydrophobicContact CB-CG1 4.3Å
264	E	96.2	Very high	96.3	Very high	49 Å²	49	50.5 Å²	50.5	23%	0.229	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-42.7	173.3	-68.8	-163.7	171.6	0	0	112.7	V260 D261 L267 T268 I336 H340	V260-E264 HydrophobicContact CG1-CG 4.33Å; V260-E264 PolarHBondContact O-N 3.35Å; D261-E264 PolarHBondContact O-N 3.35Å; E264-L267 PolarHBondContact O-N 3.02Å; E264-T268 WeakPolarHBondContact O-CB 3.26Å; E264-T268 PolarHBondContact O-N 2.93Å; E264-T268 PolarHBondContact O-OG1 3.33Å; E264-I336 HydrophobicContact CB-CD1 4.13Å; E264-I336 HydrophobicContact CB-CG1 4.37Å; E264-I336 HydrophobicContact CG-CD1 4.34Å; E264-I336 HydrophobicContact CG-CG1 4.22Å; E264-I336 HydrophobicContact CG-CG2 3.99Å; E264-I336 WeakPolarHBondContact OE1-CG2 3.41Å; E264-H340 IonicContact OE1-CE1 3.78Å; E264-H340 PolarHBondContact OE1-CE1 3.07Å; E264-H340 IonicContact OE1-ND1 3.93Å; E264-H340 IonicContact OE1-NE2 3.99Å; E264-H340 PolarHBondContact OE1-NE2 3.41Å
265	C	96.9	Very high	96.5	Very high	72 Å²	72	47.3 Å²	47.3	49%	0.486	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-47	174.9	-176.7	0	0	0	0	110.8	D261 E262 L267 T268 N269	D261-C265 VanDerWaalsContact O-CB 3.26Å; D261-C265 WeakPolarHBondContact O-CB 3.1Å; D261-C265 PolarHBondContact O-N 3.11Å; E262-C265 PolarHBondContact O-N 3.47Å; C265-L267 PolarHBondContact O-N 3.22Å; C265-T268 WeakPolarHBondContact O-CB 3.32Å; C265-T268 PolarHBondContact O-N 3.42Å; C265-N269 PolarHBondContact O-N 3.08Å; C265-N269 PolarHBondContact O-ND2 2.7Å
266	F	97	Very high	96.6	Very high	58 Å²	58	51.6 Å²	51.6	25%	0.254	27%	0.272	S	S	.	.	H	α-helix	trans	-60.4	-44.4	175.3	-175.1	-90.9	0	0	0	112.4	M251 I255 F257 E262 T268 N269 L270 V352	M251-F266 HydrophobicContact CB-CE1 4.38Å; M251-F266 HydrophobicContact CB-CZ 3.82Å; M251-F266 HydrophobicContact CG-CZ 4.05Å; I255-F266 HydrophobicContact CD1-CE1 3.91Å; I255-F266 HydrophobicContact CD1-CE2 4.06Å; I255-F266 HydrophobicContact CD1-CZ 3.6Å; F257-F266 HydrophobicContact CE1-CB 3.67Å; F257-F266 HydrophobicContact CE1-CD1 4.43Å; F257-F266 HydrophobicContact CE1-CD2 4.37Å; F257-F266 AromaticContact CE1-CG 3.91Å; F257-F266 HydrophobicContact CE1-CG 3.91Å; F257-F266 HydrophobicContact CZ-CB 3.77Å; F257-F266 AromaticContact CZ-CD1 3.77Å; F257-F266 HydrophobicContact CZ-CD1 3.77Å; F257-F266 HydrophobicContact CZ-CD2 4.4Å; F257-F266 AromaticContact CZ-CG 3.7Å; F257-F266 HydrophobicContact CZ-CG 3.7Å; E262-F266 WeakPolarHBondContact O-CB 3.49Å; E262-F266 PolarHBondContact O-N 3.44Å; F266-T268 VanDerWaalsContact C-N 3.31Å; F266-T268 PolarHBondContact O-N 2.86Å; F266-N269 PolarHBondContact O-N 2.94Å; F266-L270 HydrophobicContact CE1-CD2 4.18Å; F266-L270 WeakPolarHBondContact O-CB 3.45Å; F266-L270 PolarHBondContact O-N 3.5Å; F266-V352 HydrophobicContact CE1-CB 4.32Å
267	L	96.9	Very high	96.6	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-35.3	176.2	-79.7	173.7	0	0	0	113	A263 E264 C265 S271 L290 I335 L339 V352 I354	A263-L267 WeakPolarHBondContact O-CB 3.17Å; A263-L267 VanDerWaalsContact O-CG 3.23Å; A263-L267 WeakPolarHBondContact O-CG 3.34Å; A263-L267 PolarHBondContact O-N 3.22Å; E264-L267 PolarHBondContact O-N 3.02Å; C265-L267 PolarHBondContact O-N 3.22Å; L267-S271 WeakPolarHBondContact O-CB 3.47Å; L267-S271 PolarHBondContact O-N 3.03Å; L267-S271 PolarHBondContact O-OG 2.92Å; L267-L290 HydrophobicContact CD2-CD1 4.01Å; L267-I335 HydrophobicContact CB-CG2 4.26Å; L267-I335 HydrophobicContact CD1-CG2 3.98Å; L267-I335 HydrophobicContact CD2-CG2 3.6Å; L267-I335 HydrophobicContact CG-CG2 4.17Å; L267-L339 HydrophobicContact CD1-CB 4.28Å; L267-L339 HydrophobicContact CD1-CD2 3.74Å; L267-L339 HydrophobicContact CD1-CG 4.46Å; L267-V352 HydrophobicContact CD2-CG1 3.31Å; L267-V352 HydrophobicContact CG-CG1 4.3Å; L267-I354 HydrophobicContact CD2-CD1 4.31Å; L267-I354 HydrophobicContact CD2-CG1 4.5Å
268	T	97.8	Very high	96.7	Very high	51 Å²	51	51.9 Å²	51.9	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-49.1	174.6	-58.6	0	0	0	0	110.3	E264 C265 F266 L270 S271 M272 A332	E264-T268 WeakPolarHBondContact O-CB 3.26Å; E264-T268 PolarHBondContact O-N 2.93Å; E264-T268 PolarHBondContact O-OG1 3.33Å; C265-T268 WeakPolarHBondContact O-CB 3.32Å; C265-T268 PolarHBondContact O-N 3.42Å; F266-T268 VanDerWaalsContact C-N 3.31Å; F266-T268 PolarHBondContact O-N 2.86Å; T268-L270 PolarHBondContact O-N 3.24Å; T268-S271 WeakPolarHBondContact O-CA 3.46Å; T268-S271 WeakPolarHBondContact O-CB 3.41Å; T268-S271 PolarHBondContact O-N 3.43Å; T268-S271 VanDerWaalsContact O-N 3.09Å; T268-M272 WeakPolarHBondContact O-CG 3.1Å; T268-M272 PolarHBondContact O-N 3.35Å; T268-A332 HydrophobicContact CG2-CB 4.29Å
269	N	97.6	Very high	96.7	Very high	100 Å²	100	53.9 Å²	53.9	54%	0.535	27%	0.269	S	S	.	.	H	α-helix	trans	-61.4	-42	176.5	-67.6	-23.5	0	0	0	112.5	C265 F266 S271 M272 E273	C265-N269 PolarHBondContact O-N 3.08Å; C265-N269 PolarHBondContact O-ND2 2.7Å; F266-N269 PolarHBondContact O-N 2.94Å; N269-S271 VanDerWaalsContact C-N 3.28Å; N269-S271 PolarHBondContact O-N 3.2Å; N269-M272 PolarHBondContact O-N 3.14Å; N269-E273 PolarHBondContact O-N 2.8Å
270	L	97.4	Very high	96.6	Very high	18 Å²	18	55.7 Å²	55.7	9%	0.094	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-33.3	174.5	-170.4	63.8	0	0	0	112.2	A249 F266 T268 E273 V274 V352 I354	A249-L270 HydrophobicContact CB-CD1 3.57Å; A249-L270 HydrophobicContact CB-CG 4.35Å; F266-L270 HydrophobicContact CE1-CD2 4.18Å; F266-L270 WeakPolarHBondContact O-CB 3.45Å; F266-L270 PolarHBondContact O-N 3.5Å; T268-L270 PolarHBondContact O-N 3.24Å; L270-E273 PolarHBondContact O-N 2.88Å; L270-V274 WeakPolarHBondContact O-CG2 3.45Å; L270-V274 PolarHBondContact O-N 3.33Å; L270-V352 HydrophobicContact CD2-CG1 4.17Å; L270-I354 HydrophobicContact CB-CD1 4.07Å; L270-I354 HydrophobicContact CD2-CD1 4.02Å; L270-I354 HydrophobicContact CD2-CG1 3.95Å; L270-I354 HydrophobicContact CG-CD1 3.95Å; L270-I354 HydrophobicContact CG-CG1 4.27Å
271	S	98	Very high	96.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.6	-34.5	173.8	-56.8	0	0	0	0	112.4	L267 T268 N269 V274 Q275 G328 A332 I354	L267-S271 WeakPolarHBondContact O-CB 3.47Å; L267-S271 PolarHBondContact O-N 3.03Å; L267-S271 PolarHBondContact O-OG 2.92Å; T268-S271 WeakPolarHBondContact O-CA 3.46Å; T268-S271 WeakPolarHBondContact O-CB 3.41Å; T268-S271 PolarHBondContact O-N 3.43Å; T268-S271 VanDerWaalsContact O-N 3.09Å; N269-S271 VanDerWaalsContact C-N 3.28Å; N269-S271 PolarHBondContact O-N 3.2Å; S271-V274 PolarHBondContact O-N 3.36Å; S271-Q275 PolarHBondContact O-N 3.43Å; S271-G328 WeakPolarHBondContact CB-O 3.27Å; S271-A332 WeakPolarHBondContact OG-CA 3.3Å; S271-A332 PolarHBondContact OG-N 2.87Å; S271-I354 VanDerWaalsContact OG-CD1 3.24Å; S271-I354 WeakPolarHBondContact OG-CD1 3.27Å
272	M	97.9	Very high	96.5	Very high	75 Å²	75	50.4 Å²	50.4	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-68.5	-36.7	173.2	-64	-54.7	-66.3	0	0	112.1	T268 N269 Q275 R276	T268-M272 WeakPolarHBondContact O-CG 3.1Å; T268-M272 PolarHBondContact O-N 3.35Å; N269-M272 PolarHBondContact O-N 3.14Å; M272-Q275 WeakPolarHBondContact O-CB 3.43Å; M272-Q275 PolarHBondContact O-N 3.49Å; M272-R276 PolarHBondContact O-N 3.1Å
273	E	97.7	Very high	96.5	Very high	50 Å²	50	48.2 Å²	48.2	23%	0.234	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-39.1	171.1	169.3	59.9	-175	0	0	112	A249 N269 L270 R276 R277	A249-E273 HydrophobicContact CB-CG 3.96Å; N269-E273 PolarHBondContact O-N 2.8Å; L270-E273 PolarHBondContact O-N 2.88Å; E273-R276 VanDerWaalsContact CD-NH2 3.27Å; E273-R276 WeakPolarHBondContact O-CB 3.45Å; E273-R276 PolarHBondContact O-N 3.3Å; E273-R276 IonicContact OE1-CZ 2.75Å; E273-R276 IonicContact OE1-NE 3.18Å; E273-R276 IonicContact OE1-NH2 3.3Å; E273-R276 PolarHBondContact OE1-NH2 3.2Å; E273-R276 IonicContact OE2-CZ 2.65Å; E273-R276 VanDerWaalsContact OE2-CZ 3.3Å; E273-R276 IonicContact OE2-NE 2.69Å; E273-R276 PolarHBondContact OE2-NE 3.42Å; E273-R276 IonicContact OE2-NH2 3.23Å; E273-R276 PolarHBondContact OE2-NH2 3.36Å; E273-R277 WeakPolarHBondContact O-CG 3.33Å; E273-R277 PolarHBondContact O-N 3.3Å; E273-R277 VanDerWaalsContact O-N 3.08Å; E273-R277 IonicContact OE1-CZ 3.01Å; E273-R277 IonicContact OE1-NE 3.89Å; E273-R277 PolarHBondContact OE1-NE 3.41Å; E273-R277 IonicContact OE1-NH2 3.83Å; E273-R277 PolarHBondContact OE1-NH2 3.4Å
274	V	97.6	Very high	96.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.1	-41.9	171.6	169.9	0	0	0	0	111.6	A249 L270 S271 R276 R277 L278 I331 I354 V356	A249-V274 HydrophobicContact CB-CG2 3.73Å; L270-V274 WeakPolarHBondContact O-CG2 3.45Å; L270-V274 PolarHBondContact O-N 3.33Å; S271-V274 PolarHBondContact O-N 3.36Å; V274-R276 VanDerWaalsContact C-N 3.32Å; V274-R276 PolarHBondContact O-N 2.74Å; V274-R277 PolarHBondContact O-N 3.09Å; V274-L278 HydrophobicContact CG1-CD1 3.88Å; V274-L278 HydrophobicContact CG1-CG 4.36Å; V274-L278 WeakPolarHBondContact O-CB 3.27Å; V274-L278 WeakPolarHBondContact O-CG 3.45Å; V274-L278 PolarHBondContact O-N 2.84Å; V274-I331 HydrophobicContact CG1-CD1 4.23Å; V274-I354 HydrophobicContact CG2-CB 4.06Å; V274-I354 HydrophobicContact CG2-CG2 4.01Å; V274-V356 HydrophobicContact CG1-CG2 3.65Å
275	Q	97.3	Very high	96.5	Very high	35 Å²	35	50 Å²	50	16%	0.164	25%	0.251	C	S	.	.	H	α-helix	trans	-55.5	-46.6	171.4	158.1	176.2	-51.1	0	0	111.2	S271 M272 R277 L278 K279 D326	S271-Q275 PolarHBondContact O-N 3.43Å; M272-Q275 WeakPolarHBondContact O-CB 3.43Å; M272-Q275 PolarHBondContact O-N 3.49Å; Q275-R277 PolarHBondContact O-N 2.79Å; Q275-L278 PolarHBondContact O-N 2.97Å; Q275-K279 HydrophobicContact CG-CD 3.83Å; Q275-K279 HydrophobicContact CG-CG 4.42Å; Q275-K279 VanDerWaalsContact NE2-NZ 3.19Å; Q275-K279 WeakPolarHBondContact O-CB 3.37Å; Q275-K279 WeakPolarHBondContact O-CG 3.4Å; Q275-K279 PolarHBondContact O-N 3.39Å; Q275-D326 VanDerWaalsContact CB-O 3.3Å; Q275-D326 WeakPolarHBondContact CB-O 3.35Å; Q275-D326 VanDerWaalsContact CG-O 3.23Å; Q275-D326 WeakPolarHBondContact CG-O 3.43Å
276	R	97.6	Very high	96.4	Very high	94 Å²	94	51.4 Å²	51.4	36%	0.355	25%	0.246	S	C	.	.	H	α-helix	trans	-58	-49.7	179.6	-171.8	-172.9	64.1	77.9	5.2	110.7	M272 E273 V274 L278 K279 E280	M272-R276 PolarHBondContact O-N 3.1Å; E273-R276 VanDerWaalsContact CD-NH2 3.27Å; E273-R276 WeakPolarHBondContact O-CB 3.45Å; E273-R276 PolarHBondContact O-N 3.3Å; E273-R276 IonicContact OE1-CZ 2.75Å; E273-R276 IonicContact OE1-NE 3.18Å; E273-R276 IonicContact OE1-NH2 3.3Å; E273-R276 PolarHBondContact OE1-NH2 3.2Å; E273-R276 IonicContact OE2-CZ 2.65Å; E273-R276 VanDerWaalsContact OE2-CZ 3.3Å; E273-R276 IonicContact OE2-NE 2.69Å; E273-R276 PolarHBondContact OE2-NE 3.42Å; E273-R276 IonicContact OE2-NH2 3.23Å; E273-R276 PolarHBondContact OE2-NH2 3.36Å; V274-R276 VanDerWaalsContact C-N 3.32Å; V274-R276 PolarHBondContact O-N 2.74Å; R276-L278 VanDerWaalsContact C-N 3.35Å; R276-L278 PolarHBondContact O-N 2.83Å; R276-K279 PolarHBondContact O-N 3.21Å; R276-E280 IonicContact CZ-OE1 3.42Å; R276-E280 IonicContact CZ-OE2 3.76Å; R276-E280 IonicContact NH1-OE1 3.57Å; R276-E280 PolarHBondContact NH1-OE1 3.07Å; R276-E280 IonicContact NH1-OE2 2.81Å; R276-E280 PolarHBondContact NH1-OE2 3.14Å; R276-E280 WeakPolarHBondContact O-CB 3.4Å; R276-E280 WeakPolarHBondContact O-CG 3.33Å; R276-E280 PolarHBondContact O-N 2.76Å
277	R	97.1	Very high	96.5	Very high	97 Å²	97	52.3 Å²	52.3	37%	0.366	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-35.4	177.7	-66	176.4	-170.9	-148.9	-8.1	113.7	V247 S248 E273 V274 Q275 A281	V247-R277 HydrophobicContact CG1-CB 3.56Å; S248-R277 PolarHBondContact O-NH1 2.84Å; E273-R277 WeakPolarHBondContact O-CG 3.33Å; E273-R277 PolarHBondContact O-N 3.3Å; E273-R277 VanDerWaalsContact O-N 3.08Å; E273-R277 IonicContact OE1-CZ 3.01Å; E273-R277 IonicContact OE1-NE 3.89Å; E273-R277 PolarHBondContact OE1-NE 3.41Å; E273-R277 IonicContact OE1-NH2 3.83Å; E273-R277 PolarHBondContact OE1-NH2 3.4Å; V274-R277 PolarHBondContact O-N 3.09Å; Q275-R277 PolarHBondContact O-N 2.79Å; R277-A281 WeakPolarHBondContact O-CB 3.39Å; R277-A281 PolarHBondContact O-N 3.34Å
278	L	95.8	Very high	96.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-47.9	175.5	-80.1	170.4	0	0	0	111	V247 V274 Q275 R276 A281 G282 L283 D326 I331 V356 L359	V247-L278 HydrophobicContact CB-CD2 3.88Å; V247-L278 HydrophobicContact CB-CG 4.29Å; V247-L278 HydrophobicContact CG1-CD2 4.26Å; V247-L278 HydrophobicContact CG1-CG 4.12Å; V247-L278 HydrophobicContact CG2-CD2 3.95Å; V274-L278 HydrophobicContact CG1-CD1 3.88Å; V274-L278 HydrophobicContact CG1-CG 4.36Å; V274-L278 WeakPolarHBondContact O-CB 3.27Å; V274-L278 WeakPolarHBondContact O-CG 3.45Å; V274-L278 PolarHBondContact O-N 2.84Å; Q275-L278 PolarHBondContact O-N 2.97Å; R276-L278 VanDerWaalsContact C-N 3.35Å; R276-L278 PolarHBondContact O-N 2.83Å; L278-A281 CarbonylContact O-C 3.54Å; L278-A281 PolarHBondContact O-N 3.08Å; L278-G282 PolarHBondContact O-N 3.43Å; L278-G282 VanDerWaalsContact O-N 3.09Å; L278-L283 CarbonylContact C-O 3.5Å; L278-L283 WeakPolarHBondContact CB-O 3.38Å; L278-L283 HydrophobicContact CD2-CB 4.32Å; L278-L283 PolarHBondContact O-N 2.89Å; L278-D326 HydrophobicContact CB-CB 4.35Å; L278-I331 HydrophobicContact CD1-CD1 3.98Å; L278-V356 HydrophobicContact CD1-CG1 4.37Å; L278-V356 HydrophobicContact CD1-CG2 4.33Å; L278-V356 HydrophobicContact CD2-CG1 4.47Å; L278-L359 HydrophobicContact CD2-CD2 4.07Å
279	K	95.4	Very high	96.5	Very high	107 Å²	107	50.1 Å²	50.1	47%	0.465	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-44.3	177.8	-73.3	178.8	175	177.8	0	112.7	Q275 R276 A281 G282 D326	Q275-K279 HydrophobicContact CG-CD 3.83Å; Q275-K279 HydrophobicContact CG-CG 4.42Å; Q275-K279 VanDerWaalsContact NE2-NZ 3.19Å; Q275-K279 WeakPolarHBondContact O-CB 3.37Å; Q275-K279 WeakPolarHBondContact O-CG 3.4Å; Q275-K279 PolarHBondContact O-N 3.39Å; R276-K279 PolarHBondContact O-N 3.21Å; K279-A281 PolarHBondContact O-N 3.29Å; K279-G282 PolarHBondContact O-N 3.46Å; K279-D326 WeakPolarHBondContact CE-OD2 3.14Å; K279-D326 HydrophobicContact CG-CB 4.34Å; K279-D326 WeakPolarHBondContact CG-OD2 3.37Å; K279-D326 IonicContact NZ-OD2 3.92Å
280	E	94.2	Very high	96.5	Very high	98 Å²	98	45.4 Å²	45.4	46%	0.458	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-32	174.2	-75.4	173.3	173.2	0	0	112.6	R276 Q384	R276-E280 IonicContact CZ-OE1 3.42Å; R276-E280 IonicContact CZ-OE2 3.76Å; R276-E280 IonicContact NH1-OE1 3.57Å; R276-E280 PolarHBondContact NH1-OE1 3.07Å; R276-E280 IonicContact NH1-OE2 2.81Å; R276-E280 PolarHBondContact NH1-OE2 3.14Å; R276-E280 WeakPolarHBondContact O-CB 3.4Å; R276-E280 WeakPolarHBondContact O-CG 3.33Å; R276-E280 PolarHBondContact O-N 2.76Å; E280-Q384 PolarHBondContact OE1-NE2 3.12Å
281	A	92.4	Very high	96.6	Very high	33 Å²	33	48.1 Å²	48.1	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-82.2	-11.4	174.9	0	0	0	0	0	114	R277 L278 K279 L283	R277-A281 WeakPolarHBondContact O-CB 3.39Å; R277-A281 PolarHBondContact O-N 3.34Å; L278-A281 CarbonylContact O-C 3.54Å; L278-A281 PolarHBondContact O-N 3.08Å; K279-A281 PolarHBondContact O-N 3.29Å; A281-L283 VanDerWaalsContact C-N 3.27Å; A281-L283 HydrophobicContact CB-CB 4.27Å; A281-L283 HydrophobicContact CB-CD1 3.83Å; A281-L283 HydrophobicContact CB-CG 3.82Å; A281-L283 PolarHBondContact O-N 3.37Å
282	G	94.8	Very high	96.5	Very high	37 Å²	37	48.3 Å²	48.3	38%	0.381	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	24	-170.9	0	0	0	0	0	114	L278 K279 N362	L278-G282 PolarHBondContact O-N 3.43Å; L278-G282 VanDerWaalsContact O-N 3.09Å; K279-G282 PolarHBondContact O-N 3.46Å; G282-N362 PolarHBondContact O-N 2.85Å
283	L	95.4	Very high	96.5	Very high	33 Å²	33	46.5 Å²	46.5	17%	0.173	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.8	-172.5	-58.9	177.8	0	0	0	111.6	R244 L278 A281 L359	R244-L283 HydrophobicContact CB-CD1 4.22Å; R244-L283 HydrophobicContact CG-CD1 4.39Å; L278-L283 CarbonylContact C-O 3.5Å; L278-L283 WeakPolarHBondContact CB-O 3.38Å; L278-L283 HydrophobicContact CD2-CB 4.32Å; L278-L283 PolarHBondContact O-N 2.89Å; A281-L283 VanDerWaalsContact C-N 3.27Å; A281-L283 HydrophobicContact CB-CB 4.27Å; A281-L283 HydrophobicContact CB-CD1 3.83Å; A281-L283 HydrophobicContact CB-CG 3.82Å; A281-L283 PolarHBondContact O-N 3.37Å; L283-L359 HydrophobicContact CD1-CB 4.33Å; L283-L359 HydrophobicContact CD1-CD1 3.62Å
284	R	95.8	Very high	96.4	Very high	88 Å²	88	45.1 Å²	45.1	33%	0.332	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	159.7	166	-64.2	167.4	67	163.5	2.1	108.1	S324 D326 L359 E360 N362	R284-S324 PolarHBondContact NE-O 3.42Å; R284-S324 PolarHBondContact NH2-O 3Å; R284-D326 HydrophobicContact CG-CB 4.15Å; R284-L359 CarbonylContact O-C 3.57Å; R284-L359 VanDerWaalsContact O-CA 3.22Å; R284-L359 WeakPolarHBondContact O-CA 3.39Å; R284-E360 PolarHBondContact N-O 2.86Å; R284-E360 PolarHBondContact O-N 3.42Å; R284-N362 VanDerWaalsContact CD-OD1 3.26Å; R284-N362 WeakPolarHBondContact CD-OD1 3.31Å
285	G	95.6	Very high	96.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	149.9	177.1	0	0	0	0	0	114.5	T325 Q358	G285-T325 PolarHBondContact N-O 2.91Å; G285-T325 PolarHBondContact O-N 2.86Å; G285-Q358 WeakPolarHBondContact CA-O 3.3Å
286	R	96.1	Very high	96.3	Very high	101 Å²	101	50.5 Å²	50.5	38%	0.381	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-30.7	-172.6	-160.5	175.9	-179.8	-177.5	6.1	114.3	M320 L321 A322 Q357 Q358	R286-M320 HydrophobicContact CB-CE 4.39Å; R286-M320 HydrophobicContact CG-CE 3.84Å; R286-L321 VanDerWaalsContact CG-O 3.26Å; R286-L321 WeakPolarHBondContact CG-O 3.35Å; R286-L321 PolarHBondContact NE-O 3.18Å; R286-L321 VanDerWaalsContact NE-O 3.1Å; R286-L321 WeakPolarHBondContact O-CB 3.34Å; R286-L321 PolarHBondContact O-N 2.84Å; R286-A322 PolarHBondContact NE-O 3.12Å; R286-A322 PolarHBondContact NH2-O 3.31Å; R286-Q357 PolarHBondContact N-O 2.92Å; R286-Q358 HydrophobicContact CB-CB 4.28Å; R286-Q358 PolarHBondContact N-O 2.85Å; R286-Q358 VanDerWaalsContact N-O 3.16Å
287	R	97.7	Very high	96.1	Very high	78 Å²	78	52.9 Å²	52.9	29%	0.294	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.7	-175	-172.4	-167.4	-49.7	170.3	-7.6	110.3	T318 M320 V356 Q357 Q358	R287-T318 HydrophobicContact CG-CG2 3.41Å; R287-T318 VanDerWaalsContact CG-CG2 3.41Å; R287-M320 HydrophobicContact CB-SD 3.63Å; R287-M320 HydrophobicContact CG-SD 3.67Å; R287-V356 CarbonylContact O-C 3.36Å; R287-V356 VanDerWaalsContact O-CA 3.3Å; R287-V356 WeakPolarHBondContact O-CA 3.42Å; R287-Q357 HydrophobicContact CB-CB 4.2Å; R287-Q357 PolarHBondContact N-O 3.28Å; R287-Q357 PolarHBondContact O-N 3.44Å; R287-Q358 VanDerWaalsContact NH2-NE2 3.13Å
288	V	97.7	Very high	95.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.6	-177.3	-171.4	0	0	0	0	109.8	T318 V319 L321 I331 I335 I354 V356	V288-T318 CarbonylContact O-C 3.46Å; V288-T318 WeakPolarHBondContact O-CA 3.35Å; V288-V319 HydrophobicContact CB-CG1 4.21Å; V288-V319 PolarHBondContact N-O 2.96Å; V288-V319 PolarHBondContact O-N 2.85Å; V288-L321 HydrophobicContact CG2-CD1 3.68Å; V288-L321 HydrophobicContact CG2-CG 4.04Å; V288-I331 HydrophobicContact CG1-CG2 4.07Å; V288-I331 HydrophobicContact CG2-CG1 4.45Å; V288-I335 HydrophobicContact CG1-CD1 3.64Å; V288-I335 HydrophobicContact CG1-CG1 3.81Å; V288-I354 HydrophobicContact CG1-CG2 4.23Å; V288-V356 HydrophobicContact CG1-CG2 4.47Å; V288-V356 HydrophobicContact CG2-CG2 4.39Å
289	T	98.1	Very high	95.7	Very high	9 Å²	9	52.5 Å²	52.5	6%	0.055	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.8	-178.9	-57.9	0	0	0	0	110.5	K291 A316 K317 T318 I354 Q355	T289-K291 HydrophobicContact CG2-CG 4.18Å; T289-A316 HydrophobicContact CG2-CB 4.35Å; T289-K317 CarbonylContact C-O 3.58Å; T289-K317 WeakPolarHBondContact CA-O 3.48Å; T289-T318 WeakPolarHBondContact CG2-OG1 3.47Å; T289-T318 WeakPolarHBondContact OG1-CG2 3.26Å; T289-T318 PolarHBondContact OG1-OG1 3.41Å; T289-I354 WeakPolarHBondContact O-CA 3.39Å; T289-Q355 PolarHBondContact N-O 2.76Å; T289-Q355 PolarHBondContact O-N 3.34Å
290	L	97.9	Very high	95.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.7	164.3	178.6	55.6	0	0	0	108.6	L267 V292 A316 K317 I335 L338 L339 M342 V352	L267-L290 HydrophobicContact CD2-CD1 4.01Å; L290-V292 HydrophobicContact CD1-CG1 3.89Å; L290-V292 HydrophobicContact CD2-CG1 4.31Å; L290-V292 HydrophobicContact CG-CG1 3.99Å; L290-A316 CarbonylContact O-C 3.52Å; L290-A316 WeakPolarHBondContact O-CA 3.41Å; L290-K317 PolarHBondContact N-O 3.32Å; L290-K317 PolarHBondContact O-N 3.31Å; L290-I335 HydrophobicContact CB-CD1 3.64Å; L290-I335 HydrophobicContact CD1-CD1 4.44Å; L290-I335 HydrophobicContact CD1-CG2 4.07Å; L290-I335 HydrophobicContact CD2-CG2 4.39Å; L290-L338 HydrophobicContact CB-CB 4.33Å; L290-L338 HydrophobicContact CB-CD1 4.21Å; L290-L338 HydrophobicContact CD2-CB 4.17Å; L290-L339 HydrophobicContact CD2-CB 3.96Å; L290-L339 HydrophobicContact CD2-CD1 4.42Å; L290-M342 HydrophobicContact CB-CE 4.06Å; L290-M342 HydrophobicContact CD2-CE 3.75Å; L290-M342 HydrophobicContact CD2-SD 4.2Å; L290-M342 HydrophobicContact CG-CE 3.81Å; L290-V352 HydrophobicContact CD1-CG1 4.13Å
291	K	97.8	Very high	95.4	Very high	76 Å²	76	52 Å²	52	33%	0.33	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.1	165.7	-59.9	180	-170.9	167.8	0	108.6	T289 L315 A316 G353	T289-K291 HydrophobicContact CG2-CG 4.18Å; K291-L315 WeakPolarHBondContact CA-O 3.4Å; K291-A316 HydrophobicContact CG-CB 4.2Å; K291-G353 PolarHBondContact N-O 2.74Å; K291-G353 PolarHBondContact O-N 2.73Å
292	V	97	Very high	95.3	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.024	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	140.2	174	-64.6	0	0	0	0	110.5	L290 V294 L315 M342 L344 L349 G351 V352	L290-V292 HydrophobicContact CD1-CG1 3.89Å; L290-V292 HydrophobicContact CD2-CG1 4.31Å; L290-V292 HydrophobicContact CG-CG1 3.99Å; V292-V294 HydrophobicContact CG2-CG2 4.22Å; V292-L315 HydrophobicContact CG2-CB 3.89Å; V292-L315 PolarHBondContact N-O 2.87Å; V292-L315 PolarHBondContact O-N 3.39Å; V292-M342 HydrophobicContact CG2-CE 4.35Å; V292-M342 HydrophobicContact CG2-SD 3.65Å; V292-L344 HydrophobicContact CG2-CD1 3.59Å; V292-L349 HydrophobicContact CB-CD2 4.05Å; V292-L349 HydrophobicContact CG1-CD2 4.26Å; V292-G351 CarbonylContact C-O 3.56Å; V292-G351 WeakPolarHBondContact CA-O 3.19Å; V292-V352 HydrophobicContact CG1-CG2 4.44Å
293	M	97.3	Very high	95.2	Very high	37 Å²	37	55.2 Å²	55.2	18%	0.182	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	121.6	168.6	-54.3	-166.7	173.2	0	0	107.7	N252 H309 C312 N314 R350 G351	N252-M293 HydrophobicContact CB-CE 4.29Å; N252-M293 HydrophobicContact CB-SD 4.12Å; M293-H309 HydrophobicContact SD-CB 4.44Å; M293-C312 HydrophobicContact CB-CB 3.95Å; M293-N314 WeakPolarHBondContact CG-OD1 3.31Å; M293-R350 PolarHBondContact O-N 2.68Å; M293-G351 PolarHBondContact N-O 2.77Å; M293-G351 PolarHBondContact O-N 3.26Å
294	V	96.7	Very high	95	Very high	20 Å²	20	58.4 Å²	58.4	12%	0.121	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134.8	179.7	-171.7	0	0	0	0	108.4	V292 K296 C312 D313 L315 L344 D348 L349	V292-V294 HydrophobicContact CG2-CG2 4.22Å; V294-K296 PolarHBondContact O-N 3.33Å; V294-C312 CarbonylContact O-C 3.6Å; V294-C312 WeakPolarHBondContact O-CA 3.47Å; V294-C312 VanDerWaalsContact O-CB 3.27Å; V294-C312 WeakPolarHBondContact O-CB 3.38Å; V294-D313 PolarHBondContact N-O 3.01Å; V294-D313 PolarHBondContact O-N 3.28Å; V294-L315 HydrophobicContact CG2-CD1 3.87Å; V294-L315 HydrophobicContact CG2-CG 4.44Å; V294-L344 HydrophobicContact CG2-CD1 3.87Å; V294-L344 HydrophobicContact CG2-CD2 4.28Å; V294-D348 CarbonylContact C-O 3.49Å; V294-D348 WeakPolarHBondContact CA-O 3.42Å; V294-D348 HydrophobicContact CG1-CB 3.88Å; V294-L349 HydrophobicContact CG2-CD2 4.3Å
295	R	96.6	Very high	94.8	Very high	58 Å²	58	57.2 Å²	57.2	22%	0.219	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	128.2	174.6	-176.5	-178	61.5	120.3	-1.5	109.5	A299 P300 D348 R350	R295-A299 HydrophobicContact CG-CB 4.04Å; R295-A299 PolarHBondContact NH1-O 3.18Å; R295-P300 WeakPolarHBondContact CD-O 3.43Å; R295-D348 HydrophobicContact CB-CB 4.31Å; R295-D348 IonicContact CZ-OD1 3.8Å; R295-D348 PolarHBondContact N-O 3.33Å; R295-D348 IonicContact NE-OD1 3.33Å; R295-D348 PolarHBondContact NE-OD1 3.01Å; R295-D348 IonicContact NH2-OD1 2.73Å; R295-D348 PolarHBondContact NH2-OD1 2.66Å; R295-D348 IonicContact NH2-OD2 2.87Å; R295-R350 HydrophobicContact CB-CG 4.04Å
296	K	95.5	Very high	94.6	Very high	91 Å²	91	66.3 Å²	66.3	40%	0.396	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-67.2	138.3	178.2	-174.5	173.4	-159.1	93.3	0	110.3	V294 G298 A299 I311 D313	V294-K296 PolarHBondContact O-N 3.33Å; K296-G298 PolarHBondContact O-N 3.45Å; K296-A299 HydrophobicContact CB-CB 4.34Å; K296-A299 WeakPolarHBondContact O-CB 3.3Å; K296-A299 PolarHBondContact O-N 3.41Å; K296-I311 HydrophobicContact CB-CG2 4.07Å; K296-I311 WeakPolarHBondContact CB-O 3.36Å; K296-I311 HydrophobicContact CD-CG2 4.01Å; K296-I311 PolarHBondContact N-O 3.07Å; K296-D313 WeakPolarHBondContact CG-OD2 3.43Å; K296-D313 IonicContact NZ-OD1 2.72Å; K296-D313 PolarHBondContact NZ-OD1 3.36Å; K296-D313 IonicContact NZ-OD2 3.11Å
297	V	93.1	Very high	94.4	Very high	143 Å²	143	61.6 Å²	61.6	87%	0.867	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	127.3	176.4	-176.8	0	0	0	0	110.1
298	G	91.8	Very high	94.2	Very high	77 Å²	77	58.2 Å²	58.2	79%	0.794	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	-4.2	-175.8	0	0	0	0	0	115.5	K296	K296-G298 PolarHBondContact O-N 3.45Å
299	A	93.8	Very high	94	Very high	13 Å²	13	61.9 Å²	61.9	11%	0.107	34%	0.343	C	S	.	.	S	Bend	trans	-73.9	147.6	168.9	0	0	0	0	0	111.1	R295 K296 I311	R295-A299 HydrophobicContact CG-CB 4.04Å; R295-A299 PolarHBondContact NH1-O 3.18Å; K296-A299 HydrophobicContact CB-CB 4.34Å; K296-A299 WeakPolarHBondContact O-CB 3.3Å; K296-A299 PolarHBondContact O-N 3.41Å; A299-I311 HydrophobicContact CB-CB 4.01Å
300	P	92.9	Very high	93.8	Very high	91 Å²	91	62.9 Å²	62.9	59%	0.591	36%	0.355	S	S	*	.			trans	-50.6	141.9	172.8	-28	36.1	0	0	0	112.3	R295 E302	R295-P300 WeakPolarHBondContact CD-O 3.43Å; P300-E302 WeakPolarHBondContact CB-O 3.39Å
301	L	89.8	Confident	93.7	Very high	102 Å²	102	68.1 Å²	68.1	53%	0.534	38%	0.382	S	S	.	.	S	Bend	trans	-63	-48.4	178.4	-176.2	69.5	0	0	0	110.6	R350	L301-R350 PolarHBondContact O-NH2 3.17Å
302	E	91	Very high	93.7	Very high	114 Å²	114	65.7 Å²	65.7	53%	0.533	37%	0.374	S	S	.	.	S	Bend	trans	-96.8	127	170.3	-70.4	-47.6	130.5	0	0	111.7	R256 P300	R256-E302 IonicContact CZ-OE2 3.67Å; R256-E302 IonicContact NE-OE1 3.41Å; R256-E302 IonicContact NE-OE2 3.53Å; R256-E302 IonicContact NH2-OE1 3.41Å; R256-E302 IonicContact NH2-OE2 2.68Å; R256-E302 PolarHBondContact NH2-OE2 3.03Å; P300-E302 WeakPolarHBondContact CB-O 3.39Å
303	P	91.9	Very high	93.6	Very high	25 Å²	25	68.7 Å²	68.7	16%	0.162	39%	0.39	C	S	.	.			trans	-84.7	158.2	-179.3	31.9	-30	0	0	0	112.5	K305 G308	P303-K305 VanDerWaalsContact C-N 3.28Å; P303-K305 PolarHBondContact O-N 2.92Å; P303-G308 VanDerWaalsContact CG-O 3.31Å; P303-G308 WeakPolarHBondContact CG-O 3.38Å
304	A	90.6	Very high	93.6	Very high	99 Å²	99	72.6 Å²	72.6	82%	0.818	41%	0.412	S	S	*	.	S	Bend	trans	-60.7	-29.9	-177.7	0	0	0	0	0	114.8
305	K	92.1	Very high	93.5	Very high	64 Å²	64	75.3 Å²	75.3	28%	0.278	43%	0.425	S	S	.	.	S	Bend	trans	-90.8	115.6	168.6	-175.5	174.8	-175	177.7	0	107.6	M40 E42 F60 P303 G307 G308	M40-K305 HydrophobicContact CB-CB 4.28Å; M40-K305 HydrophobicContact CB-CG 4.19Å; M40-K305 WeakPolarHBondContact O-CE 3.5Å; E42-K305 IonicContact OE2-NZ 2.99Å; E42-K305 PolarHBondContact OE2-NZ 2.95Å; F60-K305 HydrophobicContact CE1-CD 4.26Å; P303-K305 VanDerWaalsContact C-N 3.28Å; P303-K305 PolarHBondContact O-N 2.92Å; K305-G307 PolarHBondContact O-N 2.68Å; K305-G308 WeakPolarHBondContact O-CA 3.44Å; K305-G308 PolarHBondContact O-N 3.37Å
306	Y	91.8	Very high	93.5	Very high	190 Å²	190	75.6 Å²	75.6	75%	0.745	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	138	173.6	-179.7	-100.5	0	0	0	110.9	Y253 G308	Y253-Y306 VanDerWaalsContact CE2-O 3.27Å; Y253-Y306 WeakPolarHBondContact CE2-O 3.25Å; Y253-Y306 PolarHBondContact OH-O 3.35Å; Y306-G308 PolarHBondContact O-N 3.3Å
307	G	90.8	Very high	93.6	Very high	2 Å²	2	75 Å²	75	2%	0.021	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	-4.6	-174.1	0	0	0	0	0	115.6	Y253 N254 K305	Y253-G307 VanDerWaalsContact CD2-O 3.29Å; Y253-G307 WeakPolarHBondContact CD2-O 3.31Å; Y253-G307 VanDerWaalsContact CE2-C 3.48Å; N254-G307 WeakPolarHBondContact CA-O 3.22Å; N254-G307 PolarHBondContact N-O 3.04Å; K305-G307 PolarHBondContact O-N 2.68Å
308	G	93.9	Very high	93.8	Very high	7 Å²	7	71.8 Å²	71.8	7%	0.072	42%	0.418	C	S	.	.			trans	-63.9	162.7	-178.3	0	0	0	0	0	113.8	R256 P303 K305 Y306	R256-G308 PolarHBondContact NH1-O 2.85Å; R256-G308 PolarHBondContact NH2-O 2.74Å; P303-G308 VanDerWaalsContact CG-O 3.31Å; P303-G308 WeakPolarHBondContact CG-O 3.38Å; K305-G308 WeakPolarHBondContact O-CA 3.44Å; K305-G308 PolarHBondContact O-N 3.37Å; Y306-G308 PolarHBondContact O-N 3.3Å
309	H	94.6	Very high	94.1	Very high	78 Å²	78	70.3 Å²	70.3	36%	0.361	39%	0.394	S	S	.	.			trans	-74.4	-34.9	168.9	61.2	79.3	0	0	0	111.9	N252 M293 C312 R350	N252-H309 PolarHBondContact O-CD2 3.39Å; M293-H309 HydrophobicContact SD-CB 4.44Å; H309-C312 PolarHBondContact O-SG 3.46Å; H309-R350 HydrophobicContact CB-CB 3.93Å; H309-R350 WeakPolarHBondContact CB-O 3.32Å; H309-R350 WeakPolarHBondContact O-CB 3.38Å; H309-R350 WeakPolarHBondContact O-CD 3.2Å; H309-R350 VanDerWaalsContact O-CG 3.32Å; H309-R350 WeakPolarHBondContact O-CG 3.13Å
310	G	94.1	Very high	94.2	Very high	29 Å²	29	74.2 Å²	74.2	30%	0.299	41%	0.411	S	S	.	.			trans	80.9	-152.5	-179.6	0	0	0	0	0	113.7	C312	G310-C312 PolarHBondContact O-N 3.01Å
311	I	95.6	Very high	94.3	Very high	110 Å²	110	71.4 Å²	71.4	56%	0.564	39%	0.391	S	S	*	.	S	Bend	trans	-82.9	108.4	178	-56.2	175	0	0	0	108.3	K296 A299	K296-I311 HydrophobicContact CB-CG2 4.07Å; K296-I311 WeakPolarHBondContact CB-O 3.36Å; K296-I311 HydrophobicContact CD-CG2 4.01Å; K296-I311 PolarHBondContact N-O 3.07Å; A299-I311 HydrophobicContact CB-CB 4.01Å
312	C	96	Very high	94.5	Very high	26 Å²	26	70.8 Å²	70.8	18%	0.176	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	153.5	-175.1	-59.6	0	0	0	0	112.6	M293 V294 H309 G310	M293-C312 HydrophobicContact CB-CB 3.95Å; V294-C312 CarbonylContact O-C 3.6Å; V294-C312 WeakPolarHBondContact O-CA 3.47Å; V294-C312 VanDerWaalsContact O-CB 3.27Å; V294-C312 WeakPolarHBondContact O-CB 3.38Å; H309-C312 PolarHBondContact O-SG 3.46Å; G310-C312 PolarHBondContact O-N 3.01Å
313	D	96.1	Very high	94.5	Very high	66 Å²	66	72.6 Å²	72.6	35%	0.353	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	135.4	159	-64.2	-50.8	0	0	0	108.7	V294 K296	V294-D313 PolarHBondContact N-O 3.01Å; V294-D313 PolarHBondContact O-N 3.28Å; K296-D313 WeakPolarHBondContact CG-OD2 3.43Å; K296-D313 IonicContact NZ-OD1 2.72Å; K296-D313 PolarHBondContact NZ-OD1 3.36Å; K296-D313 IonicContact NZ-OD2 3.11Å
314	N	96.3	Very high	94.7	Very high	119 Å²	119	71.9 Å²	71.9	64%	0.636	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.5	-177.6	-66	-37	0	0	0	110	M293	M293-N314 WeakPolarHBondContact CG-OD1 3.31Å
315	L	96	Very high	94.9	Very high	77 Å²	77	67.7 Å²	67.7	40%	0.403	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	146.9	177.4	-54.9	177.2	0	0	0	110.1	K291 V292 V294 L344	K291-L315 WeakPolarHBondContact CA-O 3.4Å; V292-L315 HydrophobicContact CG2-CB 3.89Å; V292-L315 PolarHBondContact N-O 2.87Å; V292-L315 PolarHBondContact O-N 3.39Å; V294-L315 HydrophobicContact CG2-CD1 3.87Å; V294-L315 HydrophobicContact CG2-CG 4.44Å; L315-L344 HydrophobicContact CD1-CD1 4.18Å; L315-L344 HydrophobicContact CD1-CD2 3.72Å
316	A	96.9	Very high	95	Very high	64 Å²	64	66.8 Å²	66.8	53%	0.529	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	145.5	173.6	0	0	0	0	0	111.2	T289 L290 K291	T289-A316 HydrophobicContact CG2-CB 4.35Å; L290-A316 CarbonylContact O-C 3.52Å; L290-A316 WeakPolarHBondContact O-CA 3.41Å; K291-A316 HydrophobicContact CG-CB 4.2Å
317	K	96.9	Very high	95.2	Very high	79 Å²	79	59.1 Å²	59.1	34%	0.343	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.3	165.5	-70.5	-173.3	-179.8	-172.2	0	109.6	T289 L290 L338 T341 M342	T289-K317 CarbonylContact C-O 3.58Å; T289-K317 WeakPolarHBondContact CA-O 3.48Å; L290-K317 PolarHBondContact N-O 3.32Å; L290-K317 PolarHBondContact O-N 3.31Å; K317-L338 HydrophobicContact CB-CD1 4.49Å; K317-L338 HydrophobicContact CB-CD2 3.99Å; K317-T341 PolarHBondContact NZ-O 3.18Å; K317-M342 HydrophobicContact CB-CE 3.65Å; K317-M342 HydrophobicContact CD-CE 4.21Å; K317-M342 HydrophobicContact CD-CG 3.67Å; K317-M342 HydrophobicContact CG-CE 3.73Å; K317-M342 HydrophobicContact CG-CG 4.17Å
318	T	97.7	Very high	95.4	Very high	75 Å²	75	59 Å²	59	46%	0.46	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.3	-175.4	-58.4	0	0	0	0	109.6	R287 V288 T289	R287-T318 HydrophobicContact CG-CG2 3.41Å; R287-T318 VanDerWaalsContact CG-CG2 3.41Å; V288-T318 CarbonylContact O-C 3.46Å; V288-T318 WeakPolarHBondContact O-CA 3.35Å; T289-T318 WeakPolarHBondContact CG2-OG1 3.47Å; T289-T318 WeakPolarHBondContact OG1-CG2 3.26Å; T289-T318 PolarHBondContact OG1-OG1 3.41Å
319	V	97.3	Very high	95.5	Very high	46 Å²	46	65.8 Å²	65.8	28%	0.279	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	144.7	172.5	66	0	0	0	0	109.8	V288 A334 L338	V288-V319 HydrophobicContact CB-CG1 4.21Å; V288-V319 PolarHBondContact N-O 2.96Å; V288-V319 PolarHBondContact O-N 2.85Å; V319-A334 HydrophobicContact CG1-CB 4.05Å; V319-L338 HydrophobicContact CB-CD1 4.15Å; V319-L338 HydrophobicContact CB-CD2 4.34Å; V319-L338 HydrophobicContact CB-CG 4.46Å; V319-L338 HydrophobicContact CG1-CD1 3.87Å; V319-L338 HydrophobicContact CG1-CG 4.4Å
320	M	96.8	Very high	95.6	Very high	95 Å²	95	66.7 Å²	66.7	47%	0.468	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	125.4	170.7	-75.8	-61.8	-59.7	0	0	108.8	R286 R287 Q358	R286-M320 HydrophobicContact CB-CE 4.39Å; R286-M320 HydrophobicContact CG-CE 3.84Å; R287-M320 HydrophobicContact CB-SD 3.63Å; R287-M320 HydrophobicContact CG-SD 3.67Å; M320-Q358 PolarHBondContact SD-OE1 3.27Å
321	L	95	Very high	95.7	Very high	32 Å²	32	65.3 Å²	65.3	17%	0.168	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	150.6	172.4	-58.5	180	0	0	0	110.3	R286 V288 Q323 T325 A334	R286-L321 VanDerWaalsContact CG-O 3.26Å; R286-L321 WeakPolarHBondContact CG-O 3.35Å; R286-L321 PolarHBondContact NE-O 3.18Å; R286-L321 VanDerWaalsContact NE-O 3.1Å; R286-L321 WeakPolarHBondContact O-CB 3.34Å; R286-L321 PolarHBondContact O-N 2.84Å; V288-L321 HydrophobicContact CG2-CD1 3.68Å; V288-L321 HydrophobicContact CG2-CG 4.04Å; L321-Q323 VanDerWaalsContact C-N 3.32Å; L321-Q323 PolarHBondContact O-N 3.35Å; L321-T325 HydrophobicContact CD1-CG2 3.5Å; L321-A334 HydrophobicContact CD2-CB 4.02Å
322	A	92.4	Very high	95.8	Very high	89 Å²	89	60.2 Å²	60.2	74%	0.736	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.1	-46.5	179	0	0	0	0	0	111.4	R286	R286-A322 PolarHBondContact NE-O 3.12Å; R286-A322 PolarHBondContact NH2-O 3.31Å
323	Q	92.3	Very high	95.9	Very high	152 Å²	152	61.5 Å²	61.5	71%	0.71	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.4	177.8	-60.5	179.5	5.6	0	0	110.6	L321	L321-Q323 VanDerWaalsContact C-N 3.32Å; L321-Q323 PolarHBondContact O-N 3.35Å
324	S	94.8	Very high	95.9	Very high	10 Å²	10	59 Å²	59	7%	0.07	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.7	175.1	-55.4	0	0	0	0	111.3	R284 E360	R284-S324 PolarHBondContact NE-O 3.42Å; R284-S324 PolarHBondContact NH2-O 3Å; S324-E360 WeakPolarHBondContact CB-OE2 3.41Å; S324-E360 PolarHBondContact OG-OE1 3.2Å; S324-E360 PolarHBondContact OG-OE2 3.28Å
325	T	94.9	Very high	95.9	Very high	12 Å²	12	53.3 Å²	53.3	7%	0.074	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.5	-174	-159.6	0	0	0	0	112.9	G285 L321 S327 L330 I331	G285-T325 PolarHBondContact N-O 2.91Å; G285-T325 PolarHBondContact O-N 2.86Å; L321-T325 HydrophobicContact CD1-CG2 3.5Å; T325-S327 WeakPolarHBondContact OG1-CB 3.18Å; T325-S327 PolarHBondContact OG1-N 2.78Å; T325-S327 VanDerWaalsContact OG1-N 3.09Å; T325-L330 HydrophobicContact CG2-CB 4.43Å; T325-I331 HydrophobicContact CG2-CD1 4.38Å; T325-I331 HydrophobicContact CG2-CG1 4.01Å
326	D	94.7	Very high	96	Very high	44 Å²	44	50.9 Å²	50.9	24%	0.235	29%	0.292	C	S	.	.			trans	-113.1	2.4	164.7	65.7	-41.1	0	0	0	111.6	Q275 L278 K279 R284 G328	Q275-D326 VanDerWaalsContact CB-O 3.3Å; Q275-D326 WeakPolarHBondContact CB-O 3.35Å; Q275-D326 VanDerWaalsContact CG-O 3.23Å; Q275-D326 WeakPolarHBondContact CG-O 3.43Å; L278-D326 HydrophobicContact CB-CB 4.35Å; K279-D326 WeakPolarHBondContact CE-OD2 3.14Å; K279-D326 HydrophobicContact CG-CB 4.34Å; K279-D326 WeakPolarHBondContact CG-OD2 3.37Å; K279-D326 IonicContact NZ-OD2 3.92Å; R284-D326 HydrophobicContact CG-CB 4.15Å; D326-G328 PolarHBondContact O-N 3.46Å
327	S	96.2	Very high	95.9	Very high	30 Å²	30	54.6 Å²	54.6	21%	0.21	30%	0.296	C	S	.	.			trans	-79.1	115.2	-177.9	179.2	0	0	0	0	112	T325 Q329 L330 I331	T325-S327 WeakPolarHBondContact OG1-CB 3.18Å; T325-S327 PolarHBondContact OG1-N 2.78Å; T325-S327 VanDerWaalsContact OG1-N 3.09Å; S327-Q329 VanDerWaalsContact C-N 3.25Å; S327-Q329 PolarHBondContact O-N 3.25Å; S327-L330 PolarHBondContact O-N 3.08Å; S327-I331 WeakPolarHBondContact O-CG1 3.47Å; S327-I331 PolarHBondContact O-N 3.45Å; S327-I331 VanDerWaalsContact O-N 3.1Å
328	G	95.5	Very high	95.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-29.9	178.5	0	0	0	0	0	113	S271 D326 A332	S271-G328 WeakPolarHBondContact CB-O 3.27Å; D326-G328 PolarHBondContact O-N 3.46Å; G328-A332 VanDerWaalsContact O-CB 3.24Å; G328-A332 WeakPolarHBondContact O-CB 3.17Å; G328-A332 PolarHBondContact O-N 3.36Å
329	Q	96.3	Very high	95.8	Very high	148 Å²	148	48.6 Å²	48.6	69%	0.692	27%	0.265	S	S	*	.	H	α-helix	trans	-67.9	-43.5	176	-68	177.8	-11.5	0	0	112	S327 A332 S333	S327-Q329 VanDerWaalsContact C-N 3.25Å; S327-Q329 PolarHBondContact O-N 3.25Å; Q329-A332 PolarHBondContact O-N 3.49Å; Q329-S333 WeakPolarHBondContact O-CB 3.36Å; Q329-S333 PolarHBondContact O-N 3.22Å
330	L	95.8	Very high	95.7	Very high	97 Å²	97	51.1 Å²	51.1	51%	0.508	27%	0.273	S	S	.	.	H	α-helix	trans	-65.7	-43.6	176.2	-68	178.8	0	0	0	110.8	T325 S327 S333 A334	T325-L330 HydrophobicContact CG2-CB 4.43Å; S327-L330 PolarHBondContact O-N 3.08Å; L330-S333 PolarHBondContact O-N 3.28Å; L330-S333 PolarHBondContact O-OG 3.2Å; L330-A334 PolarHBondContact O-N 2.79Å; L330-A334 VanDerWaalsContact O-N 3.11Å
331	I	96.9	Very high	95.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-49.2	174.5	-67.1	167.5	0	0	0	110.7	V274 L278 V288 T325 S327 S333 A334 I335 I354 V356	V274-I331 HydrophobicContact CG1-CD1 4.23Å; L278-I331 HydrophobicContact CD1-CD1 3.98Å; V288-I331 HydrophobicContact CG1-CG2 4.07Å; V288-I331 HydrophobicContact CG2-CG1 4.45Å; T325-I331 HydrophobicContact CG2-CD1 4.38Å; T325-I331 HydrophobicContact CG2-CG1 4.01Å; S327-I331 WeakPolarHBondContact O-CG1 3.47Å; S327-I331 PolarHBondContact O-N 3.45Å; S327-I331 VanDerWaalsContact O-N 3.1Å; I331-S333 PolarHBondContact O-N 3.37Å; I331-A334 PolarHBondContact O-N 2.85Å; I331-I335 HydrophobicContact CG2-CG1 4.22Å; I331-I335 WeakPolarHBondContact O-CB 3.42Å; I331-I335 VanDerWaalsContact O-CG1 3.24Å; I331-I335 WeakPolarHBondContact O-CG1 3.46Å; I331-I335 PolarHBondContact O-N 2.86Å; I331-I354 HydrophobicContact CG2-CG2 4Å; I331-V356 HydrophobicContact CD1-CG2 4.33Å
332	A	97.3	Very high	95.6	Very high	4 Å²	4	50.3 Å²	50.3	3%	0.033	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-49.1	178	0	0	0	0	0	111.7	T268 S271 G328 Q329 A334 I335 I336	T268-A332 HydrophobicContact CG2-CB 4.29Å; S271-A332 WeakPolarHBondContact OG-CA 3.3Å; S271-A332 PolarHBondContact OG-N 2.87Å; G328-A332 VanDerWaalsContact O-CB 3.24Å; G328-A332 WeakPolarHBondContact O-CB 3.17Å; G328-A332 PolarHBondContact O-N 3.36Å; Q329-A332 PolarHBondContact O-N 3.49Å; A332-A334 PolarHBondContact O-N 2.81Å; A332-I335 PolarHBondContact O-N 3.33Å; A332-I335 VanDerWaalsContact O-N 3.15Å; A332-I336 WeakPolarHBondContact O-CB 3.16Å; A332-I336 WeakPolarHBondContact O-CG1 3.42Å; A332-I336 PolarHBondContact O-N 2.88Å
333	S	97.1	Very high	95.5	Very high	52 Å²	52	55.3 Å²	55.3	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-59.5	-35.1	179.9	80	0	0	0	0	112.9	Q329 L330 I331 K337	Q329-S333 WeakPolarHBondContact O-CB 3.36Å; Q329-S333 PolarHBondContact O-N 3.22Å; L330-S333 PolarHBondContact O-N 3.28Å; L330-S333 PolarHBondContact O-OG 3.2Å; I331-S333 PolarHBondContact O-N 3.37Å; S333-K337 VanDerWaalsContact O-CD 3.32Å; S333-K337 WeakPolarHBondContact O-CD 3.43Å; S333-K337 WeakPolarHBondContact O-CG 3.37Å; S333-K337 PolarHBondContact O-N 2.67Å
334	A	96.9	Very high	95.5	Very high	13 Å²	13	50.3 Å²	50.3	11%	0.107	26%	0.257	C	S	.	.	H	α-helix	trans	-75.4	-40.8	177.3	0	0	0	0	0	111.8	V319 L321 L330 I331 A332 L338	V319-A334 HydrophobicContact CG1-CB 4.05Å; L321-A334 HydrophobicContact CD2-CB 4.02Å; L330-A334 PolarHBondContact O-N 2.79Å; L330-A334 VanDerWaalsContact O-N 3.11Å; I331-A334 PolarHBondContact O-N 2.85Å; A332-A334 PolarHBondContact O-N 2.81Å; A334-L338 WeakPolarHBondContact O-CG 3.34Å; A334-L338 PolarHBondContact O-N 3.45Å
335	I	96.9	Very high	95.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-41.7	179	-74.3	-71.8	0	0	0	112.2	L267 V288 L290 I331 A332 L338 L339 I354	L267-I335 HydrophobicContact CB-CG2 4.26Å; L267-I335 HydrophobicContact CD1-CG2 3.98Å; L267-I335 HydrophobicContact CD2-CG2 3.6Å; L267-I335 HydrophobicContact CG-CG2 4.17Å; V288-I335 HydrophobicContact CG1-CD1 3.64Å; V288-I335 HydrophobicContact CG1-CG1 3.81Å; L290-I335 HydrophobicContact CB-CD1 3.64Å; L290-I335 HydrophobicContact CD1-CD1 4.44Å; L290-I335 HydrophobicContact CD1-CG2 4.07Å; L290-I335 HydrophobicContact CD2-CG2 4.39Å; I331-I335 HydrophobicContact CG2-CG1 4.22Å; I331-I335 WeakPolarHBondContact O-CB 3.42Å; I331-I335 VanDerWaalsContact O-CG1 3.24Å; I331-I335 WeakPolarHBondContact O-CG1 3.46Å; I331-I335 PolarHBondContact O-N 2.86Å; A332-I335 PolarHBondContact O-N 3.33Å; A332-I335 VanDerWaalsContact O-N 3.15Å; I335-L338 WeakPolarHBondContact O-CB 3.49Å; I335-L338 PolarHBondContact O-N 2.91Å; I335-L338 VanDerWaalsContact O-N 3.14Å; I335-L339 PolarHBondContact O-N 3.32Å; I335-I354 HydrophobicContact CD1-CG1 4.03Å; I335-I354 HydrophobicContact CD1-CG2 4.11Å; I335-I354 HydrophobicContact CG1-CD1 4.16Å; I335-I354 HydrophobicContact CG1-CG1 4.2Å; I335-I354 HydrophobicContact CG1-CG2 4.27Å; I335-I354 HydrophobicContact CG2-CD1 4.13Å; I335-I354 HydrophobicContact CG2-CG1 4.32Å
336	I	96.4	Very high	95.2	Very high	27 Å²	27	56.7 Å²	56.7	14%	0.138	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-43.7	176.1	-69.3	166.3	0	0	0	110.6	E264 A332 L338 L339 H340	E264-I336 HydrophobicContact CB-CD1 4.13Å; E264-I336 HydrophobicContact CB-CG1 4.37Å; E264-I336 HydrophobicContact CG-CD1 4.34Å; E264-I336 HydrophobicContact CG-CG1 4.22Å; E264-I336 HydrophobicContact CG-CG2 3.99Å; E264-I336 WeakPolarHBondContact OE1-CG2 3.41Å; A332-I336 WeakPolarHBondContact O-CB 3.16Å; A332-I336 WeakPolarHBondContact O-CG1 3.42Å; A332-I336 PolarHBondContact O-N 2.88Å; I336-L338 VanDerWaalsContact C-N 3.28Å; I336-L338 PolarHBondContact O-N 3.01Å; I336-L339 WeakPolarHBondContact O-CB 3.35Å; I336-L339 PolarHBondContact O-N 2.92Å; I336-L339 VanDerWaalsContact O-N 3.14Å; I336-H340 PolarHBondContact O-N 3.05Å
337	K	96.4	Very high	95.2	Very high	142 Å²	142	60.5 Å²	60.5	62%	0.617	30%	0.302	S	S	*	.	H	α-helix	trans	-57.1	-40.9	171.6	-72.7	169.4	-174.2	174.9	0	111.9	S333 T341	S333-K337 VanDerWaalsContact O-CD 3.32Å; S333-K337 WeakPolarHBondContact O-CD 3.43Å; S333-K337 WeakPolarHBondContact O-CG 3.37Å; S333-K337 PolarHBondContact O-N 2.67Å; K337-T341 WeakPolarHBondContact O-CB 3.49Å; K337-T341 PolarHBondContact O-N 2.87Å; K337-T341 PolarHBondContact O-OG1 3.41Å
338	L	96.4	Very high	95.1	Very high	19 Å²	19	60.4 Å²	60.4	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-64.7	-42.8	175.2	-73.2	179.5	0	0	0	112.3	L290 K317 V319 A334 I335 I336 T341 M342	L290-L338 HydrophobicContact CB-CB 4.33Å; L290-L338 HydrophobicContact CB-CD1 4.21Å; L290-L338 HydrophobicContact CD2-CB 4.17Å; K317-L338 HydrophobicContact CB-CD1 4.49Å; K317-L338 HydrophobicContact CB-CD2 3.99Å; V319-L338 HydrophobicContact CB-CD1 4.15Å; V319-L338 HydrophobicContact CB-CD2 4.34Å; V319-L338 HydrophobicContact CB-CG 4.46Å; V319-L338 HydrophobicContact CG1-CD1 3.87Å; V319-L338 HydrophobicContact CG1-CG 4.4Å; A334-L338 WeakPolarHBondContact O-CG 3.34Å; A334-L338 PolarHBondContact O-N 3.45Å; I335-L338 WeakPolarHBondContact O-CB 3.49Å; I335-L338 PolarHBondContact O-N 2.91Å; I335-L338 VanDerWaalsContact O-N 3.14Å; I336-L338 VanDerWaalsContact C-N 3.28Å; I336-L338 PolarHBondContact O-N 3.01Å; L338-T341 CarbonylContact O-C 3.57Å; L338-T341 WeakPolarHBondContact O-CB 3.45Å; L338-T341 PolarHBondContact O-N 2.73Å; L338-M342 WeakPolarHBondContact O-CG 3.36Å; L338-M342 PolarHBondContact O-N 2.86Å
339	L	95.6	Very high	95.1	Very high	9 Å²	9	60.5 Å²	60.5	5%	0.047	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-51.6	176.6	-179.3	69.6	0	0	0	111.1	A263 L267 L290 I335 I336 T341 M342 K343 L349	A263-L339 HydrophobicContact CB-CD2 4.46Å; L267-L339 HydrophobicContact CD1-CB 4.28Å; L267-L339 HydrophobicContact CD1-CD2 3.74Å; L267-L339 HydrophobicContact CD1-CG 4.46Å; L290-L339 HydrophobicContact CD2-CB 3.96Å; L290-L339 HydrophobicContact CD2-CD1 4.42Å; I335-L339 PolarHBondContact O-N 3.32Å; I336-L339 WeakPolarHBondContact O-CB 3.35Å; I336-L339 PolarHBondContact O-N 2.92Å; I336-L339 VanDerWaalsContact O-N 3.14Å; L339-T341 VanDerWaalsContact C-N 3.26Å; L339-T341 PolarHBondContact O-N 3.46Å; L339-M342 WeakPolarHBondContact O-CA 3.43Å; L339-M342 WeakPolarHBondContact O-CB 3.4Å; L339-M342 PolarHBondContact O-N 2.91Å; L339-K343 PolarHBondContact O-N 3.32Å; L339-L349 HydrophobicContact CD1-CD1 4.46Å
340	H	95.2	Very high	95.1	Very high	99 Å²	99	53.6 Å²	53.6	46%	0.458	27%	0.267	S	S	.	.	H	α-helix	trans	-59	-37.8	176	-71.9	157	0	0	0	112.8	E264 I336 M342 K343	E264-H340 IonicContact OE1-CE1 3.78Å; E264-H340 PolarHBondContact OE1-CE1 3.07Å; E264-H340 IonicContact OE1-ND1 3.93Å; E264-H340 IonicContact OE1-NE2 3.99Å; E264-H340 PolarHBondContact OE1-NE2 3.41Å; I336-H340 PolarHBondContact O-N 3.05Å; H340-M342 PolarHBondContact O-N 2.88Å; H340-K343 PolarHBondContact O-N 3.44Å
341	T	95.8	Very high	95.2	Very high	87 Å²	87	49 Å²	49	53%	0.534	24%	0.243	S	C	.	.	H	α-helix	trans	-68.4	-18.4	175.1	-50.6	0	0	0	0	112.5	K317 K337 L338 L339	K317-T341 PolarHBondContact NZ-O 3.18Å; K337-T341 WeakPolarHBondContact O-CB 3.49Å; K337-T341 PolarHBondContact O-N 2.87Å; K337-T341 PolarHBondContact O-OG1 3.41Å; L338-T341 CarbonylContact O-C 3.57Å; L338-T341 WeakPolarHBondContact O-CB 3.45Å; L338-T341 PolarHBondContact O-N 2.73Å; L339-T341 VanDerWaalsContact C-N 3.26Å; L339-T341 PolarHBondContact O-N 3.46Å
342	M	93.1	Very high	95.2	Very high	23 Å²	23	49.1 Å²	49.1	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-80.8	-20.5	173	-63.1	179.9	-177.2	0	0	113.4	L290 V292 K317 L338 L339 H340 L344	L290-M342 HydrophobicContact CB-CE 4.06Å; L290-M342 HydrophobicContact CD2-CE 3.75Å; L290-M342 HydrophobicContact CD2-SD 4.2Å; L290-M342 HydrophobicContact CG-CE 3.81Å; V292-M342 HydrophobicContact CG2-CE 4.35Å; V292-M342 HydrophobicContact CG2-SD 3.65Å; K317-M342 HydrophobicContact CB-CE 3.65Å; K317-M342 HydrophobicContact CD-CE 4.21Å; K317-M342 HydrophobicContact CD-CG 3.67Å; K317-M342 HydrophobicContact CG-CE 3.73Å; K317-M342 HydrophobicContact CG-CG 4.17Å; L338-M342 WeakPolarHBondContact O-CG 3.36Å; L338-M342 PolarHBondContact O-N 2.86Å; L339-M342 WeakPolarHBondContact O-CA 3.43Å; L339-M342 WeakPolarHBondContact O-CB 3.4Å; L339-M342 PolarHBondContact O-N 2.91Å; H340-M342 PolarHBondContact O-N 2.88Å; M342-L344 VanDerWaalsContact C-N 3.34Å; M342-L344 HydrophobicContact CB-CD1 3.77Å; M342-L344 HydrophobicContact CB-CD2 4.37Å; M342-L344 HydrophobicContact CB-CG 3.65Å; M342-L344 HydrophobicContact CG-CD1 4.42Å; M342-L344 PolarHBondContact O-N 3.44Å; M342-L344 HydrophobicContact SD-CD1 3.78Å
343	K	92	Very high	95.2	Very high	193 Å²	193	49.1 Å²	49.1	84%	0.839	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	46.7	-179.2	-59.6	-172.9	177.4	-173.9	0	113.7	L339 H340	L339-K343 PolarHBondContact O-N 3.32Å; H340-K343 PolarHBondContact O-N 3.44Å
344	L	91.5	Very high	95.3	Very high	48 Å²	48	46.7 Å²	46.7	25%	0.251	23%	0.227	S	C	.	.			trans	-92	152.5	-178.1	-57.7	174.6	0	0	0	111.7	V292 V294 L315 M342 L349	V292-L344 HydrophobicContact CG2-CD1 3.59Å; V294-L344 HydrophobicContact CG2-CD1 3.87Å; V294-L344 HydrophobicContact CG2-CD2 4.28Å; L315-L344 HydrophobicContact CD1-CD1 4.18Å; L315-L344 HydrophobicContact CD1-CD2 3.72Å; M342-L344 VanDerWaalsContact C-N 3.34Å; M342-L344 HydrophobicContact CB-CD1 3.77Å; M342-L344 HydrophobicContact CB-CD2 4.37Å; M342-L344 HydrophobicContact CB-CG 3.65Å; M342-L344 HydrophobicContact CG-CD1 4.42Å; M342-L344 PolarHBondContact O-N 3.44Å; M342-L344 HydrophobicContact SD-CD1 3.78Å; L344-L349 HydrophobicContact CD1-CD2 4.22Å
345	Q	91.1	Very high	95.3	Very high	136 Å²	136	47.4 Å²	47.4	64%	0.636	23%	0.228	S	C	*	.			trans	-79	119.7	167.9	-61.2	-172.3	19.9	0	0	109.1	Q347 D348	Q345-Q347 PolarHBondContact O-N 3Å; Q345-D348 PolarHBondContact O-N 3.43Å; Q345-D348 VanDerWaalsContact O-N 3.09Å
346	V	92.8	Very high	95.3	Very high	19 Å²	19	47.4 Å²	47.4	12%	0.115	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-63.6	-29.8	-175.8	-65.6	0	0	0	0	113.3	F257 V260 A263 D348 L349	F257-V346 HydrophobicContact CB-CB 4.33Å; V260-V346 HydrophobicContact CG2-CG1 4.01Å; V260-V346 HydrophobicContact CG2-CG2 4.3Å; A263-V346 HydrophobicContact CB-CG1 4.3Å; V346-D348 PolarHBondContact O-N 2.99Å; V346-L349 HydrophobicContact CB-CD1 4.26Å; V346-L349 HydrophobicContact CG1-CD1 4.21Å; V346-L349 VanDerWaalsContact O-CB 3.31Å; V346-L349 WeakPolarHBondContact O-CB 3.4Å; V346-L349 PolarHBondContact O-N 2.84Å; V346-L349 VanDerWaalsContact O-N 3.07Å
347	Q	93.4	Very high	95.4	Very high	125 Å²	125	48.4 Å²	48.4	58%	0.584	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-65.2	-24.1	175.5	-61.9	176.1	10.6	0	0	113.6	F257 Q345 R350	F257-Q347 WeakPolarHBondContact O-CA 3.45Å; Q345-Q347 PolarHBondContact O-N 3Å; Q347-R350 PolarHBondContact O-NH1 2.8Å
348	D	95.1	Very high	95.3	Very high	28 Å²	28	45.5 Å²	45.5	15%	0.15	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-92.2	-2.4	175.2	-83.3	-32.5	0	0	0	112.9	V294 R295 Q345 V346	V294-D348 CarbonylContact C-O 3.49Å; V294-D348 WeakPolarHBondContact CA-O 3.42Å; V294-D348 HydrophobicContact CG1-CB 3.88Å; R295-D348 HydrophobicContact CB-CB 4.31Å; R295-D348 IonicContact CZ-OD1 3.8Å; R295-D348 PolarHBondContact N-O 3.33Å; R295-D348 IonicContact NE-OD1 3.33Å; R295-D348 PolarHBondContact NE-OD1 3.01Å; R295-D348 IonicContact NH2-OD1 2.73Å; R295-D348 PolarHBondContact NH2-OD1 2.66Å; R295-D348 IonicContact NH2-OD2 2.87Å; Q345-D348 PolarHBondContact O-N 3.43Å; Q345-D348 VanDerWaalsContact O-N 3.09Å; V346-D348 PolarHBondContact O-N 2.99Å
349	L	95.5	Very high	95.2	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	138.2	170.8	-64.9	173.1	0	0	0	110.2	I255 F257 V292 V294 L339 L344 V346	I255-L349 HydrophobicContact CG2-CB 4.42Å; F257-L349 HydrophobicContact CD2-CB 4.07Å; F257-L349 HydrophobicContact CD2-CD1 3.86Å; F257-L349 HydrophobicContact CE2-CB 4.4Å; F257-L349 HydrophobicContact CE2-CD1 4.17Å; V292-L349 HydrophobicContact CB-CD2 4.05Å; V292-L349 HydrophobicContact CG1-CD2 4.26Å; V294-L349 HydrophobicContact CG2-CD2 4.3Å; L339-L349 HydrophobicContact CD1-CD1 4.46Å; L344-L349 HydrophobicContact CD1-CD2 4.22Å; V346-L349 HydrophobicContact CB-CD1 4.26Å; V346-L349 HydrophobicContact CG1-CD1 4.21Å; V346-L349 VanDerWaalsContact O-CB 3.31Å; V346-L349 WeakPolarHBondContact O-CB 3.4Å; V346-L349 PolarHBondContact O-N 2.84Å; V346-L349 VanDerWaalsContact O-N 3.07Å
350	R	96.6	Very high	95.1	Very high	3 Å²	3	50.5 Å²	50.5	1%	0.011	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	-10.4	-175.3	-71.3	-64.2	-179.5	-80.4	5.6	113.5	R256 M293 R295 L301 H309 Q347	R256-R350 VanDerWaalsContact NH1-CD 3.27Å; M293-R350 PolarHBondContact O-N 2.68Å; R295-R350 HydrophobicContact CB-CG 4.04Å; L301-R350 PolarHBondContact O-NH2 3.17Å; H309-R350 HydrophobicContact CB-CB 3.93Å; H309-R350 WeakPolarHBondContact CB-O 3.32Å; H309-R350 WeakPolarHBondContact O-CB 3.38Å; H309-R350 WeakPolarHBondContact O-CD 3.2Å; H309-R350 VanDerWaalsContact O-CG 3.32Å; H309-R350 WeakPolarHBondContact O-CG 3.13Å; Q347-R350 PolarHBondContact O-NH1 2.8Å
351	G	96.8	Very high	94.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	146.2	175.4	0	0	0	0	0	110.5	M251 N252 V292 M293	M251-G351 CarbonylContact O-C 3.57Å; M251-G351 VanDerWaalsContact O-CA 3.31Å; M251-G351 WeakPolarHBondContact O-CA 3.24Å; N252-G351 WeakPolarHBondContact OD1-CA 3.08Å; V292-G351 CarbonylContact C-O 3.56Å; V292-G351 WeakPolarHBondContact CA-O 3.19Å; M293-G351 PolarHBondContact N-O 2.77Å; M293-G351 PolarHBondContact O-N 3.26Å
352	V	97.2	Very high	93.1	Very high	3 Å²	3	49 Å²	49	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	132.7	-175.8	-178.4	0	0	0	0	109.3	E250 M251 I255 F257 F266 L267 L270 L290 V292	E250-V352 WeakPolarHBondContact CA-O 3.37Å; M251-V352 PolarHBondContact N-O 3.36Å; M251-V352 PolarHBondContact O-N 3.03Å; I255-V352 HydrophobicContact CG2-CG2 4.35Å; F257-V352 HydrophobicContact CE2-CG2 4.15Å; F266-V352 HydrophobicContact CE1-CB 4.32Å; L267-V352 HydrophobicContact CD2-CG1 3.31Å; L267-V352 HydrophobicContact CG-CG1 4.3Å; L270-V352 HydrophobicContact CD2-CG1 4.17Å; L290-V352 HydrophobicContact CD1-CG1 4.13Å; V292-V352 HydrophobicContact CG1-CG2 4.44Å
353	G	97.6	Very high	90.8	Very high	3 Å²	3	56 Å²	56	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	140.8	179	0	0	0	0	0	113.4	A249 K291	A249-G353 WeakPolarHBondContact O-CA 3.48Å; K291-G353 PolarHBondContact N-O 2.74Å; K291-G353 PolarHBondContact O-N 2.73Å
354	I	98.1	Very high	88.5	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.7	175.6	-61.2	173.9	0	0	0	107.5	S248 A249 L267 L270 S271 V274 V288 T289 I331 I335	S248-I354 WeakPolarHBondContact CA-O 3.23Å; S248-I354 WeakPolarHBondContact CB-O 3.38Å; A249-I354 PolarHBondContact N-O 3.01Å; A249-I354 PolarHBondContact O-N 2.75Å; L267-I354 HydrophobicContact CD2-CD1 4.31Å; L267-I354 HydrophobicContact CD2-CG1 4.5Å; L270-I354 HydrophobicContact CB-CD1 4.07Å; L270-I354 HydrophobicContact CD2-CD1 4.02Å; L270-I354 HydrophobicContact CD2-CG1 3.95Å; L270-I354 HydrophobicContact CG-CD1 3.95Å; L270-I354 HydrophobicContact CG-CG1 4.27Å; S271-I354 VanDerWaalsContact OG-CD1 3.24Å; S271-I354 WeakPolarHBondContact OG-CD1 3.27Å; V274-I354 HydrophobicContact CG2-CB 4.06Å; V274-I354 HydrophobicContact CG2-CG2 4.01Å; V288-I354 HydrophobicContact CG1-CG2 4.23Å; T289-I354 WeakPolarHBondContact O-CA 3.39Å; I331-I354 HydrophobicContact CG2-CG2 4Å; I335-I354 HydrophobicContact CD1-CG1 4.03Å; I335-I354 HydrophobicContact CD1-CG2 4.11Å; I335-I354 HydrophobicContact CG1-CD1 4.16Å; I335-I354 HydrophobicContact CG1-CG1 4.2Å; I335-I354 HydrophobicContact CG1-CG2 4.27Å; I335-I354 HydrophobicContact CG2-CD1 4.13Å; I335-I354 HydrophobicContact CG2-CG1 4.32Å
355	Q	97.9	Very high	85.8	Confident	29 Å²	29	59.1 Å²	59.1	14%	0.136	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.2	175.2	-178.8	176.5	13.3	0	0	110.8	S246 T289 Q357	S246-Q355 PolarHBondContact OG-NE2 3.08Å; T289-Q355 PolarHBondContact N-O 2.76Å; T289-Q355 PolarHBondContact O-N 3.34Å; Q355-Q357 HydrophobicContact CG-CG 4.02Å; Q355-Q357 VanDerWaalsContact NE2-NE2 3.17Å
356	V	97.4	Very high	83.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.9	174.9	-176.2	0	0	0	0	109.3	S246 V247 V274 L278 R287 V288 I331 L359	S246-V356 CarbonylContact C-O 3.53Å; S246-V356 WeakPolarHBondContact CA-O 3.18Å; S246-V356 WeakPolarHBondContact CB-O 3.41Å; V247-V356 PolarHBondContact N-O 3.47Å; V247-V356 PolarHBondContact O-N 3.47Å; V274-V356 HydrophobicContact CG1-CG2 3.65Å; L278-V356 HydrophobicContact CD1-CG1 4.37Å; L278-V356 HydrophobicContact CD1-CG2 4.33Å; L278-V356 HydrophobicContact CD2-CG1 4.47Å; R287-V356 CarbonylContact O-C 3.36Å; R287-V356 VanDerWaalsContact O-CA 3.3Å; R287-V356 WeakPolarHBondContact O-CA 3.42Å; V288-V356 HydrophobicContact CG1-CG2 4.47Å; V288-V356 HydrophobicContact CG2-CG2 4.39Å; I331-V356 HydrophobicContact CD1-CG2 4.33Å; V356-L359 HydrophobicContact CB-CD2 4.49Å; V356-L359 HydrophobicContact CG1-CD2 3.88Å
357	Q	97.1	Very high	80.5	Confident	47 Å²	47	65.1 Å²	65.1	22%	0.22	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	174.9	-178	-51.9	-175	-29.1	0	0	110.3	R286 R287 Q355	R286-Q357 PolarHBondContact N-O 2.92Å; R287-Q357 HydrophobicContact CB-CB 4.2Å; R287-Q357 PolarHBondContact N-O 3.28Å; R287-Q357 PolarHBondContact O-N 3.44Å; Q355-Q357 HydrophobicContact CG-CG 4.02Å; Q355-Q357 VanDerWaalsContact NE2-NE2 3.17Å
358	Q	94.8	Very high	77.7	Confident	81 Å²	81	67 Å²	67	38%	0.379	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.2	69.9	-166.3	-74.9	167.7	-47	0	0	108.6	G285 R286 R287 M320	G285-Q358 WeakPolarHBondContact CA-O 3.3Å; R286-Q358 HydrophobicContact CB-CB 4.28Å; R286-Q358 PolarHBondContact N-O 2.85Å; R286-Q358 VanDerWaalsContact N-O 3.16Å; R287-Q358 VanDerWaalsContact NH2-NE2 3.13Å; M320-Q358 PolarHBondContact SD-OE1 3.27Å
359	L	95.4	Very high	74.6	Confident	35 Å²	35	71.4 Å²	71.4	18%	0.183	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.5	-178.4	-57	-170.3	0	0	0	109.5	R244 V247 L278 L283 R284 V356	R244-L359 HydrophobicContact CG-CD1 4.27Å; V247-L359 HydrophobicContact CG2-CD1 3.9Å; L278-L359 HydrophobicContact CD2-CD2 4.07Å; L283-L359 HydrophobicContact CD1-CB 4.33Å; L283-L359 HydrophobicContact CD1-CD1 3.62Å; R284-L359 CarbonylContact O-C 3.57Å; R284-L359 VanDerWaalsContact O-CA 3.22Å; R284-L359 WeakPolarHBondContact O-CA 3.39Å; V356-L359 HydrophobicContact CB-CD2 4.49Å; V356-L359 HydrophobicContact CG1-CD2 3.88Å
360	E	92.7	Very high	71.9	Confident	99 Å²	99	84 Å²	84	46%	0.463	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.9	177.1	-72	162.6	-164.7	0	0	107	R284 S324	R284-E360 PolarHBondContact N-O 2.86Å; R284-E360 PolarHBondContact O-N 3.42Å; S324-E360 WeakPolarHBondContact CB-OE2 3.41Å; S324-E360 PolarHBondContact OG-OE1 3.2Å; S324-E360 PolarHBondContact OG-OE2 3.28Å
361	G	85.1	Confident	68.9	Low	46 Å²	46	86.9 Å²	86.9	47%	0.474	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	145.8	175.7	0	0	0	0	0	111.2	Q363	G361-Q363 PolarHBondContact O-N 3.38Å
362	N	62.9	Low	66.3	Low	109 Å²	109	93.5 Å²	93.5	58%	0.583	51%	0.514	S	S	*	.			trans	-70.2	84.6	161.1	-79.1	-9.2	0	0	0	108.5	G282 R284 P364	G282-N362 PolarHBondContact O-N 2.85Å; R284-N362 VanDerWaalsContact CD-OD1 3.26Å; R284-N362 WeakPolarHBondContact CD-OD1 3.31Å; N362-P364 WeakPolarHBondContact O-CD 3.44Å
363	Q	46.5	Very low	63.5	Low	168 Å²	168	104.8 Å²	104.8	79%	0.785	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-68.9	123.2	159.5	-77	-170.2	-5.9	0	0	107.9	G361	G361-Q363 PolarHBondContact O-N 3.38Å
364	P	42.7	Very low	60.9	Low	115 Å²	115	109.9 Å²	109.9	75%	0.747	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-59.1	138.3	150.3	29	-31.7	0	0	0	106.9	N362 A366	N362-P364 WeakPolarHBondContact O-CD 3.44Å; P364-A366 PolarHBondContact O-N 3.32Å; P364-A366 VanDerWaalsContact O-N 3.15Å
365	Q	34.8	Very low	58.3	Low	192 Å²	192	119.9 Å²	119.9	90%	0.897	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-50.5	125.7	179.2	-73.5	174.8	-58.4	0	0	109.5	Q367	Q365-Q367 PolarHBondContact O-N 2.9Å
366	A	36.2	Very low	55.8	Low	97 Å²	97	121.5 Å²	121.5	80%	0.802	64%	0.639	S	S	*	*			trans	-65.7	103	-178.8	0	0	0	0	0	109.1	P364	P364-A366 PolarHBondContact O-N 3.32Å; P364-A366 VanDerWaalsContact O-N 3.15Å
367	Q	36.1	Very low	53.5	Low	184 Å²	184	123.3 Å²	123.3	86%	0.86	65%	0.649	S	S	*	*			trans	-89.9	125.8	166.1	-157.5	166.9	12.2	0	0	106.8	Q365 C369	Q365-Q367 PolarHBondContact O-N 2.9Å; Q367-C369 PolarHBondContact O-N 3.33Å; Q367-C369 VanDerWaalsContact O-N 3.13Å
368	D	35.8	Very low	51	Low	164 Å²	164	125.9 Å²	125.9	88%	0.877	66%	0.659	S	S	*	*			trans	-50.6	115.3	-167	-81.7	-59	0	0	0	113.9
369	C	30.3	Very low	49	Very low	122 Å²	122	127 Å²	127	82%	0.824	67%	0.668	S	S	*	*			trans	-148.9	106.7	163.6	-91.8	0	0	0	0	109.8	Q367 G371	Q367-C369 PolarHBondContact O-N 3.33Å; Q367-C369 VanDerWaalsContact O-N 3.13Å; C369-G371 PolarHBondContact O-N 3.2Å
370	R	37.6	Very low	46.8	Very low	266 Å²	266	131.8 Å²	131.8	100%	1.004	69%	0.691	S	S	*	*			trans	-63.2	117.4	171.3	-71.2	-176.5	176.2	-160.6	-1.2	109.6
371	G	34.3	Very low	44.4	Very low	63 Å²	63	130.3 Å²	130.3	65%	0.649	69%	0.686	S	S	*	*			trans	175.1	98.6	175.7	0	0	0	0	0	111.6	C369 R373	C369-G371 PolarHBondContact O-N 3.2Å; G371-R373 PolarHBondContact O-N 3.49Å
372	T	42.3	Very low	42.6	Very low	140 Å²	140	131.9 Å²	131.9	86%	0.859	68%	0.683	S	S	*	*			trans	-64.4	92.4	178.4	-46.7	0	0	0	0	110.5	T374	T372-T374 PolarHBondContact O-N 3.42Å
373	R	37.7	Very low	41.6	Very low	239 Å²	239	129 Å²	129	90%	0.902	68%	0.679	S	S	*	*			trans	-88.6	87.6	167.1	-76.5	-173.6	175.7	173	-0.1	109.1	G371 R375	G371-R373 PolarHBondContact O-N 3.49Å; R373-R375 PolarHBondContact O-N 3Å
374	T	42.6	Very low	41.6	Very low	110 Å²	110	128.1 Å²	128.1	68%	0.675	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-54	125.5	160.1	35.5	0	0	0	0	108.6	T372	T372-T374 PolarHBondContact O-N 3.42Å
375	R	44.5	Very low	41	Very low	211 Å²	211	126.3 Å²	126.3	80%	0.796	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-72	134.7	171.4	-66.6	-176.3	-179.3	-173	0.3	107.8	R373	R373-R375 PolarHBondContact O-N 3Å
376	S	45	Very low	40.8	Very low	64 Å²	64	122.7 Å²	122.7	45%	0.448	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-66.9	148.5	-178.5	-175.3	0	0	0	0	109.9	K378 D379 M380	S376-K378 PolarHBondContact O-N 3.11Å; S376-K378 VanDerWaalsContact O-N 3.1Å; S376-K378 WeakPolarHBondContact OG-CB 3.47Å; S376-K378 PolarHBondContact OG-N 3.33Å; S376-D379 PolarHBondContact N-OD2 2.62Å; S376-D379 WeakPolarHBondContact O-CB 3.48Å; S376-D379 PolarHBondContact O-N 2.88Å; S376-M380 PolarHBondContact O-N 2.93Å
377	I	50.1	Low	40.5	Very low	38 Å²	38	126.7 Å²	126.7	20%	0.195	68%	0.681	C	S	.	*	H	α-helix	trans	-53.5	-30.8	168.8	-66.5	167.9	0	0	0	110.1	Y89 A93 I99 D379 M380 L381	Y89-I377 HydrophobicContact CD1-CG2 4.37Å; A93-I377 HydrophobicContact CB-CD1 4.1Å; I99-I377 HydrophobicContact CD1-CD1 4.18Å; I377-D379 VanDerWaalsContact C-N 3.34Å; I377-D379 PolarHBondContact O-N 2.81Å; I377-M380 HydrophobicContact CG1-CE 4.26Å; I377-M380 PolarHBondContact O-N 3.24Å; I377-L381 HydrophobicContact CG2-CD1 3.85Å; I377-L381 HydrophobicContact CG2-CG 4.47Å; I377-L381 WeakPolarHBondContact O-CG 3.38Å; I377-L381 PolarHBondContact O-N 2.69Å
378	K	44.6	Very low	40.1	Very low	100 Å²	100	122.2 Å²	122.2	44%	0.435	68%	0.676	S	S	.	*	H	α-helix	trans	-57.8	-40.7	172.5	-163.7	157.7	-170.1	138.3	0	113	E90 S376 M380 L381 L382	E90-K378 IonicContact OE1-NZ 3.78Å; E90-K378 PolarHBondContact OE1-NZ 3.24Å; S376-K378 PolarHBondContact O-N 3.11Å; S376-K378 VanDerWaalsContact O-N 3.1Å; S376-K378 WeakPolarHBondContact OG-CB 3.47Å; S376-K378 PolarHBondContact OG-N 3.33Å; K378-M380 VanDerWaalsContact C-N 3.34Å; K378-M380 PolarHBondContact O-N 3.44Å; K378-L381 PolarHBondContact O-N 3.02Å; K378-L382 HydrophobicContact CD-CD1 4.42Å; K378-L382 HydrophobicContact CG-CD1 3.62Å; K378-L382 HydrophobicContact CG-CG 4.21Å; K378-L382 VanDerWaalsContact O-CB 3.27Å; K378-L382 WeakPolarHBondContact O-CB 3.37Å; K378-L382 VanDerWaalsContact O-CG 3.3Å; K378-L382 WeakPolarHBondContact O-CG 3.35Å; K378-L382 PolarHBondContact O-N 3.38Å
379	D	51.1	Low	39.8	Very low	106 Å²	106	126 Å²	126	57%	0.567	68%	0.677	S	S	*	*	H	α-helix	trans	-72.7	-25.7	178.6	-55.6	-44.8	0	0	0	112.7	S376 I377	S376-D379 PolarHBondContact N-OD2 2.62Å; S376-D379 WeakPolarHBondContact O-CB 3.48Å; S376-D379 PolarHBondContact O-N 2.88Å; I377-D379 VanDerWaalsContact C-N 3.34Å; I377-D379 PolarHBondContact O-N 2.81Å
380	M	49.6	Very low	39.6	Very low	134 Å²	134	126.8 Å²	126.8	66%	0.66	68%	0.679	S	S	*	*	H	α-helix	trans	-75.5	-29.2	173.2	-78.6	-166.7	-74	0	0	113	S376 I377 K378	S376-M380 PolarHBondContact O-N 2.93Å; I377-M380 HydrophobicContact CG1-CE 4.26Å; I377-M380 PolarHBondContact O-N 3.24Å; K378-M380 VanDerWaalsContact C-N 3.34Å; K378-M380 PolarHBondContact O-N 3.44Å
381	L	42.8	Very low	39.1	Very low	69 Å²	69	120.2 Å²	120.2	36%	0.361	67%	0.668	S	S	.	*	H	α-helix	trans	-95.3	-27.9	-177.2	-62	172.2	0	0	0	112.6	L86 Y89 I377 K378 G383	L86-L381 HydrophobicContact CD2-CB 3.55Å; L86-L381 HydrophobicContact CD2-CD1 3.85Å; L86-L381 HydrophobicContact CD2-CG 4.32Å; Y89-L381 HydrophobicContact CD2-CD1 4.33Å; Y89-L381 HydrophobicContact CG-CD1 4.19Å; I377-L381 HydrophobicContact CG2-CD1 3.85Å; I377-L381 HydrophobicContact CG2-CG 4.47Å; I377-L381 WeakPolarHBondContact O-CG 3.38Å; I377-L381 PolarHBondContact O-N 2.69Å; K378-L381 PolarHBondContact O-N 3.02Å; L381-G383 VanDerWaalsContact C-N 3.34Å; L381-G383 PolarHBondContact O-N 3.24Å
382	L	46.7	Very low	38.8	Very low	78 Å²	78	125 Å²	125	41%	0.408	68%	0.679	S	S	.	*			trans	-90.1	61.7	175.2	-61.4	-177.6	0	0	0	112.4	L86 K378 Q384	L86-L382 HydrophobicContact CD1-CD2 4.46Å; L86-L382 HydrophobicContact CD2-CD2 4.48Å; K378-L382 HydrophobicContact CD-CD1 4.42Å; K378-L382 HydrophobicContact CG-CD1 3.62Å; K378-L382 HydrophobicContact CG-CG 4.21Å; K378-L382 VanDerWaalsContact O-CB 3.27Å; K378-L382 WeakPolarHBondContact O-CB 3.37Å; K378-L382 VanDerWaalsContact O-CG 3.3Å; K378-L382 WeakPolarHBondContact O-CG 3.35Å; K378-L382 PolarHBondContact O-N 3.38Å; L382-Q384 PolarHBondContact O-N 3.32Å
383	G	42	Very low	38	Very low	50 Å²	50	128.5 Å²	128.5	52%	0.515	68%	0.682	S	S	.	*			trans	-63.7	119.7	157.6	0	0	0	0	0	109.6	L381	L381-G383 VanDerWaalsContact C-N 3.34Å; L381-G383 PolarHBondContact O-N 3.24Å
384	Q	46.8	Very low	37.5	Very low	149 Å²	149	122.1 Å²	122.1	70%	0.696	68%	0.681	S	S	*	*			trans	81.7	136.8	-172	-50.8	170.9	3.2	0	0	114.5	E280 L382	E280-Q384 PolarHBondContact OE1-NE2 3.12Å; L382-Q384 PolarHBondContact O-N 3.32Å
385	G	30.4	Very low	36.7	Very low	77 Å²	77	120.9 Å²	120.9	79%	0.794	69%	0.69	S	S	*	*			cis	166.5	129	-8.8	0	0	0	0	0	113.3
386	S	29.3	Very low	35.8	Very low	116 Å²	116	116.1 Å²	116.1	81%	0.811	69%	0.689	S	S	*	*			trans	-161.8	100.9	168.6	58.7	0	0	0	0	112.1	A388	S386-A388 PolarHBondContact O-N 3.44Å
387	N	30.2	Very low	35.5	Very low	181 Å²	181	117.7 Å²	117.7	97%	0.968	70%	0.698	S	S	*	*			trans	-85.5	90.9	167.7	-100.3	-17.8	0	0	0	109.5
388	A	28.1	Very low	34.5	Very low	90 Å²	90	124.4 Å²	124.4	74%	0.744	73%	0.728	S	S	*	*			trans	-102.1	113.8	166	0	0	0	0	0	109.1	S386 T390	S386-A388 PolarHBondContact O-N 3.44Å; A388-T390 PolarHBondContact O-N 3.12Å
389	R	29	Very low	33.6	Very low	242 Å²	242	129.3 Å²	129.3	91%	0.913	75%	0.75	S	S	*	*			trans	-97.3	93.1	-171.3	-161.1	-179	-164.3	-177.9	4.3	110	T391	R389-T391 PolarHBondContact O-N 3.15Å
390	T	26.2	Very low	32.4	Very low	140 Å²	140	132.6 Å²	132.6	86%	0.859	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-71.7	121.1	175.5	11.4	0	0	0	0	111.1	A388	A388-T390 PolarHBondContact O-N 3.12Å
391	T	27	Very low	31.2	Very low	127 Å²	127	131.7 Å²	131.7	78%	0.779	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-96.7	125.3	172.3	50.2	0	0	0	0	110.6	R389	R389-T391 PolarHBondContact O-N 3.15Å
392	N	27.9	Very low	30.5	Very low	163 Å²	163	133.4 Å²	133.4	87%	0.872	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-64.8	145.1	173.2	-72.3	-22	0	0	0	112.2
393	K	27.3	Very low	29.6	Very low	214 Å²	214	134.8 Å²	134.8	93%	0.93	80%	0.798	S	S	*	*			trans	-137.5	145.5	145.2	-114.6	-175.8	179.8	-176.8	0	109.8
394	A	26.6	Very low	28.8	Very low	106 Å²	106	137.2 Å²	137.2	88%	0.876	81%	0.812	S	S	*	*			trans	-91.4	161	-161.1	0	0	0	0	0	114.3
395	G	24.7	Very low	27.8	Very low	83 Å²	83	134.6 Å²	134.6	86%	0.856	82%	0.817	S	S	*	*			trans	-172.8	77	174.2	0	0	0	0	0	112.1
396	S	25.8	Very low	27.7	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	82%	0.815	S	S	*	*			trans	-86.6	172.9	165.7	57.8	0	0	0	0	109.5
397	P	40	Very low	27.6	Very low	98 Å²	98	137.6 Å²	137.6	64%	0.636	82%	0.817	S	S	*	*			cis	-148.3	177.2	22.6	43.8	-23.3	0	0	0	119.6
398	Q	28.1	Very low	27.4	Very low	178 Å²	178	134.3 Å²	134.3	83%	0.832	81%	0.808	S	S	*	*			trans	60.5	127.3	146	-78.6	167.7	-26.7	0	0	119.7
399	K	26.4	Very low	27.2	Very low	204 Å²	204	135.3 Å²	135.3	89%	0.887	81%	0.81	S	S	*	*				-157.9	153	63.8	-119.4	172.8	-175.9	177.3	0	113.5
400	Q	26	Very low	27.8	Very low	175 Å²	175	129 Å²	129	82%	0.818	80%	0.8	S	S	*	*			trans	-76.6	166.8	161.5	-58.4	164.5	-36.7	0	0	108.7
401	T	24.5	Very low	27.9	Very low	114 Å²	114	130.9 Å²	130.9	70%	0.699	80%	0.799	S	S	*	*			cis	-162.9	159	40.3	45.9	0	0	0	0	111.8
402	S	28.3	Very low	29	Very low	106 Å²	106	130 Å²	130	74%	0.741	80%	0.796	S	S	*	*			trans	50.2	145.3	142.5	61.7	0	0	0	0	122
403	S	26.6	Very low	29.8	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	79%	0.79	S	S	*	*			cis	179.5	156.6	-9.2	49.5	0	0	0	0	111
404	A	26	Very low	29.8	Very low	100 Å²	100	123.7 Å²	123.7	83%	0.826	78%	0.783	S	S	*	*			trans	83.9	151.2	148.1	0	0	0	0	0	122.8
405	A	26.1	Very low	30.5	Very low	95 Å²	95	124.4 Å²	124.4	79%	0.785	78%	0.779	S	S	*	*			trans	83.8	80	153.5	0	0	0	0	0	121.9
406	A	27	Very low	30.5	Very low	91 Å²	91	125.2 Å²	125.2	75%	0.752	78%	0.777	S	S	*	*				57.4	130	107.8	0	0	0	0	0	124.3
407	L	27.6	Very low	30.6	Very low	165 Å²	165	128.2 Å²	128.2	86%	0.864	78%	0.779	S	S	*	*			trans	85.4	133.8	133.5	-82.9	163.5	0	0	0	123.1
408	S	25.8	Very low	30.6	Very low	111 Å²	111	129 Å²	129	78%	0.776	78%	0.784	S	S	*	*			trans	97.4	116.8	151.6	-30.7	0	0	0	0	120.3
409	S	25.1	Very low	30.6	Very low	112 Å²	112	126.3 Å²	126.3	78%	0.783	78%	0.779	S	S	*	*			trans	-73.7	-172.1	162.8	49.5	0	0	0	0	112
410	P	41.9	Very low	31.1	Very low	108 Å²	108	122.5 Å²	122.5	70%	0.701	78%	0.775	S	S	*	*			cis	-143.7	173.7	12.6	40.6	-18.7	0	0	0	119.8
411	H	28.4	Very low	31	Very low	181 Å²	181	117.5 Å²	117.5	84%	0.838	77%	0.771	S	S	*	*			trans	5.4	170.1	146.7	-70.4	-72.9	0	0	0	122.7
412	P	48.1	Very low	31	Very low	109 Å²	109	118.7 Å²	118.7	71%	0.708	78%	0.778	S	S	*	*			cis	-128	-138.1	-31.1	37.1	-15	0	0	0	109.1
413	P	45.9	Very low	30.8	Very low	115 Å²	115	119.3 Å²	119.3	75%	0.747	78%	0.783	S	S	*	*			cis	-132.8	-162.3	-21.5	40.6	-20.1	0	0	0	115.4
414	T	26.7	Very low	30.8	Very low	129 Å²	129	122.9 Å²	122.9	79%	0.791	79%	0.785	S	S	*	*			trans	-80.1	173.8	173.1	11.4	0	0	0	0	114.1
415	P	41	Very low	30.7	Very low	121 Å²	121	125.7 Å²	125.7	79%	0.786	79%	0.786	S	S	*	*			cis	-153.3	-177.1	44.5	44.1	-22	0	0	0	120.8
416	A	26.2	Very low	30.7	Very low	100 Å²	100	127.7 Å²	127.7	83%	0.826	79%	0.788	S	S	*	*			trans	100.6	135.5	144.7	0	0	0	0	0	122.3
417	E	26.3	Very low	31	Very low	173 Å²	173	128.6 Å²	128.6	81%	0.808	79%	0.787	S	S	*	*			trans	-72.9	175.9	168.8	-102.4	-171.1	160.9	0	0	112.8
418	P	40.2	Very low	30.8	Very low	115 Å²	115	127.8 Å²	127.8	75%	0.747	79%	0.788	S	S	*	*			cis	-150.2	-176.3	37.6	41.4	-18	0	0	0	120.1
419	V	28.8	Very low	30.6	Very low	121 Å²	121	128 Å²	128	73%	0.733	79%	0.788	S	S	*	*			trans	-57.4	-178.4	163.6	-112.5	0	0	0	0	114.3
420	P	37.6	Very low	30.5	Very low	124 Å²	124	134.5 Å²	134.5	81%	0.805	80%	0.796	S	S	*	*			cis	-135.9	-174	-10.4	35.8	-15.2	0	0	0	115.3
421	G	22.8	Very low	29.6	Very low	70 Å²	70	133.9 Å²	133.9	72%	0.722	80%	0.8	S	S	*	*			trans	159.7	114.2	153.4	0	0	0	0	0	119.4
422	T	23.9	Very low	29.4	Very low	140 Å²	140	129.4 Å²	129.4	86%	0.859	79%	0.794	S	S	*	*			trans	-5.3	144.6	148.4	55.3	0	0	0	0	119
423	S	25.7	Very low	28.3	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	80%	0.801	S	S	*	*				-167.8	176.6	68.2	-159	0	0	0	0	115.1
424	K	25.1	Very low	27.3	Very low	182 Å²	182	137.2 Å²	137.2	79%	0.791	81%	0.808	S	S	*	*			trans	-72.8	155.2	175.5	-57	168.3	178.3	174.9	0	112.1
425	D	24.7	Very low	27.3	Very low	158 Å²	158	140.3 Å²	140.3	85%	0.845	81%	0.813	S	S	*	*				-173.7	156.2	109.3	-94.6	-21	0	0	0	113.9
426	T	25.2	Very low	26.7	Very low	137 Å²	137	139.7 Å²	139.7	84%	0.84	81%	0.812	S	S	*	*			trans	-105.9	170.3	-179.2	12.3	0	0	0	0	111.3
427	P	34.6	Very low	26.8	Very low	111 Å²	111	146.6 Å²	146.6	72%	0.721	82%	0.817	S	S	*	*			trans	-103.3	166.6	-145.1	39.6	-38.5	0	0	0	115.8
428	V	22.6	Very low	27	Very low	147 Å²	147	144.8 Å²	144.8	89%	0.891	82%	0.818	S	S	*	*			trans	-132	130.1	158.6	179	0	0	0	0	110
429	C	21.8	Very low	26.3	Very low	115 Å²	115	150.4 Å²	150.4	78%	0.777	82%	0.824	S	S	*	*			trans	-81.9	153.1	-179.3	-56.5	0	0	0	0	113.2
430	R	22.5	Very low	26.4	Very low	249 Å²	249	152.2 Å²	152.2	94%	0.94	83%	0.829	S	S	*	*			trans	-151.8	142.4	139.9	-115.5	170.7	-175	-177.9	1.2	113.2
431	A	23.6	Very low	26	Very low	96 Å²	96	153.7 Å²	153.7	79%	0.793	83%	0.83	S	S	*	*			trans	-33.1	163.3	171.7	0	0	0	0	0	117.9
432	A	23.9	Very low	26.4	Very low	87 Å²	87	156.8 Å²	156.8	72%	0.719	83%	0.829	S	S	*	*			cis	-179.9	148.4	-16.8	0	0	0	0	0	107.9
433	Q	25.3	Very low	26.8	Very low	182 Å²	182	156 Å²	156	85%	0.85	83%	0.83	S	S	*	*			trans	-166.4	121.1	156	-112.9	160.2	17.2	0	0	115.6
434	K	24.8	Very low	27.7	Very low	205 Å²	205	157 Å²	157	89%	0.891	82%	0.824	S	S	*	*			trans	12	109.7	148.4	-59.3	173.8	-179	177.6	0	118.3
435	H	26.8	Very low	28.7	Very low	194 Å²	194	156.1 Å²	156.1	90%	0.898	82%	0.823	S	S	*	*			trans	-84.5	123.9	158.6	-80	-72.9	0	0	0	111.8
436	S	29	Very low	30.1	Very low	109 Å²	109	150.9 Å²	150.9	76%	0.762	80%	0.796	S	S	*	*			trans	-76.6	133.5	166.2	43	0	0	0	0	110.6	T438	S436-T438 PolarHBondContact O-N 3.27Å
437	R	27.2	Very low	31.6	Very low	244 Å²	244	147.4 Å²	147.4	92%	0.921	78%	0.776	S	S	*	*			trans	-76.2	112.8	173.2	-80.3	175.7	153.4	130.3	-8.1	110.2	R439	R437-R439 PolarHBondContact O-N 3.1Å
438	T	30	Very low	32.8	Very low	136 Å²	136	144.1 Å²	144.1	83%	0.834	76%	0.756	S	S	*	*			trans	-76.7	113.1	163.9	38	0	0	0	0	109.6	S436	S436-T438 PolarHBondContact O-N 3.27Å
439	R	26.9	Very low	34.4	Very low	233 Å²	233	140.9 Å²	140.9	88%	0.879	74%	0.738	S	S	*	*			trans	-73.9	128.2	175.1	-75.9	-177.3	170.1	-175.5	-3.3	110.3	R437	R437-R439 PolarHBondContact O-N 3.1Å
440	L	30.6	Very low	36.2	Very low	158 Å²	158	140.7 Å²	140.7	83%	0.827	74%	0.737	S	S	*	*			trans	-84.5	118.4	161.4	-68	170.7	0	0	0	108.5	L442	L440-L442 HydrophobicContact CB-CD1 4.37Å; L440-L442 PolarHBondContact O-N 3.02Å
441	N	29.4	Very low	37.9	Very low	155 Å²	155	135.5 Å²	135.5	83%	0.829	72%	0.724	S	S	*	*			trans	-78.4	102	172.3	-86.4	-35.9	0	0	0	109.7
442	L	30.1	Very low	39.8	Very low	136 Å²	136	133 Å²	133	71%	0.712	70%	0.699	S	S	*	*			trans	-96.4	111.1	156.6	-80.1	88.8	0	0	0	108.5	L440 I444	L440-L442 HydrophobicContact CB-CD1 4.37Å; L440-L442 PolarHBondContact O-N 3.02Å; L442-I444 HydrophobicContact CB-CG1 4.37Å; L442-I444 PolarHBondContact O-N 3.4Å; L442-I444 VanDerWaalsContact O-N 3.1Å
443	S	34	Very low	41.7	Very low	124 Å²	124	133.8 Å²	133.8	87%	0.867	69%	0.691	S	S	*	*			trans	-75.6	93.1	166.6	-60.4	0	0	0	0	109
444	I	44.7	Very low	43.6	Very low	139 Å²	139	134.1 Å²	134.1	71%	0.713	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-81.3	122.7	171.6	-60.6	173.3	0	0	0	107.5	L442 V446	L442-I444 HydrophobicContact CB-CG1 4.37Å; L442-I444 PolarHBondContact O-N 3.4Å; L442-I444 VanDerWaalsContact O-N 3.1Å; I444-V446 PolarHBondContact O-N 2.89Å
445	E	45.5	Very low	45.7	Very low	164 Å²	164	127.8 Å²	127.8	77%	0.766	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-69.5	117.6	170.6	-87.3	-166.1	114.4	0	0	110
446	V	54.8	Low	47.8	Very low	47 Å²	47	122.7 Å²	122.7	29%	0.285	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-71	127.9	174.4	-177.5	0	0	0	0	108.7	I444 V468	I444-V446 PolarHBondContact O-N 2.89Å; V446-V468 HydrophobicContact CG1-CG1 4.05Å
447	P	56.1	Low	49.7	Very low	64 Å²	64	118.5 Å²	118.5	42%	0.416	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-58	162	176.7	-24.3	34.1	0	0	0	113.2	Q451 V452 W472	P447-Q451 HydrophobicContact CB-CB 3.97Å; P447-V452 HydrophobicContact CB-CG2 4.02Å; P447-V452 HydrophobicContact CG-CG2 4.45Å; P447-W472 PolarHBondContact O-NE1 3.39Å
448	S	59.9	Low	51.9	Low	43 Å²	43	113.5 Å²	113.5	30%	0.301	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-69.8	156.1	175.2	63.8	0	0	0	0	111.3	S450 Q451	S448-S450 PolarHBondContact O-N 3.41Å; S448-S450 PolarHBondContact OG-OG 3.46Å; S448-Q451 VanDerWaalsContact N-OE1 3.09Å; S448-Q451 WeakPolarHBondContact O-CB 3.36Å; S448-Q451 PolarHBondContact O-N 2.94Å; S448-Q451 VanDerWaalsContact OG-CD 3.27Å; S448-Q451 WeakPolarHBondContact OG-CG 3.45Å; S448-Q451 PolarHBondContact OG-OE1 3.36Å; S448-Q451 VanDerWaalsContact OG-OE1 3.12Å
449	P	55.8	Low	54.1	Low	79 Å²	79	111 Å²	111	51%	0.513	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-58	-24.7	-175.6	-24.7	32.3	0	0	0	114.7	Q451 W472	P449-Q451 VanDerWaalsContact C-N 3.31Å; P449-W472 HydrophobicContact CB-CD2 4.35Å; P449-W472 HydrophobicContact CB-CE3 4.37Å; P449-W472 HydrophobicContact CB-CH2 4.33Å; P449-W472 HydrophobicContact CB-CZ2 4.3Å; P449-W472 HydrophobicContact CB-CZ3 4.36Å; P449-W472 HydrophobicContact CG-CD2 3.73Å; P449-W472 HydrophobicContact CG-CE3 4.13Å; P449-W472 HydrophobicContact CG-CG 3.93Å; P449-W472 HydrophobicContact CG-CZ2 4.33Å
450	S	58.8	Low	56.1	Low	110 Å²	110	103.1 Å²	103.1	77%	0.769	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-80.6	-6.1	176.7	52.6	0	0	0	0	114.6	S448	S448-S450 PolarHBondContact O-N 3.41Å; S448-S450 PolarHBondContact OG-OG 3.46Å
451	Q	58	Low	58.4	Low	140 Å²	140	99.5 Å²	99.5	65%	0.654	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-105.7	-4.9	-179.3	-65.1	175.1	-38.7	0	0	113.1	P447 S448 P449	P447-Q451 HydrophobicContact CB-CB 3.97Å; S448-Q451 VanDerWaalsContact N-OE1 3.09Å; S448-Q451 WeakPolarHBondContact O-CB 3.36Å; S448-Q451 PolarHBondContact O-N 2.94Å; S448-Q451 VanDerWaalsContact OG-CD 3.27Å; S448-Q451 WeakPolarHBondContact OG-CG 3.45Å; S448-Q451 PolarHBondContact OG-OE1 3.36Å; S448-Q451 VanDerWaalsContact OG-OE1 3.12Å; P449-Q451 VanDerWaalsContact C-N 3.31Å
452	V	63.3	Low	60	Low	44 Å²	44	95.4 Å²	95.4	27%	0.267	55%	0.546	S	S	.	.	S	Bend	trans	-108.2	123.6	-179.2	-176.9	0	0	0	0	109.3	P447 R454 L457 W472	P447-V452 HydrophobicContact CB-CG2 4.02Å; P447-V452 HydrophobicContact CG-CG2 4.45Å; V452-R454 PolarHBondContact O-N 3.07Å; V452-L457 HydrophobicContact CG1-CB 4.38Å; V452-W472 HydrophobicContact CB-CH2 4.45Å; V452-W472 HydrophobicContact CB-CZ2 4.47Å; V452-W472 HydrophobicContact CG2-CH2 4.49Å; V452-W472 HydrophobicContact CG2-CZ2 4.04Å
453	D	64.2	Low	61.8	Low	103 Å²	103	96.8 Å²	96.8	55%	0.551	55%	0.548	S	S	*	.			trans	-66.5	129.5	173	-168.5	-49.2	0	0	0	109.7	S455 V456 L457	D453-S455 VanDerWaalsContact CG-OG 3.31Å; D453-S455 PolarHBondContact O-N 2.65Å; D453-S455 WeakPolarHBondContact OD1-CB 3.36Å; D453-S455 PolarHBondContact OD1-N 3.48Å; D453-S455 PolarHBondContact OD1-OG 3.31Å; D453-V456 HydrophobicContact CB-CG2 4.07Å; D453-V456 WeakPolarHBondContact O-CB 3.3Å; D453-V456 PolarHBondContact O-N 2.91Å; D453-L457 PolarHBondContact O-N 2.97Å
454	R	66	Low	63.3	Low	190 Å²	190	95 Å²	95	72%	0.717	53%	0.529	S	S	*	.	H	α-helix	trans	-60.1	-33.1	-175.7	-163.7	172.6	-172.6	147.8	5.4	112.4	V452 V456 L457 E458	V452-R454 PolarHBondContact O-N 3.07Å; R454-V456 VanDerWaalsContact C-N 3.29Å; R454-V456 PolarHBondContact O-N 2.93Å; R454-L457 PolarHBondContact O-N 3.3Å; R454-E458 IonicContact NE-OE1 2.86Å; R454-E458 WeakPolarHBondContact O-CG 3.42Å; R454-E458 PolarHBondContact O-N 3.03Å; R454-E458 VanDerWaalsContact O-N 3.11Å
455	S	69.4	Low	64.9	Low	72 Å²	72	92.5 Å²	92.5	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-31.1	175.9	63.6	0	0	0	0	113	D453 A459	D453-S455 VanDerWaalsContact CG-OG 3.31Å; D453-S455 PolarHBondContact O-N 2.65Å; D453-S455 WeakPolarHBondContact OD1-CB 3.36Å; D453-S455 PolarHBondContact OD1-N 3.48Å; D453-S455 PolarHBondContact OD1-OG 3.31Å; S455-A459 WeakPolarHBondContact O-CB 3.44Å; S455-A459 PolarHBondContact O-N 3.17Å
456	V	70.9	Confident	66.3	Low	86 Å²	86	89.6 Å²	89.6	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-77.2	-36	177.6	178.6	0	0	0	0	110.8	D453 R454 A459	D453-V456 HydrophobicContact CB-CG2 4.07Å; D453-V456 WeakPolarHBondContact O-CB 3.3Å; D453-V456 PolarHBondContact O-N 2.91Å; R454-V456 VanDerWaalsContact C-N 3.29Å; R454-V456 PolarHBondContact O-N 2.93Å; V456-A459 PolarHBondContact O-N 3.49Å
457	L	68.3	Low	67	Low	21 Å²	21	93.5 Å²	93.5	11%	0.11	51%	0.512	C	S	.	.	H	α-helix	trans	-66.7	-38.3	175.6	-172.8	66.6	0	0	0	112	V452 D453 R454 A459 L460 R465 V468 W472	V452-L457 HydrophobicContact CG1-CB 4.38Å; D453-L457 PolarHBondContact O-N 2.97Å; R454-L457 PolarHBondContact O-N 3.3Å; L457-A459 VanDerWaalsContact C-N 3.35Å; L457-L460 HydrophobicContact CD1-CD1 4.37Å; L457-L460 PolarHBondContact O-N 3.27Å; L457-R465 HydrophobicContact CD1-CG 4.02Å; L457-R465 HydrophobicContact CG-CG 4.07Å; L457-R465 WeakPolarHBondContact O-CD 3.34Å; L457-V468 HydrophobicContact CD1-CB 4.42Å; L457-V468 HydrophobicContact CD1-CG1 3.98Å; L457-W472 HydrophobicContact CD1-CH2 4.46Å; L457-W472 HydrophobicContact CD2-CH2 4.03Å; L457-W472 HydrophobicContact CD2-CZ3 3.9Å
458	E	72.3	Confident	67.6	Low	139 Å²	139	91.9 Å²	91.9	65%	0.65	50%	0.501	S	S	*	.	H	α-helix	trans	-73.4	-23.7	177.2	-72.2	172.9	-168.8	0	0	113.2	R454 L460	R454-E458 IonicContact NE-OE1 2.86Å; R454-E458 WeakPolarHBondContact O-CG 3.42Å; R454-E458 PolarHBondContact O-N 3.03Å; R454-E458 VanDerWaalsContact O-N 3.11Å; E458-L460 VanDerWaalsContact C-N 3.31Å
459	A	77.4	Confident	68.4	Low	83 Å²	83	93.1 Å²	93.1	69%	0.686	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.1	175.2	0	0	0	0	0	114.4	S455 V456 L457	S455-A459 WeakPolarHBondContact O-CB 3.44Å; S455-A459 PolarHBondContact O-N 3.17Å; V456-A459 PolarHBondContact O-N 3.49Å; L457-A459 VanDerWaalsContact C-N 3.35Å
460	L	69.6	Low	68.9	Low	69 Å²	69	93.4 Å²	93.4	36%	0.361	50%	0.496	S	S	.	.	S	Bend	trans	-82.5	146.2	179.1	-74.7	170.5	0	0	0	112.5	L457 E458 R465	L457-L460 HydrophobicContact CD1-CD1 4.37Å; L457-L460 PolarHBondContact O-N 3.27Å; E458-L460 VanDerWaalsContact C-N 3.31Å; L460-R465 HydrophobicContact CB-CB 4.34Å
461	P	77.8	Confident	69.4	Low	82 Å²	82	90.2 Å²	90.2	53%	0.532	47%	0.474	S	S	.	.			trans	-53.7	141.6	169.4	-25.2	34.2	0	0	0	112.1	E463 L464 R465	P461-E463 VanDerWaalsContact C-N 3.34Å; P461-E463 PolarHBondContact O-N 2.93Å; P461-L464 HydrophobicContact CG-CD1 4.34Å; P461-L464 PolarHBondContact O-N 2.99Å; P461-R465 PolarHBondContact O-N 3.35Å
462	A	64.1	Low	69.9	Low	68 Å²	68	85.3 Å²	85.3	56%	0.562	45%	0.45	S	S	*	.	H	α-helix	trans	-53	-43.7	-169.9	0	0	0	0	0	114.2	L464 R465 E466	A462-L464 VanDerWaalsContact C-N 3.3Å; A462-L464 PolarHBondContact O-N 2.91Å; A462-R465 PolarHBondContact O-N 2.85Å; A462-E466 WeakPolarHBondContact O-CB 3.26Å; A462-E466 PolarHBondContact O-N 3.14Å
463	E	67.4	Low	69.7	Low	165 Å²	165	87.4 Å²	87.4	77%	0.771	46%	0.463	S	S	*	.	H	α-helix	trans	-59.3	-37.2	176.6	-73.3	-175.1	120.5	0	0	113.3	P461 Q467	P461-E463 VanDerWaalsContact C-N 3.34Å; P461-E463 PolarHBondContact O-N 2.93Å; E463-Q467 WeakPolarHBondContact O-CG 3.42Å; E463-Q467 PolarHBondContact O-N 2.97Å; E463-Q467 VanDerWaalsContact O-N 3.15Å
464	L	65.3	Low	69.3	Low	88 Å²	88	89.7 Å²	89.7	46%	0.461	47%	0.468	S	S	.	.	H	α-helix	trans	-80	-37.5	-178.5	-63.5	179.2	0	0	0	111.5	P461 A462 E466 Q467 V468	P461-L464 HydrophobicContact CG-CD1 4.34Å; P461-L464 PolarHBondContact O-N 2.99Å; A462-L464 VanDerWaalsContact C-N 3.3Å; A462-L464 PolarHBondContact O-N 2.91Å; L464-E466 VanDerWaalsContact C-N 3.35Å; L464-Q467 PolarHBondContact O-N 2.97Å; L464-V468 WeakPolarHBondContact O-CG2 3.24Å; L464-V468 PolarHBondContact O-N 2.86Å; L464-V468 VanDerWaalsContact O-N 3.12Å
465	R	77.7	Confident	68.8	Low	85 Å²	85	87.7 Å²	87.7	32%	0.321	46%	0.46	S	S	.	.	H	α-helix	trans	-60.3	-46.4	172.5	-172.5	-179.5	63.9	72.3	7.6	110.7	L457 L460 P461 A462 V468 E469	L457-R465 HydrophobicContact CD1-CG 4.02Å; L457-R465 HydrophobicContact CG-CG 4.07Å; L457-R465 WeakPolarHBondContact O-CD 3.34Å; L460-R465 HydrophobicContact CB-CB 4.34Å; P461-R465 PolarHBondContact O-N 3.35Å; A462-R465 PolarHBondContact O-N 2.85Å; R465-V468 PolarHBondContact O-N 2.85Å; R465-E469 WeakPolarHBondContact CG-OE1 3.34Å; R465-E469 IonicContact CZ-OE1 3.5Å; R465-E469 IonicContact CZ-OE2 3.95Å; R465-E469 IonicContact NH1-OE1 3.69Å; R465-E469 PolarHBondContact NH1-OE1 3.2Å; R465-E469 IonicContact NH1-OE2 2.7Å; R465-E469 PolarHBondContact NH1-OE2 3.42Å; R465-E469 WeakPolarHBondContact O-CG 3.23Å; R465-E469 PolarHBondContact O-N 3Å
466	E	74.3	Confident	67.8	Low	104 Å²	104	90.8 Å²	90.8	49%	0.486	47%	0.471	S	S	.	.	H	α-helix	trans	-65.5	-39.5	179.5	-159.7	-174.2	159.2	0	0	112.1	A462 L464 V468 E469 Q470	A462-E466 WeakPolarHBondContact O-CB 3.26Å; A462-E466 PolarHBondContact O-N 3.14Å; L464-E466 VanDerWaalsContact C-N 3.35Å; E466-V468 VanDerWaalsContact C-N 3.33Å; E466-V468 PolarHBondContact O-N 3.03Å; E466-E469 PolarHBondContact O-N 3.32Å; E466-Q470 HydrophobicContact CG-CG 4.49Å; E466-Q470 WeakPolarHBondContact O-CB 3.46Å; E466-Q470 VanDerWaalsContact O-CG 3.23Å; E466-Q470 WeakPolarHBondContact O-CG 3.33Å; E466-Q470 PolarHBondContact O-N 3.39Å; E466-Q470 PolarHBondContact OE1-NE2 3.4Å
467	Q	70.4	Confident	66.2	Low	128 Å²	128	94.5 Å²	94.5	60%	0.598	48%	0.483	S	S	*	.	H	α-helix	trans	-61.6	-37.5	173.2	-81.1	-175.1	-15.3	0	0	113.4	E463 L464 S471	E463-Q467 WeakPolarHBondContact O-CG 3.42Å; E463-Q467 PolarHBondContact O-N 2.97Å; E463-Q467 VanDerWaalsContact O-N 3.15Å; L464-Q467 PolarHBondContact O-N 2.97Å; Q467-S471 WeakPolarHBondContact O-CB 3.27Å; Q467-S471 PolarHBondContact O-N 3.25Å; Q467-S471 VanDerWaalsContact O-N 3.1Å
468	V	68.9	Low	64.6	Low	31 Å²	31	103.7 Å²	103.7	19%	0.188	52%	0.516	C	S	.	.	H	α-helix	trans	-67.2	-47.5	175.4	168.5	0	0	0	0	110.7	V446 L457 L464 R465 E466 Q470 S471 W472	V446-V468 HydrophobicContact CG1-CG1 4.05Å; L457-V468 HydrophobicContact CD1-CB 4.42Å; L457-V468 HydrophobicContact CD1-CG1 3.98Å; L464-V468 WeakPolarHBondContact O-CG2 3.24Å; L464-V468 PolarHBondContact O-N 2.86Å; L464-V468 VanDerWaalsContact O-N 3.12Å; R465-V468 PolarHBondContact O-N 2.85Å; E466-V468 VanDerWaalsContact C-N 3.33Å; E466-V468 PolarHBondContact O-N 3.03Å; V468-Q470 PolarHBondContact O-N 3.21Å; V468-S471 WeakPolarHBondContact O-CB 3.24Å; V468-S471 PolarHBondContact O-N 3.44Å; V468-S471 PolarHBondContact O-OG 3.4Å; V468-W472 HydrophobicContact CG1-CD2 4.29Å; V468-W472 HydrophobicContact CG1-CE3 4.44Å; V468-W472 HydrophobicContact CG1-CH2 3.94Å; V468-W472 HydrophobicContact CG1-CZ2 3.75Å; V468-W472 HydrophobicContact CG1-CZ3 4.27Å; V468-W472 PolarHBondContact O-N 2.94Å
469	E	75.4	Confident	62.8	Low	68 Å²	68	103.2 Å²	103.2	32%	0.318	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-40.4	178.5	-71.5	168.8	-174.1	0	0	112.3	R465 E466 S471 W472 T473	R465-E469 WeakPolarHBondContact CG-OE1 3.34Å; R465-E469 IonicContact CZ-OE1 3.5Å; R465-E469 IonicContact CZ-OE2 3.95Å; R465-E469 IonicContact NH1-OE1 3.69Å; R465-E469 PolarHBondContact NH1-OE1 3.2Å; R465-E469 IonicContact NH1-OE2 2.7Å; R465-E469 PolarHBondContact NH1-OE2 3.42Å; R465-E469 WeakPolarHBondContact O-CG 3.23Å; R465-E469 PolarHBondContact O-N 3Å; E466-E469 PolarHBondContact O-N 3.32Å; E469-S471 VanDerWaalsContact C-N 3.29Å; E469-S471 PolarHBondContact O-N 2.96Å; E469-W472 PolarHBondContact O-N 2.92Å; E469-T473 PolarHBondContact O-N 3.17Å; E469-T473 PolarHBondContact O-OG1 2.89Å
470	Q	67.4	Low	60.7	Low	85 Å²	85	106.5 Å²	106.5	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-26.9	172.7	-72	179.1	18.6	0	0	113.3	E466 V468 T473 K474	E466-Q470 HydrophobicContact CG-CG 4.49Å; E466-Q470 WeakPolarHBondContact O-CB 3.46Å; E466-Q470 VanDerWaalsContact O-CG 3.23Å; E466-Q470 WeakPolarHBondContact O-CG 3.33Å; E466-Q470 PolarHBondContact O-N 3.39Å; E466-Q470 PolarHBondContact OE1-NE2 3.4Å; V468-Q470 PolarHBondContact O-N 3.21Å; Q470-T473 WeakPolarHBondContact CA-OG1 3.3Å; Q470-T473 PolarHBondContact O-OG1 3.43Å; Q470-K474 WeakPolarHBondContact O-CG 3.49Å; Q470-K474 PolarHBondContact O-N 2.82Å
471	S	68.6	Low	58.7	Low	43 Å²	43	112 Å²	112	30%	0.301	56%	0.555	S	S	.	*	H	α-helix	trans	-75.6	-29.5	176.6	82.2	0	0	0	0	112.6	Q467 V468 E469	Q467-S471 WeakPolarHBondContact O-CB 3.27Å; Q467-S471 PolarHBondContact O-N 3.25Å; Q467-S471 VanDerWaalsContact O-N 3.1Å; V468-S471 WeakPolarHBondContact O-CB 3.24Å; V468-S471 PolarHBondContact O-N 3.44Å; V468-S471 PolarHBondContact O-OG 3.4Å; E469-S471 VanDerWaalsContact C-N 3.29Å; E469-S471 PolarHBondContact O-N 2.96Å
472	W	69.4	Low	56.2	Low	37 Å²	37	113.2 Å²	113.2	14%	0.14	56%	0.564	C	S	.	*	H	α-helix	trans	-74.9	-46.5	174.4	-66.5	-26.3	0	0	0	111.7	P447 P449 V452 L457 V468 E469 K474 R475 D476	P447-W472 PolarHBondContact O-NE1 3.39Å; P449-W472 HydrophobicContact CB-CD2 4.35Å; P449-W472 HydrophobicContact CB-CE3 4.37Å; P449-W472 HydrophobicContact CB-CH2 4.33Å; P449-W472 HydrophobicContact CB-CZ2 4.3Å; P449-W472 HydrophobicContact CB-CZ3 4.36Å; P449-W472 HydrophobicContact CG-CD2 3.73Å; P449-W472 HydrophobicContact CG-CE3 4.13Å; P449-W472 HydrophobicContact CG-CG 3.93Å; P449-W472 HydrophobicContact CG-CZ2 4.33Å; V452-W472 HydrophobicContact CB-CH2 4.45Å; V452-W472 HydrophobicContact CB-CZ2 4.47Å; V452-W472 HydrophobicContact CG2-CH2 4.49Å; V452-W472 HydrophobicContact CG2-CZ2 4.04Å; L457-W472 HydrophobicContact CD1-CH2 4.46Å; L457-W472 HydrophobicContact CD2-CH2 4.03Å; L457-W472 HydrophobicContact CD2-CZ3 3.9Å; V468-W472 HydrophobicContact CG1-CD2 4.29Å; V468-W472 HydrophobicContact CG1-CE3 4.44Å; V468-W472 HydrophobicContact CG1-CH2 3.94Å; V468-W472 HydrophobicContact CG1-CZ2 3.75Å; V468-W472 HydrophobicContact CG1-CZ3 4.27Å; V468-W472 PolarHBondContact O-N 2.94Å; E469-W472 PolarHBondContact O-N 2.92Å; W472-K474 VanDerWaalsContact C-N 3.32Å; W472-K474 PolarHBondContact O-N 2.86Å; W472-R475 WeakPolarHBondContact O-CA 3.47Å; W472-R475 VanDerWaalsContact O-CB 3.24Å; W472-R475 WeakPolarHBondContact O-CB 3.45Å; W472-R475 PolarHBondContact O-N 3.39Å; W472-D476 PolarHBondContact O-N 3.43Å
473	T	58.6	Low	54.4	Low	88 Å²	88	121.1 Å²	121.1	54%	0.54	58%	0.579	S	S	.	*	H	α-helix	trans	-58.3	-40.4	177.8	22.6	0	0	0	0	112.8	E469 Q470 R475 D476	E469-T473 PolarHBondContact O-N 3.17Å; E469-T473 PolarHBondContact O-OG1 2.89Å; Q470-T473 WeakPolarHBondContact CA-OG1 3.3Å; Q470-T473 PolarHBondContact O-OG1 3.43Å; T473-R475 PolarHBondContact O-N 2.88Å; T473-R475 VanDerWaalsContact O-N 3.16Å; T473-D476 PolarHBondContact O-N 3.3Å
474	K	55.5	Low	52.6	Low	151 Å²	151	118.5 Å²	118.5	66%	0.657	58%	0.579	S	S	*	*	H	α-helix	trans	-65.3	-12.9	173.6	-75.6	175.9	179.5	168.4	0	114.8	Q470 W472	Q470-K474 WeakPolarHBondContact O-CG 3.49Å; Q470-K474 PolarHBondContact O-N 2.82Å; W472-K474 VanDerWaalsContact C-N 3.32Å; W472-K474 PolarHBondContact O-N 2.86Å
475	R	56.3	Low	51.4	Low	149 Å²	149	119.4 Å²	119.4	56%	0.562	59%	0.59	S	S	*	*	H	α-helix	trans	-89.2	-27.8	177.7	-146.3	170.3	-167.5	150.3	3.2	111.8	W472 T473	W472-R475 WeakPolarHBondContact O-CA 3.47Å; W472-R475 VanDerWaalsContact O-CB 3.24Å; W472-R475 WeakPolarHBondContact O-CB 3.45Å; W472-R475 PolarHBondContact O-N 3.39Å; T473-R475 PolarHBondContact O-N 2.88Å; T473-R475 VanDerWaalsContact O-N 3.16Å
476	D	47.5	Very low	48.8	Very low	137 Å²	137	121.6 Å²	121.6	73%	0.733	61%	0.608	S	S	*	*	H	α-helix	trans	-85.9	-14.2	-177.5	-68.6	-30.4	0	0	0	114.1	W472 T473 R478	W472-D476 PolarHBondContact O-N 3.43Å; T473-D476 PolarHBondContact O-N 3.3Å; D476-R478 VanDerWaalsContact C-N 3.26Å; D476-R478 PolarHBondContact O-N 2.79Å
477	E	37.5	Very low	46.5	Very low	163 Å²	163	123.1 Å²	123.1	76%	0.762	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	9.4	-179.6	-70.8	-171.3	140.2	0	0	115.5	P479	E477-P479 WeakPolarHBondContact O-CD 3.35Å
478	R	35.7	Very low	44.4	Very low	214 Å²	214	125.8 Å²	125.8	81%	0.808	63%	0.631	S	S	*	*	S	Bend	trans	-91.1	117.9	178.9	-71.7	-172.3	177.8	-172.3	-0	111.9	D476	D476-R478 VanDerWaalsContact C-N 3.26Å; D476-R478 PolarHBondContact O-N 2.79Å
479	P	34.8	Very low	42.3	Very low	129 Å²	129	131.8 Å²	131.8	84%	0.838	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-68.3	141.5	-177.9	-20.9	33.7	0	0	0	114.1	E477	E477-P479 WeakPolarHBondContact O-CD 3.35Å
480	N	31.8	Very low	39.9	Very low	153 Å²	153	133.1 Å²	133.1	82%	0.818	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-74.7	147.7	177	-81.9	-47.8	0	0	0	113.8
481	H	28.6	Very low	38	Very low	185 Å²	185	134.3 Å²	134.3	86%	0.856	70%	0.696	S	S	*	*			trans	-127.2	109.2	147	-100	2.8	0	0	0	111
482	C	26.1	Very low	36.2	Very low	107 Å²	107	138.4 Å²	138.4	72%	0.723	72%	0.721	S	S	*	*			trans	32.7	137.3	140.3	-60.6	0	0	0	0	119.9
483	R	24.6	Very low	34.1	Very low	234 Å²	234	148.1 Å²	148.1	88%	0.883	76%	0.758	S	S	*	*			cis	-163.6	139.5	9.8	-121.4	174.4	-173.3	177.3	0.4	109.1
484	S	30.5	Very low	33.2	Very low	110 Å²	110	149.3 Å²	149.3	77%	0.769	77%	0.768	S	S	*	*			trans	-80.2	176.4	158.2	-33	0	0	0	0	109
485	P	39.8	Very low	31.9	Very low	107 Å²	107	146.6 Å²	146.6	70%	0.695	77%	0.773	S	S	*	*			cis	-141.1	-167.2	39.5	47.9	-27.3	0	0	0	113.1
486	D	23.6	Very low	31.2	Very low	130 Å²	130	144.6 Å²	144.6	70%	0.695	78%	0.779	S	S	*	*			cis	-153.9	158.4	15.5	-128.1	-27.7	0	0	0	113.2
487	L	26.1	Very low	30.1	Very low	136 Å²	136	148.6 Å²	148.6	71%	0.712	79%	0.786	S	S	*	*			trans	15.9	137.2	148.9	-65	162.2	0	0	0	119.7
488	Q	25.6	Very low	29.7	Very low	184 Å²	184	144.9 Å²	144.9	86%	0.86	78%	0.783	S	S	*	*				-167.2	-176.9	56.1	-138.7	159.3	53.9	0	0	114.4
489	L	25.7	Very low	29.5	Very low	158 Å²	158	140.5 Å²	140.5	83%	0.827	78%	0.782	S	S	*	*			trans	-97.3	167	-159.2	-162	70.1	0	0	0	114.6
490	S	23.5	Very low	29.3	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	78%	0.777	S	S	*	*			trans	93.7	109.9	147.9	78.8	0	0	0	0	121
491	S	28.2	Very low	29.5	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	78%	0.782	S	S	*	*				38.9	164.7	128.4	49.2	0	0	0	0	123.5
492	P	31	Very low	30.3	Very low	128 Å²	128	131.5 Å²	131.5	83%	0.831	77%	0.768	S	S	*	*			cis	-131.6	-163	-17.4	34.2	-12.3	0	0	0	113.7
493	R	25.8	Very low	30.9	Very low	241 Å²	241	130.4 Å²	130.4	91%	0.909	76%	0.758	S	S	*	*			trans	-77.3	178.6	172	-122.3	-157.9	167.3	177.9	-2.7	112.2
494	P	39.7	Very low	31.9	Very low	114 Å²	114	122 Å²	122	74%	0.74	73%	0.73	S	S	*	*				-126.6	170	-127.4	41.1	-23.1	0	0	0	116.3
495	A	26.9	Very low	32.6	Very low	94 Å²	94	120.9 Å²	120.9	78%	0.777	72%	0.718	S	S	*	*			trans	-159.1	169.3	155.1	0	0	0	0	0	109.3
496	P	42.8	Very low	32.8	Very low	106 Å²	106	120.6 Å²	120.6	69%	0.688	71%	0.711	S	S	*	*				-111.8	178	-119.2	32.5	-16.2	0	0	0	114.6
497	Y	25	Very low	33.6	Very low	222 Å²	222	122.3 Å²	122.3	87%	0.871	72%	0.715	S	S	*	*			trans	140.8	144.5	142.8	-88.9	-83.5	0	0	0	115.6
498	A	27.4	Very low	34.2	Very low	84 Å²	84	123.1 Å²	123.1	69%	0.694	71%	0.713	S	S	*	*			trans	63.9	141.9	154.5	0	0	0	0	0	120.8
499	P	31.6	Very low	35	Very low	123 Å²	123	120.1 Å²	120.1	80%	0.799	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-76.9	139.1	166.5	32.9	-32.6	0	0	0	110.7
500	P	31.3	Very low	36	Very low	112 Å²	112	120.3 Å²	120.3	73%	0.727	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-76.7	158.3	177.7	31.7	-34.4	0	0	0	112.5
501	A	35.9	Very low	36.7	Very low	111 Å²	111	123 Å²	123	92%	0.917	71%	0.713	S	S	*	*	S	Bend	trans	-82.3	141.9	173.4	0	0	0	0	0	111.1
502	G	45.3	Very low	37.3	Very low	55 Å²	55	123.6 Å²	123.6	57%	0.567	71%	0.714	S	S	*	*			trans	151.7	0.8	178.5	0	0	0	0	0	116.7
503	T	39.1	Very low	37.8	Very low	84 Å²	84	125 Å²	125	52%	0.515	71%	0.714	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.8	123.9	-174.8	-56.8	0	0	0	0	113.6	V505 V518	T503-V505 HydrophobicContact CG2-CG2 4.05Å; T503-V518 HydrophobicContact CG2-CB 4.16Å; T503-V518 HydrophobicContact CG2-CG1 3.63Å; T503-V518 HydrophobicContact CG2-CG2 3.84Å
504	L	45	Very low	38.5	Very low	58 Å²	58	116.2 Å²	116.2	30%	0.304	69%	0.69	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.8	143.1	157.3	-77.9	179.6	0	0	0	110.5	L519 L521	L504-L519 PolarHBondContact O-N 2.82Å; L504-L521 HydrophobicContact CD1-CD1 3.7Å; L504-L521 HydrophobicContact CD1-CD2 4.39Å; L504-L521 HydrophobicContact CD1-CG 4.23Å; L504-L521 HydrophobicContact CG-CD1 4.24Å
505	V	46.1	Very low	38.5	Very low	85 Å²	85	117.1 Å²	117.1	52%	0.515	70%	0.696	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.9	112.8	174	-179.8	0	0	0	0	107.9	T503 V518	T503-V505 HydrophobicContact CG2-CG2 4.05Å; V505-V518 HydrophobicContact CG2-CG2 4.34Å
506	L	42.9	Very low	39.3	Very low	102 Å²	102	113.7 Å²	113.7	53%	0.534	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.8	131.7	174.9	-70.6	166.9	0	0	0	110.2	L519	L506-L519 HydrophobicContact CD1-CD1 4.4Å
507	Q	40.6	Very low	39.3	Very low	166 Å²	166	113.4 Å²	113.4	78%	0.776	66%	0.661	S	S	*	*			trans	-114.5	139.4	176.6	-75	-175.8	-36.4	0	0	110.9
508	F	38.7	Very low	40.2	Very low	153 Å²	153	107.6 Å²	107.6	67%	0.671	65%	0.649	S	S	*	*			trans	-89.4	135	176.2	-61.8	-79.2	0	0	0	111.1	N510	F508-N510 PolarHBondContact O-N 2.79Å
509	P	42.8	Very low	41.2	Very low	120 Å²	120	108 Å²	108	78%	0.779	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	83.2	178.9	31.9	-34.2	0	0	0	111.2
510	N	46.3	Very low	41.9	Very low	163 Å²	163	110.5 Å²	110.5	87%	0.872	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.7	16.2	145.8	-91.2	-18.2	0	0	0	115.8	F508	F508-N510 PolarHBondContact O-N 2.79Å
511	Q	38.1	Very low	42.7	Very low	152 Å²	152	108.2 Å²	108.2	71%	0.71	62%	0.621	S	S	*	*			trans	-137.7	118.3	169.5	-75.7	-172.1	-16.8	0	0	112
512	P	40.4	Very low	43.6	Very low	122 Å²	122	106.4 Å²	106.4	79%	0.792	60%	0.6	S	S	*	*	S	Bend	trans	-79.2	-13.7	-175.5	30.3	-34.6	0	0	0	115.2
513	D	41.8	Very low	44.1	Very low	158 Å²	158	108.8 Å²	108.8	85%	0.845	60%	0.6	S	S	*	*	S	Bend	trans	-123.5	59	-172.2	-71.6	-59.8	0	0	0	113.2
514	S	40.3	Very low	44.8	Very low	57 Å²	57	109 Å²	109	40%	0.399	59%	0.593	S	S	.	*	S	Bend	trans	-133	141.8	167.2	66.3	0	0	0	0	111.4	G516	S514-G516 PolarHBondContact O-N 3.02Å
515	P	39.8	Very low	45.4	Very low	133 Å²	133	111 Å²	111	86%	0.864	61%	0.613	S	S	*	*			trans	-72.7	111	174.1	29.2	-31.8	0	0	0	109.4
516	G	43.6	Very low	45.8	Very low	22 Å²	22	114 Å²	114	23%	0.227	62%	0.621	C	S	.	*			trans	-60.6	158	178.4	0	0	0	0	0	113.1	S514 V518	S514-G516 PolarHBondContact O-N 3.02Å; G516-V518 PolarHBondContact O-N 3.33Å
517	I	43.1	Very low	46.6	Very low	100 Å²	100	111.4 Å²	111.4	51%	0.513	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72	121.7	-178.6	-57.7	175	0	0	0	109	L519	I517-L519 HydrophobicContact CG2-CD1 3.74Å; I517-L519 HydrophobicContact CG2-CG 4.05Å
518	V	44.8	Very low	47.9	Very low	99 Å²	99	107.7 Å²	107.7	60%	0.6	60%	0.595	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.3	113	170	161.9	0	0	0	0	108.2	T503 V505 G516	T503-V518 HydrophobicContact CG2-CB 4.16Å; T503-V518 HydrophobicContact CG2-CG1 3.63Å; T503-V518 HydrophobicContact CG2-CG2 3.84Å; V505-V518 HydrophobicContact CG2-CG2 4.34Å; G516-V518 PolarHBondContact O-N 3.33Å
519	L	47.8	Very low	49.3	Very low	93 Å²	93	105.2 Å²	105.2	49%	0.487	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	130.9	173.9	-86.6	137.7	0	0	0	109.8	L504 L506 I517	L504-L519 PolarHBondContact O-N 2.82Å; L506-L519 HydrophobicContact CD1-CD1 4.4Å; I517-L519 HydrophobicContact CG2-CD1 3.74Å; I517-L519 HydrophobicContact CG2-CG 4.05Å
520	E	45.6	Very low	50.4	Low	175 Å²	175	105.8 Å²	105.8	82%	0.818	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.3	120	173.5	-165	167.3	-146.3	0	0	107.7
521	L	49.4	Very low	51.5	Low	65 Å²	65	102.4 Å²	102.4	34%	0.34	58%	0.576	S	S	.	*			trans	-79	136.8	-175.5	-74	174.7	0	0	0	111.3	L504 Y547	L504-L521 HydrophobicContact CD1-CD1 3.7Å; L504-L521 HydrophobicContact CD1-CD2 4.39Å; L504-L521 HydrophobicContact CD1-CG 4.23Å; L504-L521 HydrophobicContact CG-CD1 4.24Å; L521-Y547 HydrophobicContact CD1-CE2 4.3Å
522	P	55.5	Low	53.1	Low	73 Å²	73	96.4 Å²	96.4	47%	0.474	55%	0.547	S	S	.	.			trans	-68.8	176.6	171.2	30.2	-34.8	0	0	0	111.9	Y547	P522-Y547 WeakPolarHBondContact O-CE1 3.3Å; P522-Y547 PolarHBondContact O-OH 3.08Å
523	N	55.8	Low	54.7	Low	104 Å²	104	93.8 Å²	93.8	56%	0.556	54%	0.536	S	S	*	.			trans	-74.9	141.5	176.8	-165.4	-2	0	0	0	110.7	S525 Q526	N523-S525 PolarHBondContact O-N 2.84Å; N523-Q526 WeakPolarHBondContact O-CB 3.5Å; N523-Q526 PolarHBondContact O-N 3.38Å
524	F	53.2	Low	56.2	Low	88 Å²	88	90.2 Å²	90.2	39%	0.386	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-59.6	-27.1	-172.4	-161.4	-107.2	0	0	0	113.4	Q526 V527 F532 Y547	F524-Q526 PolarHBondContact O-N 2.98Å; F524-V527 PolarHBondContact O-N 3.29Å; F524-F532 HydrophobicContact CE2-CE2 4.4Å; F524-Y547 HydrophobicContact CB-CD1 3.82Å; F524-Y547 HydrophobicContact CB-CE1 3.77Å; F524-Y547 HydrophobicContact CB-CG 4.32Å; F524-Y547 HydrophobicContact CD2-CD1 4.07Å; F524-Y547 AromaticContact CD2-CD2 3.5Å; F524-Y547 HydrophobicContact CD2-CD2 3.5Å; F524-Y547 HydrophobicContact CD2-CE1 4.04Å; F524-Y547 AromaticContact CD2-CE2 3.51Å; F524-Y547 HydrophobicContact CD2-CE2 3.51Å; F524-Y547 AromaticContact CD2-CG 3.79Å; F524-Y547 HydrophobicContact CD2-CG 3.79Å; F524-Y547 AromaticContact CD2-CZ 3.77Å; F524-Y547 AromaticContact CE2-CD2 3.96Å; F524-Y547 HydrophobicContact CE2-CD2 3.96Å; F524-Y547 HydrophobicContact CE2-CE2 4.09Å; F524-Y547 HydrophobicContact CG-CD1 4.33Å; F524-Y547 HydrophobicContact CG-CD2 4.47Å; F524-Y547 HydrophobicContact CG-CE1 4.41Å; F524-Y547 HydrophobicContact CG-CG 4.35Å
525	S	56.3	Low	57.9	Low	102 Å²	102	90.6 Å²	90.6	71%	0.713	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-70.1	-1.7	174.6	37.4	0	0	0	0	115.1	N523	N523-S525 PolarHBondContact O-N 2.84Å
526	Q	55.4	Low	59.8	Low	146 Å²	146	87.6 Å²	87.6	68%	0.682	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-104.2	1.9	173.9	-59.7	178.6	-48.5	0	0	112.9	N523 F524	N523-Q526 WeakPolarHBondContact O-CB 3.5Å; N523-Q526 PolarHBondContact O-N 3.38Å; F524-Q526 PolarHBondContact O-N 2.98Å
527	V	59.9	Low	60.8	Low	48 Å²	48	94.2 Å²	94.2	29%	0.291	53%	0.529	S	S	.	.	S	Bend	trans	-92.5	126.7	179.9	-175.5	0	0	0	0	109.6	F524 F532	F524-V527 PolarHBondContact O-N 3.29Å; V527-F532 HydrophobicContact CG1-CB 4.14Å
528	D	68.5	Low	61.8	Low	89 Å²	89	96.4 Å²	96.4	48%	0.476	54%	0.537	S	S	.	.			trans	-65.9	124.3	176.4	-170.4	-49	0	0	0	110.6	D530 V531 F532	D528-D530 VanDerWaalsContact C-N 3.3Å; D528-D530 PolarHBondContact O-N 3.22Å; D528-D530 PolarHBondContact OD1-N 2.99Å; D528-V531 HydrophobicContact CB-CB 4.09Å; D528-V531 HydrophobicContact CB-CG2 3.81Å; D528-V531 PolarHBondContact O-N 3.09Å; D528-F532 PolarHBondContact O-N 2.68Å
529	P	66.6	Low	62.8	Low	100 Å²	100	95.5 Å²	95.5	65%	0.649	53%	0.528	S	S	*	.	H	α-helix	trans	-58.5	-36.7	-177	-25.2	34.7	0	0	0	114.2	F532 A533	P529-F532 PolarHBondContact O-N 2.94Å; P529-A533 WeakPolarHBondContact O-CB 3.38Å; P529-A533 PolarHBondContact O-N 3.4Å
530	D	66.6	Low	64	Low	132 Å²	132	92.6 Å²	92.6	71%	0.706	51%	0.512	S	S	*	.	H	α-helix	trans	-74.6	-35	-176.4	-70	-22.2	0	0	0	110.7	D528 A533 A534	D528-D530 VanDerWaalsContact C-N 3.3Å; D528-D530 PolarHBondContact O-N 3.22Å; D528-D530 PolarHBondContact OD1-N 2.99Å; D530-A533 PolarHBondContact O-N 2.94Å; D530-A534 WeakPolarHBondContact O-CB 3.36Å; D530-A534 PolarHBondContact O-N 3.32Å; D530-A534 VanDerWaalsContact O-N 3.15Å
531	V	68.9	Low	65.2	Low	92 Å²	92	88.3 Å²	88.3	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-67.9	-39.8	173.7	-179.5	0	0	0	0	111.1	D528 A534	D528-V531 HydrophobicContact CB-CB 4.09Å; D528-V531 HydrophobicContact CB-CG2 3.81Å; D528-V531 PolarHBondContact O-N 3.09Å; V531-A534 PolarHBondContact O-N 2.9Å
532	F	72.6	Confident	66.3	Low	27 Å²	27	90.5 Å²	90.5	12%	0.118	50%	0.503	C	S	.	.	H	α-helix	trans	-66.3	-40.5	175.8	-175.2	-98	0	0	0	112.2	F524 V527 D528 P529 A534 L535 Q540 L543 K544	F524-F532 HydrophobicContact CE2-CE2 4.4Å; V527-F532 HydrophobicContact CG1-CB 4.14Å; D528-F532 PolarHBondContact O-N 2.68Å; P529-F532 PolarHBondContact O-N 2.94Å; F532-A534 VanDerWaalsContact C-N 3.27Å; F532-A534 PolarHBondContact O-N 2.92Å; F532-L535 HydrophobicContact CD2-CD1 4.14Å; F532-L535 PolarHBondContact O-N 2.87Å; F532-Q540 HydrophobicContact CE1-CB 4.19Å; F532-Q540 HydrophobicContact CE1-CG 4.17Å; F532-Q540 HydrophobicContact CE2-CB 4.46Å; F532-Q540 HydrophobicContact CE2-CG 4.49Å; F532-Q540 HydrophobicContact CZ-CB 3.82Å; F532-Q540 HydrophobicContact CZ-CG 4.08Å; F532-Q540 PolarHBondContact O-NE2 3.48Å; F532-L543 HydrophobicContact CD2-CD2 4.29Å; F532-L543 HydrophobicContact CE2-CB 3.98Å; F532-L543 HydrophobicContact CE2-CD2 3.94Å; F532-K544 HydrophobicContact CZ-CG 4.12Å
533	A	72.4	Confident	66.9	Low	66 Å²	66	89.1 Å²	89.1	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-65.5	-27.9	177.5	0	0	0	0	0	113.4	P529 D530 L535 Q540	P529-A533 WeakPolarHBondContact O-CB 3.38Å; P529-A533 PolarHBondContact O-N 3.4Å; D530-A533 PolarHBondContact O-N 2.94Å; A533-L535 VanDerWaalsContact C-N 3.33Å; A533-Q540 PolarHBondContact O-NE2 3.35Å; A533-Q540 VanDerWaalsContact O-NE2 3.14Å
534	A	74.5	Confident	67.7	Low	84 Å²	84	88 Å²	88	69%	0.694	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.7	177.8	0	0	0	0	0	114.7	D530 V531 F532	D530-A534 WeakPolarHBondContact O-CB 3.36Å; D530-A534 PolarHBondContact O-N 3.32Å; D530-A534 VanDerWaalsContact O-N 3.15Å; V531-A534 PolarHBondContact O-N 2.9Å; F532-A534 VanDerWaalsContact C-N 3.27Å; F532-A534 PolarHBondContact O-N 2.92Å
535	L	75.4	Confident	68.3	Low	65 Å²	65	86.5 Å²	86.5	34%	0.34	48%	0.482	S	S	.	.	S	Bend	trans	-73.8	150.5	178.9	-69.9	171.1	0	0	0	112.6	F532 A533 Q540	F532-L535 HydrophobicContact CD2-CD1 4.14Å; F532-L535 PolarHBondContact O-N 2.87Å; A533-L535 VanDerWaalsContact C-N 3.33Å; L535-Q540 HydrophobicContact CB-CG 3.86Å; L535-Q540 PolarHBondContact O-NE2 2.84Å
536	P	79.8	Confident	68.9	Low	69 Å²	69	82.8 Å²	82.8	45%	0.448	46%	0.457	S	S	.	.			trans	-53.3	143.9	167.7	-25.1	34.2	0	0	0	112.2	E538 L539 Q540	P536-E538 VanDerWaalsContact C-N 3.27Å; P536-E538 PolarHBondContact O-N 2.98Å; P536-L539 HydrophobicContact CG-CD1 4.38Å; P536-L539 PolarHBondContact O-N 3.18Å; P536-L539 VanDerWaalsContact O-N 3.08Å; P536-Q540 PolarHBondContact O-N 3.23Å; P536-Q540 VanDerWaalsContact O-N 3.12Å
537	K	64.2	Low	69.3	Low	162 Å²	162	77.8 Å²	77.8	70%	0.704	43%	0.433	S	S	*	.	H	α-helix	trans	-60.5	-35.2	-173	-73.9	-172	175.7	-177.7	0	113	L539 Q540 D541	K537-L539 VanDerWaalsContact C-N 3.3Å; K537-L539 PolarHBondContact O-N 3.03Å; K537-Q540 PolarHBondContact O-N 3.09Å; K537-D541 PolarHBondContact O-N 3.2Å; K537-D541 VanDerWaalsContact O-N 3.14Å
538	E	64.3	Low	69.3	Low	146 Å²	146	79.5 Å²	79.5	68%	0.682	45%	0.447	S	S	*	.	H	α-helix	trans	-58.8	-43.2	177	-58.1	82.8	-171.5	0	0	111.5	P536 E542	P536-E538 VanDerWaalsContact C-N 3.27Å; P536-E538 PolarHBondContact O-N 2.98Å; E538-E542 WeakPolarHBondContact O-CB 3.33Å; E538-E542 PolarHBondContact O-N 3.05Å; E538-E542 VanDerWaalsContact O-N 3.08Å
539	L	65.8	Low	68.7	Low	80 Å²	80	84.8 Å²	84.8	42%	0.419	46%	0.46	S	S	.	.	H	α-helix	trans	-75.7	-32.3	-178.9	-63.7	178.4	0	0	0	112.7	P536 K537 D541 L543	P536-L539 HydrophobicContact CG-CD1 4.38Å; P536-L539 PolarHBondContact O-N 3.18Å; P536-L539 VanDerWaalsContact O-N 3.08Å; K537-L539 VanDerWaalsContact C-N 3.3Å; K537-L539 PolarHBondContact O-N 3.03Å; L539-D541 VanDerWaalsContact C-N 3.35Å; L539-L543 PolarHBondContact O-N 3.45Å
540	Q	72.8	Confident	68.1	Low	31 Å²	31	83.9 Å²	83.9	15%	0.145	46%	0.461	C	S	.	.	H	α-helix	trans	-62.3	-42.9	173	-67.9	-172.4	22.4	0	0	111.6	F532 A533 L535 P536 K537 K544	F532-Q540 HydrophobicContact CE1-CB 4.19Å; F532-Q540 HydrophobicContact CE1-CG 4.17Å; F532-Q540 HydrophobicContact CE2-CB 4.46Å; F532-Q540 HydrophobicContact CE2-CG 4.49Å; F532-Q540 HydrophobicContact CZ-CB 3.82Å; F532-Q540 HydrophobicContact CZ-CG 4.08Å; F532-Q540 PolarHBondContact O-NE2 3.48Å; A533-Q540 PolarHBondContact O-NE2 3.35Å; A533-Q540 VanDerWaalsContact O-NE2 3.14Å; L535-Q540 HydrophobicContact CB-CG 3.86Å; L535-Q540 PolarHBondContact O-NE2 2.84Å; P536-Q540 PolarHBondContact O-N 3.23Å; P536-Q540 VanDerWaalsContact O-N 3.12Å; K537-Q540 PolarHBondContact O-N 3.09Å; Q540-K544 VanDerWaalsContact O-CG 3.26Å; Q540-K544 WeakPolarHBondContact O-CG 3.39Å; Q540-K544 PolarHBondContact O-N 3.27Å
541	D	71.8	Confident	67.2	Low	86 Å²	86	85.9 Å²	85.9	46%	0.46	47%	0.466	S	S	.	.	H	α-helix	trans	-78.2	-30.4	-176.6	-67.9	-18.7	0	0	0	112.1	K537 L539 K544 S545	K537-D541 PolarHBondContact O-N 3.2Å; K537-D541 VanDerWaalsContact O-N 3.14Å; L539-D541 VanDerWaalsContact C-N 3.35Å; D541-K544 IonicContact OD1-NZ 2.79Å; D541-K544 PolarHBondContact OD1-NZ 2.67Å; D541-S545 VanDerWaalsContact O-CB 3.28Å; D541-S545 WeakPolarHBondContact O-CB 3.23Å; D541-S545 PolarHBondContact O-N 3.1Å; D541-S545 PolarHBondContact O-OG 3.5Å
542	E	72.8	Confident	66	Low	111 Å²	111	88.4 Å²	88.4	52%	0.519	48%	0.476	S	S	.	.	H	α-helix	trans	-64.6	-44.4	168.7	-170.3	169.5	-164.7	0	0	111.9	E538 S545 A546	E538-E542 WeakPolarHBondContact O-CB 3.33Å; E538-E542 PolarHBondContact O-N 3.05Å; E538-E542 VanDerWaalsContact O-N 3.08Å; E542-S545 WeakPolarHBondContact O-CB 3.41Å; E542-S545 PolarHBondContact O-N 3.42Å; E542-A546 PolarHBondContact O-N 3.28Å
543	L	67.9	Low	64.6	Low	43 Å²	43	93.2 Å²	93.2	23%	0.225	51%	0.507	C	S	.	.	H	α-helix	trans	-61.3	-51	174	-108.9	80.6	0	0	0	111.9	F532 L539 S545 A546 Y547	F532-L543 HydrophobicContact CD2-CD2 4.29Å; F532-L543 HydrophobicContact CE2-CB 3.98Å; F532-L543 HydrophobicContact CE2-CD2 3.94Å; L539-L543 PolarHBondContact O-N 3.45Å; L543-S545 PolarHBondContact O-N 3.43Å; L543-A546 WeakPolarHBondContact O-CB 3.46Å; L543-A546 PolarHBondContact O-N 2.75Å; L543-Y547 HydrophobicContact CD2-CE2 4.2Å; L543-Y547 HydrophobicContact CG-CE2 4.32Å; L543-Y547 VanDerWaalsContact O-CD2 3.3Å; L543-Y547 WeakPolarHBondContact O-CD2 3.22Å; L543-Y547 PolarHBondContact O-N 3.04Å
544	K	71.1	Confident	62.6	Low	80 Å²	80	99.1 Å²	99.1	35%	0.348	52%	0.524	S	S	.	.	H	α-helix	trans	-53.4	-44.6	177.5	-71.4	165	-157	158.2	0	110.7	F532 Q540 D541 A546 Y547 S548	F532-K544 HydrophobicContact CZ-CG 4.12Å; Q540-K544 VanDerWaalsContact O-CG 3.26Å; Q540-K544 WeakPolarHBondContact O-CG 3.39Å; Q540-K544 PolarHBondContact O-N 3.27Å; D541-K544 IonicContact OD1-NZ 2.79Å; D541-K544 PolarHBondContact OD1-NZ 2.67Å; K544-A546 VanDerWaalsContact C-N 3.33Å; K544-A546 PolarHBondContact O-N 2.88Å; K544-Y547 PolarHBondContact O-N 3.39Å; K544-S548 WeakPolarHBondContact O-CB 3.4Å; K544-S548 PolarHBondContact O-N 2.96Å; K544-S548 PolarHBondContact O-OG 3.42Å
545	S	67.7	Low	61	Low	57 Å²	57	100.6 Å²	100.6	40%	0.399	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-35.3	177.8	-61.7	0	0	0	0	113.4	D541 E542 L543 R549	D541-S545 VanDerWaalsContact O-CB 3.28Å; D541-S545 WeakPolarHBondContact O-CB 3.23Å; D541-S545 PolarHBondContact O-N 3.1Å; D541-S545 PolarHBondContact O-OG 3.5Å; E542-S545 WeakPolarHBondContact O-CB 3.41Å; E542-S545 PolarHBondContact O-N 3.42Å; L543-S545 PolarHBondContact O-N 3.43Å; S545-R549 WeakPolarHBondContact O-CG 3.47Å; S545-R549 PolarHBondContact O-N 3.26Å
546	A	67.6	Low	58.7	Low	24 Å²	24	107.1 Å²	107.1	20%	0.198	56%	0.555	C	S	.	*	H	α-helix	trans	-69.6	-48.1	176.1	0	0	0	0	0	112	E542 L543 K544 S548 R549 A550	E542-A546 PolarHBondContact O-N 3.28Å; L543-A546 WeakPolarHBondContact O-CB 3.46Å; L543-A546 PolarHBondContact O-N 2.75Å; K544-A546 VanDerWaalsContact C-N 3.33Å; K544-A546 PolarHBondContact O-N 2.88Å; A546-S548 PolarHBondContact O-N 3.39Å; A546-R549 PolarHBondContact O-N 2.93Å; A546-A550 PolarHBondContact O-N 3.13Å
547	Y	65.1	Low	56.3	Low	42 Å²	42	109.9 Å²	109.9	17%	0.165	57%	0.57	C	S	.	*	H	α-helix	trans	-66.9	-35.7	178.6	-75.3	-82.2	0	0	0	112.8	L521 P522 F524 L543 K544 R549 A550 H551	L521-Y547 HydrophobicContact CD1-CE2 4.3Å; P522-Y547 WeakPolarHBondContact O-CE1 3.3Å; P522-Y547 PolarHBondContact O-OH 3.08Å; F524-Y547 HydrophobicContact CB-CD1 3.82Å; F524-Y547 HydrophobicContact CB-CE1 3.77Å; F524-Y547 HydrophobicContact CB-CG 4.32Å; F524-Y547 HydrophobicContact CD2-CD1 4.07Å; F524-Y547 AromaticContact CD2-CD2 3.5Å; F524-Y547 HydrophobicContact CD2-CD2 3.5Å; F524-Y547 HydrophobicContact CD2-CE1 4.04Å; F524-Y547 AromaticContact CD2-CE2 3.51Å; F524-Y547 HydrophobicContact CD2-CE2 3.51Å; F524-Y547 AromaticContact CD2-CG 3.79Å; F524-Y547 HydrophobicContact CD2-CG 3.79Å; F524-Y547 AromaticContact CD2-CZ 3.77Å; F524-Y547 AromaticContact CE2-CD2 3.96Å; F524-Y547 HydrophobicContact CE2-CD2 3.96Å; F524-Y547 HydrophobicContact CE2-CE2 4.09Å; F524-Y547 HydrophobicContact CG-CD1 4.33Å; F524-Y547 HydrophobicContact CG-CD2 4.47Å; F524-Y547 HydrophobicContact CG-CE1 4.41Å; F524-Y547 HydrophobicContact CG-CG 4.35Å; L543-Y547 HydrophobicContact CD2-CE2 4.2Å; L543-Y547 HydrophobicContact CG-CE2 4.32Å; L543-Y547 VanDerWaalsContact O-CD2 3.3Å; L543-Y547 WeakPolarHBondContact O-CD2 3.22Å; L543-Y547 PolarHBondContact O-N 3.04Å; K544-Y547 PolarHBondContact O-N 3.39Å; Y547-R549 PolarHBondContact O-N 3.32Å; Y547-A550 PolarHBondContact O-N 3.48Å; Y547-A550 VanDerWaalsContact O-N 3.12Å; Y547-H551 PolarHBondContact O-N 3.16Å
548	S	58.8	Low	54.5	Low	83 Å²	83	111.2 Å²	111.2	58%	0.58	58%	0.576	S	S	*	*	H	α-helix	trans	-62.1	-29	174.6	-61.9	0	0	0	0	113.5	K544 A546	K544-S548 WeakPolarHBondContact O-CB 3.4Å; K544-S548 PolarHBondContact O-N 2.96Å; K544-S548 PolarHBondContact O-OG 3.42Å; A546-S548 PolarHBondContact O-N 3.39Å
549	R	56.8	Low	52.5	Low	200 Å²	200	112.9 Å²	112.9	76%	0.755	59%	0.586	S	S	*	*	H	α-helix	trans	-73.8	-30.9	174.6	-68.2	172.2	-161.4	174.6	7.7	112.6	S545 A546 Y547	S545-R549 WeakPolarHBondContact O-CG 3.47Å; S545-R549 PolarHBondContact O-N 3.26Å; A546-R549 PolarHBondContact O-N 2.93Å; Y547-R549 PolarHBondContact O-N 3.32Å
550	A	52.6	Low	50.6	Low	81 Å²	81	113.5 Å²	113.5	67%	0.669	60%	0.603	S	S	*	*	H	α-helix	trans	-72.5	-31.4	179.9	0	0	0	0	0	113	A546 Y547 N552	A546-A550 PolarHBondContact O-N 3.13Å; Y547-A550 PolarHBondContact O-N 3.48Å; Y547-A550 VanDerWaalsContact O-N 3.12Å; A550-N552 PolarHBondContact O-N 3.04Å
551	H	48.1	Very low	48.3	Very low	174 Å²	174	119.4 Å²	119.4	81%	0.806	63%	0.63	S	S	*	*	S	Bend	trans	-81.5	-10.2	-171.5	-147	-43.9	0	0	0	114.7	Y547 V553	Y547-H551 PolarHBondContact O-N 3.16Å; H551-V553 PolarHBondContact O-N 3.19Å
552	N	43.6	Very low	46.2	Very low	146 Å²	146	121.3 Å²	121.3	78%	0.781	64%	0.637	S	S	*	*			trans	-99.3	32.1	-165.6	-149.2	6.9	0	0	0	114.6	A550	A550-N552 PolarHBondContact O-N 3.04Å
553	V	42.8	Very low	43.9	Very low	127 Å²	127	124.4 Å²	124.4	77%	0.77	65%	0.648	S	S	*	*			trans	-130.3	94.6	178.3	-174.3	0	0	0	0	111	H551	H551-V553 PolarHBondContact O-N 3.19Å
554	Q	30.5	Very low	42.2	Very low	191 Å²	191	130 Å²	130	89%	0.893	68%	0.678	S	S	*	*			trans	-134.1	155	158.4	-95.6	-165.4	-5.1	0	0	110.4
555	P	40.8	Very low	40.4	Very low	115 Å²	115	131.7 Å²	131.7	75%	0.747	70%	0.698	S	S	*	*			trans	-95.9	153.9	-158	36.3	-35.8	0	0	0	114.9
556	Q	28.3	Very low	38.4	Very low	201 Å²	201	136.2 Å²	136.2	94%	0.939	72%	0.716	S	S	*	*			trans	-122.8	151.2	162.2	-93.4	-167.8	-15.6	0	0	112.1
557	V	28.4	Very low	36.6	Very low	128 Å²	128	141.8 Å²	141.8	78%	0.776	74%	0.742	S	S	*	*			trans	-123.8	132.7	-170.1	-179.4	0	0	0	0	109.7
558	K	25.8	Very low	34.7	Very low	190 Å²	190	147.5 Å²	147.5	83%	0.826	77%	0.77	S	S	*	*			trans	167.2	122.6	130.4	-93.4	173.2	-177	-178.2	0	115.7
559	M	23.9	Very low	33.2	Very low	180 Å²	180	150.8 Å²	150.8	89%	0.887	78%	0.781	S	S	*	*			trans	63.1	147.6	130.5	-70.5	-166.9	141.8	0	0	125.5
560	A	25.2	Very low	31.7	Very low	93 Å²	93	150.7 Å²	150.7	77%	0.769	79%	0.786	S	S	*	*			trans	75.8	145.9	155.4	0	0	0	0	0	118.8
561	E	25.2	Very low	30.5	Very low	155 Å²	155	155.3 Å²	155.3	72%	0.724	79%	0.793	S	S	*	*			cis	-161.4	154.7	-20.2	-117.4	-161.4	124.2	0	0	111.4
562	Q	26.3	Very low	30.2	Very low	127 Å²	127	152.5 Å²	152.5	59%	0.593	79%	0.791	S	S	*	*			trans	58.2	142.6	147.2	-68.8	-169.7	26	0	0	125.3
563	K	25	Very low	29.3	Very low	176 Å²	176	150.3 Å²	150.3	77%	0.765	79%	0.793	S	S	*	*			trans	83.1	100.6	146.9	-76.3	155.8	177.6	151.6	0	120.9
564	N	32.6	Very low	28.5	Very low	159 Å²	159	149.2 Å²	149.2	85%	0.85	80%	0.797	S	S	*	*			trans	-76.2	153.8	136.2	-77.8	-42.2	0	0	0	109.7
565	P	32.3	Very low	28.3	Very low	117 Å²	117	143 Å²	143	76%	0.76	78%	0.784	S	S	*	*				-145.4	142.7	107.7	35	-18.9	0	0	0	116.8
566	L	27	Very low	27.6	Very low	151 Å²	151	145.1 Å²	145.1	79%	0.791	80%	0.795	S	S	*	*			trans	43.5	120.6	138.9	-101.1	66.7	0	0	0	123.6
567	L	28.9	Very low	27.5	Very low	142 Å²	142	139 Å²	139	74%	0.743	79%	0.786	S	S	*	*				73.8	139.5	125.3	-80.4	175.1	0	0	0	124.3
568	Q	25.3	Very low	27.6	Very low	161 Å²	161	139.9 Å²	139.9	75%	0.752	79%	0.792	S	S	*	*			trans	85	103.8	147.2	-74.1	175.2	31.2	0	0	122.6
569	L	28.3	Very low	27.7	Very low	152 Å²	152	134.1 Å²	134.1	80%	0.796	79%	0.786	S	S	*	*				54.8	97.9	110.4	-165	87.1	0	0	0	120.2
570	K	24.7	Very low	28	Very low	198 Å²	198	136.6 Å²	136.6	86%	0.861	79%	0.785	S	S	*	*				173.4	145.1	124.2	-104.9	175.5	176.2	175.6	0	114.7
571	Q	27.5	Very low	28.2	Very low	178 Å²	178	138.2 Å²	138.2	83%	0.832	78%	0.78	S	S	*	*			trans	-83.1	170.9	153.2	-76.6	-174.4	-0.9	0	0	109.2
572	P	41.3	Very low	28.5	Very low	116 Å²	116	138.4 Å²	138.4	75%	0.753	78%	0.779	S	S	*	*			cis	-153.7	-168.3	32.6	43.9	-21.4	0	0	0	118.8
573	A	24.5	Very low	28.7	Very low	100 Å²	100	143 Å²	143	83%	0.826	79%	0.791	S	S	*	*			trans	69.2	148.3	161.6	0	0	0	0	0	116.2
574	A	26.7	Very low	28.7	Very low	104 Å²	104	146.4 Å²	146.4	86%	0.86	80%	0.799	S	S	*	*			cis	173.9	153.6	-10.6	0	0	0	0	0	103.2
575	G	25.7	Very low	28.7	Very low	60 Å²	60	150.8 Å²	150.8	62%	0.619	81%	0.805	S	S	*	*			cis	-174.2	-156	2.2	0	0	0	0	0	109.4
576	T	27.4	Very low	28.5	Very low	160 Å²	160	153.4 Å²	153.4	98%	0.982	81%	0.805	S	S	*	*			trans	57.9	131.4	177.1	38.1	0	0	0	0	115.9
577	G	26.1	Very low	28.6	Very low	72 Å²	72	158.5 Å²	158.5	74%	0.742	81%	0.813	S	S	*	*			cis	154.3	157.4	16.4	0	0	0	0	0	104.5
578	V	29.7	Very low	28.6	Very low	147 Å²	147	160.2 Å²	160.2	89%	0.891	82%	0.815	S	S	*	*			cis	-160.8	136.2	21.9	167	0	0	0	0	109.6
579	G	28.1	Very low	28.7	Very low	68 Å²	68	160.5 Å²	160.5	70%	0.701	82%	0.821	S	S	*	*			trans	64.6	152.8	144.9	0	0	0	0	0	120.8
580	R	30.1	Very low	28.7	Very low	232 Å²	232	156.8 Å²	156.8	88%	0.875	82%	0.82	S	S	*	*			cis	-147.4	142.6	2.2	-81.9	-179.3	166.6	173.4	-3.5	111.2
581	L	30.5	Very low	29	Very low	128 Å²	128	154 Å²	154	67%	0.67	82%	0.819	S	S	*	*			trans	26	147.4	130.3	-69.4	63.8	0	0	0	119.3
582	K	30.2	Very low	29.2	Very low	159 Å²	159	150.4 Å²	150.4	69%	0.691	81%	0.814	S	S	*	*			cis	-168.9	168.5	1.4	-105.8	167.7	-172.3	165.3	0	104.9
583	R	30.4	Very low	29.4	Very low	224 Å²	224	150.6 Å²	150.6	85%	0.845	82%	0.815	S	S	*	*			cis	-162	139.1	17.9	-130.4	163.5	-177.8	166.9	-2.8	107.7
584	R	26.6	Very low	29.7	Very low	247 Å²	247	152 Å²	152	93%	0.932	81%	0.813	S	S	*	*			trans	-117.5	143.8	164.3	-105.7	-176.1	176.1	-176.4	-0.4	109.4
585	Y	31.9	Very low	29.8	Very low	250 Å²	250	156.3 Å²	156.3	98%	0.98	81%	0.812	S	S	*	*			trans	-73.7	154.7	175.8	-103.5	-89.7	0	0	0	112.2
586	K	28.3	Very low	30	Very low	173 Å²	173	163.2 Å²	163.2	75%	0.752	83%	0.825	S	S	*	*			trans	-125.6	117.6	-159	-171.1	178.2	-171.7	173.2	0	110.8
587	R	28.3	Very low	29.9	Very low	258 Å²	258	158.6 Å²	158.6	97%	0.974	81%	0.809	S	S	*	*			trans	-89.8	139.1	157.9	-93.8	-175.9	171.6	176.8	-1.9	108.6
588	K	29.3	Very low	30	Very low	178 Å²	178	162.2 Å²	162.2	77%	0.774	82%	0.817	S	S	*	*			trans	-135.2	113.5	-178.4	-161.5	-172.6	-176.9	-164.3	0	109.3
589	N	27.2	Very low	29.9	Very low	166 Å²	166	159.9 Å²	159.9	89%	0.888	81%	0.807	S	S	*	*			trans	-85.6	153.5	162.4	-77.4	-2.3	0	0	0	109.4
590	G	28.8	Very low	30.7	Very low	75 Å²	75	162.7 Å²	162.7	77%	0.773	81%	0.813	S	S	*	*			trans	-138.8	156.6	172.9	0	0	0	0	0	110
591	V	29.6	Very low	30.8	Very low	139 Å²	139	158.7 Å²	158.7	84%	0.842	81%	0.808	S	S	*	*			trans	-113.1	140.9	-160.4	170.7	0	0	0	0	112.4
592	S	33.5	Very low	30.8	Very low	103 Å²	103	161.4 Å²	161.4	72%	0.72	82%	0.815	S	S	*	*			trans	10.8	156.6	146.8	-39.6	0	0	0	0	121
593	P	44.1	Very low	30.6	Very low	119 Å²	119	162.9 Å²	162.9	77%	0.773	82%	0.816	S	S	*	*				-156.9	146.8	68.9	39.5	-16.8	0	0	0	121.7
594	V	30.6	Very low	30.5	Very low	129 Å²	129	161.1 Å²	161.1	78%	0.782	81%	0.809	S	S	*	*			trans	46.8	124.4	130.5	-174.4	0	0	0	0	123
595	K	29.9	Very low	30.6	Very low	195 Å²	195	156.3 Å²	156.3	85%	0.848	80%	0.798	S	S	*	*				-170.2	124.2	125	-107.1	169.9	-173.9	176.9	0	116.7
596	K	28.9	Very low	30.3	Very low	206 Å²	206	148.2 Å²	148.2	90%	0.896	78%	0.782	S	S	*	*			trans	22.3	142.7	146.4	-58.2	-175.8	176.4	-174	0	123.8
597	G	26.4	Very low	30.2	Very low	62 Å²	62	145.9 Å²	145.9	64%	0.639	78%	0.783	S	S	*	*			trans	130.4	84.9	146.7	0	0	0	0	0	116.5
598	T	27.7	Very low	30.1	Very low	148 Å²	148	141.2 Å²	141.2	91%	0.908	78%	0.777	S	S	*	*				71.4	121.8	102.4	50.8	0	0	0	0	118.3
599	S	28.3	Very low	30.1	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	78%	0.779	S	S	*	*			trans	-86.3	168.6	169.6	-179.2	0	0	0	0	111.5
600	P	43.7	Very low	30.9	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	78%	0.778	S	S	*	*				-142.4	175.5	106.3	37	-22.2	0	0	0	116
601	L	32.2	Very low	30.9	Very low	148 Å²	148	137.4 Å²	137.4	78%	0.775	78%	0.776	S	S	*	*			trans	-95.6	173.5	-177.2	-65.4	96	0	0	0	114.4
602	K	30.3	Very low	31.1	Very low	185 Å²	185	140.2 Å²	140.2	80%	0.804	78%	0.777	S	S	*	*			trans	92	115.1	136.6	-96.5	176.1	179.3	172.4	0	120.5
603	R	27	Very low	30.6	Very low	190 Å²	190	147.3 Å²	147.3	72%	0.717	79%	0.788	S	S	*	*				108.1	126.1	106.6	-167.9	176.7	-150.8	-154.7	7.9	119.9
604	R	27.8	Very low	30	Very low	187 Å²	187	148.3 Å²	148.3	71%	0.706	79%	0.792	S	S	*	*			trans	71	159.1	152	-83.3	-176.2	170.4	-164.6	-5.5	118.8
605	Q	27.8	Very low	30.5	Very low	147 Å²	147	147.5 Å²	147.5	69%	0.687	79%	0.789	S	S	*	*			cis	-167.2	145.4	-31.2	-134.1	173.5	-22.7	0	0	110
606	A	27.1	Very low	31.3	Very low	80 Å²	80	143.3 Å²	143.3	66%	0.661	78%	0.782	S	S	*	*			trans	75.8	143.2	142	0	0	0	0	0	124.9
607	T	25.8	Very low	31.4	Very low	124 Å²	124	140.7 Å²	140.7	76%	0.761	78%	0.776	S	S	*	*			trans	95.6	123.3	146.7	64.1	0	0	0	0	124.1
608	N	25.9	Very low	31.5	Very low	159 Å²	159	146.8 Å²	146.8	85%	0.85	79%	0.785	S	S	*	*			trans	85.9	133.8	140.9	-60.7	-6.4	0	0	0	123.7
609	S	30.3	Very low	32.1	Very low	117 Å²	117	145 Å²	145	82%	0.818	78%	0.776	S	S	*	*			trans	-91.4	-178.3	173.7	-32	0	0	0	0	111.3
610	P	43.1	Very low	32	Very low	133 Å²	133	148.4 Å²	148.4	86%	0.864	78%	0.781	S	S	*	*				-154.9	-165.3	57	41.8	-16.8	0	0	0	119.1
611	A	28.9	Very low	31.1	Very low	90 Å²	90	150.9 Å²	150.9	74%	0.744	78%	0.781	S	S	*	*			trans	-65.6	160.6	-162.5	0	0	0	0	0	124.3
612	K	33.1	Very low	31.6	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	78%	0.779	S	S	*	*			trans	38.3	128.8	140.5	-71.3	-177	173.2	179.6	0	123.2
613	R	24.1	Very low	31.4	Very low	252 Å²	252	144.5 Å²	144.5	95%	0.951	78%	0.776	S	S	*	*				178.3	173.5	116.6	-99.4	180	-173.5	-123.5	4.5	115
614	V	31.8	Very low	31.3	Very low	139 Å²	139	143.1 Å²	143.1	84%	0.842	78%	0.782	S	S	*	*			trans	-150.2	134.7	-158.4	172.5	0	0	0	0	111.5
615	P	40.9	Very low	31.4	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	78%	0.784	S	S	*	*				-159	-147.5	107.9	46	-25	0	0	0	112.8
616	P	45.6	Very low	31.7	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	79%	0.788	S	S	*	*			cis	-136.6	136.1	-25.2	33.6	-12.7	0	0	0	119
617	I	32.5	Very low	31.7	Very low	151 Å²	151	144 Å²	144	77%	0.774	80%	0.796	S	S	*	*				51.5	120.8	110.1	-69.1	174.6	0	0	0	126.3
618	K	27.1	Very low	31.6	Very low	189 Å²	189	143.3 Å²	143.3	82%	0.822	79%	0.792	S	S	*	*			trans	72.3	165.5	136.9	-79.5	-174.4	-177.5	-172.7	0	124
619	P	41.7	Very low	31.6	Very low	110 Å²	110	144 Å²	144	71%	0.714	79%	0.79	S	S	*	*			cis	-142.3	163.9	20.1	42.3	-21.8	0	0	0	123.5
620	Q	25.7	Very low	31.5	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	79%	0.792	S	S	*	*			trans	52.4	114.8	144.6	-71.9	175.9	-76.3	0	0	127.7
621	E	24.5	Very low	30.8	Very low	177 Å²	177	147.7 Å²	147.7	83%	0.827	79%	0.79	S	S	*	*				33.9	165.4	108.8	-96.3	-178.8	173.6	0	0	124.9
622	P	42.8	Very low	31.2	Very low	111 Å²	111	149.1 Å²	149.1	72%	0.721	79%	0.792	S	S	*	*			cis	-143.6	-173.2	-6.2	38	-15.9	0	0	0	118.9
623	A	25.7	Very low	30.8	Very low	89 Å²	89	144.8 Å²	144.8	74%	0.736	79%	0.786	S	S	*	*			trans	76.9	137.9	154.2	0	0	0	0	0	120
624	N	24.8	Very low	30.9	Very low	160 Å²	160	138.6 Å²	138.6	86%	0.856	78%	0.777	S	S	*	*			cis	-167.6	170	35.5	-133	-10.9	0	0	0	113.2
625	V	30.3	Very low	30.8	Very low	124 Å²	124	136.4 Å²	136.4	75%	0.752	77%	0.767	S	S	*	*			trans	-141.8	138.7	178.3	174.3	0	0	0	0	111.8
626	P	34.9	Very low	30.2	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	77%	0.768	S	S	*	*				-137	150	122.1	17.9	4.6	0	0	0	112
627	K	25.9	Very low	29.4	Very low	191 Å²	191	141.8 Å²	141.8	83%	0.83	77%	0.773	S	S	*	*				57.3	131.3	67	-67.3	-170	174.9	-175.3	0	112.4
628	T	25.1	Very low	29	Very low	110 Å²	110	141.8 Å²	141.8	68%	0.675	78%	0.775	S	S	*	*			cis	-163.5	156.5	29.5	-40.3	0	0	0	0	112
629	E	25.6	Very low	29.1	Very low	172 Å²	172	138.3 Å²	138.3	80%	0.804	77%	0.77	S	S	*	*			trans	72.1	147	141.7	-96.3	159.5	-148.4	0	0	127.3
630	M	27	Very low	28.4	Very low	173 Å²	173	138.3 Å²	138.3	85%	0.852	77%	0.767	S	S	*	*			trans	72.6	123.4	152.7	-69.9	179.3	102	0	0	123.9
631	N	28.9	Very low	28.5	Very low	155 Å²	155	137.4 Å²	137.4	83%	0.829	77%	0.773	S	S	*	*			trans	-66.5	151.7	154.3	-81.2	-18.5	0	0	0	110.4
632	P	36.8	Very low	28.8	Very low	121 Å²	121	133.1 Å²	133.1	79%	0.786	76%	0.763	S	S	*	*				-149.6	152.6	78.4	38.1	-18.8	0	0	0	118.7
633	S	25.4	Very low	28.2	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	77%	0.765	S	S	*	*			trans	28.1	140.1	141.2	-156.3	0	0	0	0	123.8
634	T	26.8	Very low	28.4	Very low	122 Å²	122	136.4 Å²	136.4	75%	0.748	77%	0.771	S	S	*	*			trans	95.7	121.4	140.6	-0	0	0	0	0	122.1
635	S	28.4	Very low	28.6	Very low	93 Å²	93	138.3 Å²	138.3	65%	0.65	77%	0.772	S	S	*	*			trans	79.3	136.1	139.1	-98.3	0	0	0	0	124.7
636	E	28.4	Very low	28.6	Very low	158 Å²	158	137.7 Å²	137.7	74%	0.738	77%	0.774	S	S	*	*			trans	80.6	91.5	143.6	-76.6	148.6	-122.7	0	0	122
637	Q	28.4	Very low	28.4	Very low	175 Å²	175	143.8 Å²	143.8	82%	0.818	78%	0.781	S	S	*	*				45.9	121	116.7	-63.5	179.6	4.8	0	0	119.7
638	D	25.1	Very low	29	Very low	152 Å²	152	140.2 Å²	140.2	81%	0.813	78%	0.778	S	S	*	*				-156.9	113.5	114.3	-118.4	-21.5	0	0	0	115.3
639	V	29.5	Very low	30.4	Very low	116 Å²	116	143 Å²	143	70%	0.703	78%	0.776	S	S	*	*				45.7	104.2	129	178.3	0	0	0	0	122.1
640	V	27.4	Very low	32.1	Very low	110 Å²	110	140.4 Å²	140.4	67%	0.667	77%	0.774	S	S	*	*				73.3	120.8	128	179.3	0	0	0	0	122.4	S642	V640-S642 VanDerWaalsContact CG1-OG 3.31Å; V640-S642 WeakPolarHBondContact CG1-OG 3.42Å
641	V	27.4	Very low	33.8	Very low	153 Å²	153	137.1 Å²	137.1	93%	0.927	76%	0.764	S	S	*	*				-124.6	145.3	129.3	175	0	0	0	0	108.7
642	S	29.5	Very low	35.8	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	73%	0.729	S	S	*	*			trans	-99.3	134.8	-153.2	-54.8	0	0	0	0	117	V640	V640-S642 VanDerWaalsContact CG1-OG 3.31Å; V640-S642 WeakPolarHBondContact CG1-OG 3.42Å
643	V	31.1	Very low	37.8	Very low	125 Å²	125	127.2 Å²	127.2	76%	0.758	71%	0.706	S	S	*	*			trans	54.6	115.2	132.6	-175.4	0	0	0	0	119.8
644	T	28.9	Very low	40.3	Very low	143 Å²	143	122.7 Å²	122.7	88%	0.877	67%	0.674	S	S	*	*			trans	-109.4	128.8	135.1	51.3	0	0	0	0	109.7	S646	T644-S646 PolarHBondContact O-N 3.29Å
645	K	30	Very low	42.4	Very low	200 Å²	200	121 Å²	121	87%	0.87	67%	0.673	S	S	*	*			trans	-45.5	124.3	-177.5	-86.7	172.7	168.5	172.7	0	113.8
646	S	30.4	Very low	44.4	Very low	112 Å²	112	119.3 Å²	119.3	78%	0.783	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-82.3	129.6	153.8	46.3	0	0	0	0	109.6	T644	T644-S646 PolarHBondContact O-N 3.29Å
647	W	29.7	Very low	46.6	Very low	245 Å²	245	112.4 Å²	112.4	93%	0.928	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-72.8	142.5	160.6	-90	-49	0	0	0	109.1	R649	W647-R649 PolarHBondContact O-N 3.05Å
648	P	40.4	Very low	48.5	Very low	116 Å²	116	107.6 Å²	107.6	75%	0.753	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-60.3	126.2	165.5	-16.2	29.8	0	0	0	108.6
649	R	52.9	Low	51.1	Low	168 Å²	168	105.5 Å²	105.5	63%	0.634	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-68.5	141.9	170.1	-67.4	-177.4	176.5	-156.3	-2.5	108.7	W647 E694	W647-R649 PolarHBondContact O-N 3.05Å; R649-E694 IonicContact CZ-OE2 2.66Å; R649-E694 IonicContact NH1-OE2 3.39Å; R649-E694 PolarHBondContact NH1-OE2 2.68Å; R649-E694 IonicContact NH2-OE2 3.54Å
650	P	60.9	Low	53.6	Low	118 Å²	118	102.1 Å²	102.1	77%	0.766	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-64.8	141.9	171.2	29	-33.7	0	0	0	109.5
651	V	64.1	Low	56.1	Low	105 Å²	105	101.8 Å²	101.8	64%	0.636	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-57.6	138.4	175.7	-179.1	0	0	0	0	109.5	T653	V651-T653 PolarHBondContact O-N 3.11Å
652	P	71.5	Confident	58.8	Low	15 Å²	15	98.5 Å²	98.5	10%	0.097	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-56.6	126.6	176.4	-26.1	34.7	0	0	0	110.9	Y688 D691 L692 D695	P652-Y688 HydrophobicContact CB-CD2 4.15Å; P652-Y688 HydrophobicContact CB-CE2 3.91Å; P652-D691 HydrophobicContact CB-CB 3.91Å; P652-D691 HydrophobicContact CG-CB 4Å; P652-L692 HydrophobicContact CB-CD2 4.41Å; P652-D695 WeakPolarHBondContact CD-OD2 3.35Å; P652-D695 HydrophobicContact CG-CB 4.48Å; P652-D695 WeakPolarHBondContact CG-OD2 3.34Å
653	T	78.2	Confident	61.4	Low	52 Å²	52	94.4 Å²	94.4	32%	0.319	54%	0.538	S	S	.	.			trans	-133.1	138.5	178.2	51	0	0	0	0	111.5	V651 A657 C658 Y688	V651-T653 PolarHBondContact O-N 3.11Å; T653-A657 WeakPolarHBondContact CA-O 3.23Å; T653-C658 HydrophobicContact CG2-CB 4.49Å; T653-C658 WeakPolarHBondContact CG2-SG 3.45Å; T653-Y688 VanDerWaalsContact C-CD2 3.42Å
654	L	77.5	Confident	64	Low	11 Å²	11	90.7 Å²	90.7	6%	0.058	51%	0.511	C	S	.	.	B	Isolated β-bridge	trans	-99.4	111.9	170.7	-171.4	71.6	0	0	0	107.8	G656 A657 I663 L667 Q684 V685 Y688	L654-G656 PolarHBondContact O-N 3.04Å; L654-A657 PolarHBondContact N-O 3.23Å; L654-A657 VanDerWaalsContact N-O 3.16Å; L654-A657 WeakPolarHBondContact O-CB 3.42Å; L654-A657 PolarHBondContact O-N 2.86Å; L654-I663 HydrophobicContact CB-CG1 4.31Å; L654-I663 HydrophobicContact CD2-CG2 3.98Å; L654-L667 HydrophobicContact CD2-CD2 4.07Å; L654-L667 HydrophobicContact CD2-CG 4.06Å; L654-Q684 HydrophobicContact CD1-CG 4.29Å; L654-V685 HydrophobicContact CD1-CG2 4.01Å; L654-Y688 HydrophobicContact CB-CD1 4.25Å; L654-Y688 HydrophobicContact CB-CD2 3.98Å; L654-Y688 HydrophobicContact CB-CE2 4.38Å; L654-Y688 HydrophobicContact CB-CG 3.91Å; L654-Y688 HydrophobicContact CD1-CD1 4.45Å; L654-Y688 HydrophobicContact CD1-CG 4.11Å
655	A	71.1	Confident	66.8	Low	88 Å²	88	87.5 Å²	87.5	73%	0.727	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	28.7	-175.4	0	0	0	0	0	114.8	L666	A655-L666 HydrophobicContact CB-CD1 4.45Å
656	G	70	Confident	69.5	Low	57 Å²	57	81 Å²	81	59%	0.588	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	-8.2	-177.5	0	0	0	0	0	115.5	L654	L654-G656 PolarHBondContact O-N 3.04Å
657	A	74.1	Confident	72.1	Confident	13 Å²	13	75.8 Å²	75.8	11%	0.107	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-78.9	130	173.3	0	0	0	0	0	111.6	T653 L654 D662 I663 L666	T653-A657 WeakPolarHBondContact CA-O 3.23Å; L654-A657 PolarHBondContact N-O 3.23Å; L654-A657 VanDerWaalsContact N-O 3.16Å; L654-A657 WeakPolarHBondContact O-CB 3.42Å; L654-A657 PolarHBondContact O-N 2.86Å; A657-D662 HydrophobicContact CB-CB 3.94Å; A657-I663 HydrophobicContact CB-CG1 3.99Å; A657-L666 HydrophobicContact CB-CD1 3.67Å
658	C	69.4	Low	74.8	Confident	73 Å²	73	70.2 Å²	70.2	49%	0.493	41%	0.409	S	S	.	.			trans	-98.3	-33	173.6	-56	0	0	0	0	112.3	T653	T653-C658 HydrophobicContact CG2-CB 4.49Å; T653-C658 WeakPolarHBondContact CG2-SG 3.45Å
659	D	78.6	Confident	77	Confident	108 Å²	108	70 Å²	70	58%	0.578	40%	0.398	S	S	*	.	S	Bend	trans	-86.9	136.7	-170.8	-75.3	-37.2	0	0	0	112.4	T661 D662 I663	D659-T661 PolarHBondContact O-N 3.4Å; D659-T661 VanDerWaalsContact O-N 3.14Å; D659-D662 PolarHBondContact O-N 3.14Å; D659-I663 WeakPolarHBondContact O-CD1 3.26Å; D659-I663 WeakPolarHBondContact O-CG1 3.43Å; D659-I663 PolarHBondContact O-N 2.85Å
660	L	81.7	Confident	78.6	Confident	46 Å²	46	63.3 Å²	63.3	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-29.8	-174.7	-177.5	68.4	0	0	0	113.2	K664 L703 I704	L660-K664 HydrophobicContact CG-CD 4.31Å; L660-K664 WeakPolarHBondContact O-CB 3.33Å; L660-K664 WeakPolarHBondContact O-CD 3.47Å; L660-K664 VanDerWaalsContact O-CG 3.22Å; L660-K664 WeakPolarHBondContact O-CG 3.48Å; L660-K664 PolarHBondContact O-N 3.44Å; L660-K664 VanDerWaalsContact O-N 3.1Å; L660-L703 HydrophobicContact CD2-CD2 3.65Å; L660-L703 HydrophobicContact CD2-CG 4.38Å; L660-I704 HydrophobicContact CD1-CD1 3.87Å; L660-I704 HydrophobicContact CD1-CG1 3.69Å
661	T	81.3	Confident	79.7	Confident	102 Å²	102	58.5 Å²	58.5	63%	0.626	34%	0.341	S	S	*	.	H	α-helix	trans	-69.3	-42.5	177.3	-53.8	0	0	0	0	111.3	D659 K664 T665	D659-T661 PolarHBondContact O-N 3.4Å; D659-T661 VanDerWaalsContact O-N 3.14Å; T661-K664 PolarHBondContact O-N 3.32Å; T661-T665 PolarHBondContact O-N 2.92Å; T661-T665 PolarHBondContact O-OG1 3.33Å
662	D	83.3	Confident	80.6	Confident	84 Å²	84	58.2 Å²	58.2	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-71.8	-42.4	-179.7	-60.8	-15	0	0	0	110.1	A657 D659 K664 T665 L666	A657-D662 HydrophobicContact CB-CB 3.94Å; D659-D662 PolarHBondContact O-N 3.14Å; D662-K664 VanDerWaalsContact C-N 3.31Å; D662-K664 PolarHBondContact O-N 2.86Å; D662-T665 CarbonylContact O-C 3.56Å; D662-T665 WeakPolarHBondContact O-CA 3.44Å; D662-T665 WeakPolarHBondContact O-CB 3.25Å; D662-T665 PolarHBondContact O-N 3.05Å; D662-L666 WeakPolarHBondContact O-CG 3.49Å; D662-L666 PolarHBondContact O-N 3.3Å
663	I	84.9	Confident	81.2	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-58.3	-42.1	174	-66.1	158	0	0	0	111.4	L654 A657 D659 T665 L667 Y688 I704	L654-I663 HydrophobicContact CB-CG1 4.31Å; L654-I663 HydrophobicContact CD2-CG2 3.98Å; A657-I663 HydrophobicContact CB-CG1 3.99Å; D659-I663 WeakPolarHBondContact O-CD1 3.26Å; D659-I663 WeakPolarHBondContact O-CG1 3.43Å; D659-I663 PolarHBondContact O-N 2.85Å; I663-T665 VanDerWaalsContact C-N 3.28Å; I663-T665 PolarHBondContact O-N 3.01Å; I663-L667 HydrophobicContact CG2-CD1 3.97Å; I663-L667 WeakPolarHBondContact O-CB 3.41Å; I663-L667 VanDerWaalsContact O-CG 3.29Å; I663-L667 WeakPolarHBondContact O-CG 3.21Å; I663-L667 PolarHBondContact O-N 3.48Å; I663-Y688 HydrophobicContact CD1-CE1 4.46Å; I663-Y688 HydrophobicContact CD1-CE2 4.36Å; I663-Y688 VanDerWaalsContact CD1-OH 3.25Å; I663-Y688 WeakPolarHBondContact CD1-OH 3.36Å; I663-Y688 HydrophobicContact CG2-CE1 4.41Å; I663-I704 HydrophobicContact CG2-CD1 3.91Å
664	K	85.6	Confident	81.3	Confident	47 Å²	47	62.1 Å²	62.1	20%	0.204	36%	0.36	C	S	.	.	H	α-helix	trans	-68.3	-26.3	174.2	-75.6	171.2	-179.1	167.7	0	113.3	L660 T661 D662 R668 Y707	L660-K664 HydrophobicContact CG-CD 4.31Å; L660-K664 WeakPolarHBondContact O-CB 3.33Å; L660-K664 WeakPolarHBondContact O-CD 3.47Å; L660-K664 VanDerWaalsContact O-CG 3.22Å; L660-K664 WeakPolarHBondContact O-CG 3.48Å; L660-K664 PolarHBondContact O-N 3.44Å; L660-K664 VanDerWaalsContact O-N 3.1Å; T661-K664 PolarHBondContact O-N 3.32Å; D662-K664 VanDerWaalsContact C-N 3.31Å; D662-K664 PolarHBondContact O-N 2.86Å; K664-R668 WeakPolarHBondContact O-CB 3.47Å; K664-R668 PolarHBondContact O-N 2.86Å; K664-Y707 HydrophobicContact CB-CD1 4.13Å; K664-Y707 HydrophobicContact CB-CE1 3.65Å; K664-Y707 HydrophobicContact CG-CD1 3.76Å; K664-Y707 HydrophobicContact CG-CD2 4.48Å; K664-Y707 HydrophobicContact CG-CE1 3.82Å; K664-Y707 HydrophobicContact CG-CG 4.08Å; K664-Y707 WeakPolarHBondContact O-CE1 3.42Å; K664-Y707 PolarHBondContact O-OH 3.15Å
665	T	86.7	Confident	81.2	Confident	76 Å²	76	66.6 Å²	66.6	47%	0.466	39%	0.388	S	S	.	.	H	α-helix	trans	-76.4	-48.1	176.2	-56.2	0	0	0	0	110	T661 D662 I663 L667 R668 E669	T661-T665 PolarHBondContact O-N 2.92Å; T661-T665 PolarHBondContact O-OG1 3.33Å; D662-T665 CarbonylContact O-C 3.56Å; D662-T665 WeakPolarHBondContact O-CA 3.44Å; D662-T665 WeakPolarHBondContact O-CB 3.25Å; D662-T665 PolarHBondContact O-N 3.05Å; I663-T665 VanDerWaalsContact C-N 3.28Å; I663-T665 PolarHBondContact O-N 3.01Å; T665-L667 PolarHBondContact O-N 2.92Å; T665-R668 WeakPolarHBondContact O-CB 3.41Å; T665-R668 PolarHBondContact O-N 3.26Å; T665-R668 VanDerWaalsContact O-N 3.1Å; T665-E669 WeakPolarHBondContact O-CB 3.4Å; T665-E669 PolarHBondContact O-N 3.09Å
666	L	86.9	Confident	81.7	Confident	63 Å²	63	68.8 Å²	68.8	33%	0.33	38%	0.383	S	S	.	.	H	α-helix	trans	-57.7	-46.6	174.1	-69.4	171.9	0	0	0	112.3	A655 A657 D662 R668 E669 W670	A655-L666 HydrophobicContact CB-CD1 4.45Å; A657-L666 HydrophobicContact CB-CD1 3.67Å; D662-L666 WeakPolarHBondContact O-CG 3.49Å; D662-L666 PolarHBondContact O-N 3.3Å; L666-R668 VanDerWaalsContact C-N 3.28Å; L666-R668 PolarHBondContact O-N 3.24Å; L666-E669 PolarHBondContact O-N 3.25Å; L666-W670 VanDerWaalsContact O-CB 3.24Å; L666-W670 WeakPolarHBondContact O-CB 3.35Å; L666-W670 PolarHBondContact O-N 3.11Å
667	L	86	Confident	82.4	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-64.9	-30.3	177.1	-72.8	169.5	0	0	0	112.8	L654 I663 T665 W670 V671 V685 I704 Y707 M708	L654-L667 HydrophobicContact CD2-CD2 4.07Å; L654-L667 HydrophobicContact CD2-CG 4.06Å; I663-L667 HydrophobicContact CG2-CD1 3.97Å; I663-L667 WeakPolarHBondContact O-CB 3.41Å; I663-L667 VanDerWaalsContact O-CG 3.29Å; I663-L667 WeakPolarHBondContact O-CG 3.21Å; I663-L667 PolarHBondContact O-N 3.48Å; T665-L667 PolarHBondContact O-N 2.92Å; L667-W670 HydrophobicContact CD2-CE3 4.18Å; L667-W670 HydrophobicContact CD2-CZ3 4.5Å; L667-V671 WeakPolarHBondContact O-CG2 3.49Å; L667-V671 PolarHBondContact O-N 3.46Å; L667-V685 HydrophobicContact CD2-CG1 4.39Å; L667-V685 HydrophobicContact CD2-CG2 3.98Å; L667-I704 HydrophobicContact CD1-CG2 3.91Å; L667-Y707 HydrophobicContact CB-CE1 4.35Å; L667-M708 HydrophobicContact CD1-CG 3.94Å; L667-M708 HydrophobicContact CD1-SD 4.18Å; L667-M708 HydrophobicContact CD2-CG 4.37Å; L667-M708 HydrophobicContact CD2-SD 4.26Å
668	R	86.3	Confident	82.9	Confident	128 Å²	128	71.5 Å²	71.5	48%	0.483	38%	0.382	S	S	.	.	H	α-helix	trans	-72.1	-48.5	173.4	179.7	-170	-62.4	-91.3	-2.7	110.8	K664 T665 L666 W670 V671 T672 Y707 L711	K664-R668 WeakPolarHBondContact O-CB 3.47Å; K664-R668 PolarHBondContact O-N 2.86Å; T665-R668 WeakPolarHBondContact O-CB 3.41Å; T665-R668 PolarHBondContact O-N 3.26Å; T665-R668 VanDerWaalsContact O-N 3.1Å; L666-R668 VanDerWaalsContact C-N 3.28Å; L666-R668 PolarHBondContact O-N 3.24Å; R668-W670 VanDerWaalsContact C-N 3.34Å; R668-V671 PolarHBondContact O-N 3.29Å; R668-T672 HydrophobicContact CG-CG2 4.43Å; R668-T672 WeakPolarHBondContact O-CB 3.4Å; R668-T672 WeakPolarHBondContact O-CG2 3.46Å; R668-T672 PolarHBondContact O-N 2.84Å; R668-T672 PolarHBondContact O-OG1 3.27Å; R668-Y707 PolarHBondContact NE-OH 3.22Å; R668-Y707 PolarHBondContact NH2-OH 3.16Å; R668-L711 HydrophobicContact CB-CD1 4.21Å
669	E	85.4	Confident	83.7	Confident	111 Å²	111	75.3 Å²	75.3	52%	0.519	39%	0.392	S	S	.	.	H	α-helix	trans	-59.8	-46.6	180	-171.7	172.3	-175.9	0	0	110.4	T665 L666 V671 T672 T673	T665-E669 WeakPolarHBondContact O-CB 3.4Å; T665-E669 PolarHBondContact O-N 3.09Å; L666-E669 PolarHBondContact O-N 3.25Å; E669-V671 PolarHBondContact O-N 2.74Å; E669-T672 PolarHBondContact O-N 3.09Å; E669-T672 VanDerWaalsContact O-N 3.16Å; E669-T672 PolarHBondContact O-OG1 3Å; E669-T673 HydrophobicContact CG-CG2 3.79Å; E669-T673 WeakPolarHBondContact O-CB 3.47Å; E669-T673 WeakPolarHBondContact O-CG2 3.34Å; E669-T673 PolarHBondContact O-N 3.23Å; E669-T673 PolarHBondContact O-OG1 2.93Å
670	W	86.9	Confident	83.9	Confident	27 Å²	27	77.3 Å²	77.3	10%	0.102	40%	0.398	C	S	.	.	H	α-helix	trans	-53.1	-51.6	174.2	-176.2	58.2	0	0	0	112.9	L666 L667 R668 T672 I674 P677 D681 I682 V685 M712 W720 I727	L666-W670 VanDerWaalsContact O-CB 3.24Å; L666-W670 WeakPolarHBondContact O-CB 3.35Å; L666-W670 PolarHBondContact O-N 3.11Å; L667-W670 HydrophobicContact CD2-CE3 4.18Å; L667-W670 HydrophobicContact CD2-CZ3 4.5Å; R668-W670 VanDerWaalsContact C-N 3.34Å; W670-T672 VanDerWaalsContact C-N 3.29Å; W670-T672 PolarHBondContact O-N 3.14Å; W670-I674 PolarHBondContact O-N 3.4Å; W670-P677 HydrophobicContact CH2-CB 4.48Å; W670-P677 HydrophobicContact CZ2-CB 4.02Å; W670-D681 HydrophobicContact CZ2-CB 3.49Å; W670-D681 VanDerWaalsContact CZ2-CB 3.49Å; W670-D681 VanDerWaalsContact NE1-CB 3.25Å; W670-D681 PolarHBondContact NE1-OD2 3.25Å; W670-I682 HydrophobicContact CH2-CG1 4.05Å; W670-I682 HydrophobicContact CZ2-CG1 4.07Å; W670-V685 HydrophobicContact CH2-CG2 4.43Å; W670-V685 HydrophobicContact CZ3-CG2 4.2Å; W670-M712 HydrophobicContact CH2-CE 4.46Å; W670-M712 HydrophobicContact CZ3-CE 4.19Å; W670-W720 HydrophobicContact CD2-CH2 4.08Å; W670-W720 AromaticContact CD2-CZ3 3.95Å; W670-W720 HydrophobicContact CD2-CZ3 3.95Å; W670-W720 AromaticContact CE3-CZ3 3.92Å; W670-W720 HydrophobicContact CE3-CZ3 3.92Å; W670-W720 HydrophobicContact CG-CH2 4.42Å; W670-W720 HydrophobicContact CH2-CZ3 4.04Å; W670-W720 HydrophobicContact CZ2-CH2 4.35Å; W670-W720 HydrophobicContact CZ2-CZ3 4.05Å; W670-W720 AromaticContact CZ3-CZ3 3.98Å; W670-W720 HydrophobicContact CZ3-CZ3 3.98Å; W670-I727 HydrophobicContact CH2-CD1 4.37Å
671	V	84.3	Confident	84.2	Confident	17 Å²	17	77.7 Å²	77.7	10%	0.103	40%	0.4	C	S	.	.	H	α-helix	trans	-73.1	-16.6	-178.7	177.7	0	0	0	0	113.3	L667 R668 E669 L711 M712 W720	L667-V671 WeakPolarHBondContact O-CG2 3.49Å; L667-V671 PolarHBondContact O-N 3.46Å; R668-V671 PolarHBondContact O-N 3.29Å; E669-V671 PolarHBondContact O-N 2.74Å; V671-L711 HydrophobicContact CG1-CB 4.32Å; V671-M712 HydrophobicContact CG1-CG 4.39Å; V671-M712 HydrophobicContact CG2-CG 3.94Å; V671-W720 HydrophobicContact CB-CE3 4.42Å; V671-W720 HydrophobicContact CB-CZ3 4.2Å; V671-W720 HydrophobicContact CG1-CD2 4.49Å; V671-W720 HydrophobicContact CG1-CE3 4.26Å; V671-W720 HydrophobicContact CG2-CE3 3.91Å; V671-W720 HydrophobicContact CG2-CH2 4.35Å; V671-W720 HydrophobicContact CG2-CZ3 3.62Å
672	T	83.4	Confident	84.5	Confident	100 Å²	100	73.7 Å²	73.7	61%	0.613	38%	0.375	S	S	*	.	H	α-helix	trans	-110.4	-16.8	-175.4	54.7	0	0	0	0	114.9	R668 E669 W670	R668-T672 HydrophobicContact CG-CG2 4.43Å; R668-T672 WeakPolarHBondContact O-CB 3.4Å; R668-T672 WeakPolarHBondContact O-CG2 3.46Å; R668-T672 PolarHBondContact O-N 2.84Å; R668-T672 PolarHBondContact O-OG1 3.27Å; E669-T672 PolarHBondContact O-N 3.09Å; E669-T672 VanDerWaalsContact O-N 3.16Å; E669-T672 PolarHBondContact O-OG1 3Å; W670-T672 VanDerWaalsContact C-N 3.29Å; W670-T672 PolarHBondContact O-N 3.14Å
673	T	82.8	Confident	84.7	Confident	92 Å²	92	74 Å²	74	56%	0.564	38%	0.376	S	S	*	.	H	α-helix	trans	-101.2	-24.2	179.5	58.4	0	0	0	0	113.5	E669	E669-T673 HydrophobicContact CG-CG2 3.79Å; E669-T673 WeakPolarHBondContact O-CB 3.47Å; E669-T673 WeakPolarHBondContact O-CG2 3.34Å; E669-T673 PolarHBondContact O-N 3.23Å; E669-T673 PolarHBondContact O-OG1 2.93Å
674	I	81.8	Confident	84.8	Confident	57 Å²	57	77.7 Å²	77.7	29%	0.292	39%	0.393	S	S	.	.			trans	-106.9	137.5	-177.9	-67.6	158.5	0	0	0	109.2	W670 E676 W720	W670-I674 PolarHBondContact O-N 3.4Å; I674-E676 WeakPolarHBondContact CG2-O 3.39Å; I674-W720 HydrophobicContact CB-CZ2 4.28Å; I674-W720 HydrophobicContact CG2-CZ2 4.17Å; I674-W720 WeakPolarHBondContact O-CZ2 3.41Å
675	T	74.6	Confident	84.9	Confident	104 Å²	104	75.8 Å²	75.8	64%	0.638	39%	0.385	S	S	*	.	S	Bend	trans	-80.7	-41.5	178.1	53.3	0	0	0	0	112.6	E717 W720	T675-E717 VanDerWaalsContact O-OE2 3.08Å; T675-W720 PolarHBondContact O-NE1 2.96Å
676	E	80.8	Confident	85.1	Confident	134 Å²	134	72.8 Å²	72.8	63%	0.626	37%	0.367	S	S	*	.	S	Bend	trans	-123.5	126.5	179	-65.3	-173	163.2	0	0	110.7	I674 M678	I674-E676 WeakPolarHBondContact CG2-O 3.39Å; E676-M678 PolarHBondContact O-N 3.43Å
677	P	84.9	Confident	85.2	Confident	18 Å²	18	75.2 Å²	75.2	12%	0.117	38%	0.375	C	S	.	.			trans	-67.2	122.9	-175.9	27	-32.9	0	0	0	111	W670 I682 V719 W720 A723	W670-P677 HydrophobicContact CH2-CB 4.48Å; W670-P677 HydrophobicContact CZ2-CB 4.02Å; P677-I682 HydrophobicContact CB-CD1 4Å; P677-I682 HydrophobicContact CB-CG1 4.17Å; P677-I682 HydrophobicContact CG-CD1 4.29Å; P677-V719 HydrophobicContact CG-CG1 4.09Å; P677-W720 HydrophobicContact CB-CD2 4.26Å; P677-W720 HydrophobicContact CB-CE3 3.94Å; P677-W720 HydrophobicContact CB-CH2 3.7Å; P677-W720 HydrophobicContact CB-CZ2 4.01Å; P677-W720 HydrophobicContact CB-CZ3 3.66Å; P677-W720 HydrophobicContact CG-CD2 4.1Å; P677-W720 HydrophobicContact CG-CE3 4.16Å; P677-W720 HydrophobicContact CG-CZ2 4.43Å; P677-W720 HydrophobicContact CG-CZ3 4.37Å; P677-A723 HydrophobicContact CB-CB 4.22Å; P677-A723 HydrophobicContact CG-CB 3.71Å
678	M	85.8	Confident	85.4	Confident	110 Å²	110	75.3 Å²	75.3	54%	0.542	38%	0.375	S	S	.	.			trans	-72.6	141.5	179.2	-66.3	-178.3	56.1	0	0	111.3	E676 E680 D681 I682	E676-M678 PolarHBondContact O-N 3.43Å; M678-E680 PolarHBondContact O-N 2.82Å; M678-D681 PolarHBondContact O-N 2.85Å; M678-I682 WeakPolarHBondContact O-CG1 3.41Å; M678-I682 PolarHBondContact O-N 2.9Å; M678-I682 VanDerWaalsContact O-N 3.11Å
679	E	84.9	Confident	85.4	Confident	153 Å²	153	69.2 Å²	69.2	72%	0.715	35%	0.352	S	S	*	.	H	α-helix	trans	-58.8	-35.9	-177.9	-172	175.2	-179.8	0	0	112.3	L683	E679-L683 HydrophobicContact CG-CD1 4.21Å; E679-L683 WeakPolarHBondContact O-CB 3.15Å; E679-L683 VanDerWaalsContact O-CG 3.24Å; E679-L683 WeakPolarHBondContact O-CG 3.18Å; E679-L683 PolarHBondContact O-N 3.16Å
680	E	83.8	Confident	85.5	Confident	150 Å²	150	65.2 Å²	65.2	70%	0.701	34%	0.335	S	S	*	.	H	α-helix	trans	-65.5	-41.6	178.2	-60.4	-171.8	165.5	0	0	112.3	M678 L683 Q684	M678-E680 PolarHBondContact O-N 2.82Å; E680-L683 PolarHBondContact O-N 2.92Å; E680-Q684 WeakPolarHBondContact O-CB 3.35Å; E680-Q684 PolarHBondContact O-N 3.1Å
681	D	87.1	Confident	85.5	Confident	53 Å²	53	66.2 Å²	66.2	28%	0.283	34%	0.343	S	S	.	.	H	α-helix	trans	-68.3	-43.3	177.8	-60.5	-28.4	0	0	0	111.5	W670 M678 L683 Q684 V685	W670-D681 HydrophobicContact CZ2-CB 3.49Å; W670-D681 VanDerWaalsContact CZ2-CB 3.49Å; W670-D681 VanDerWaalsContact NE1-CB 3.25Å; W670-D681 PolarHBondContact NE1-OD2 3.25Å; M678-D681 PolarHBondContact O-N 2.85Å; D681-L683 VanDerWaalsContact C-N 3.29Å; D681-L683 PolarHBondContact O-N 3.22Å; D681-Q684 PolarHBondContact O-N 2.57Å; D681-Q684 VanDerWaalsContact O-N 3.13Å; D681-V685 WeakPolarHBondContact O-CG2 3.43Å; D681-V685 PolarHBondContact O-N 3.32Å
682	I	87.9	Confident	85.6	Confident	19 Å²	19	65.7 Å²	65.7	10%	0.097	34%	0.339	C	S	.	.	H	α-helix	trans	-54.7	-48.5	174.6	-68.7	171.1	0	0	0	109.6	W670 P677 M678 Q684 V685 V686 A723 F726 I727	W670-I682 HydrophobicContact CH2-CG1 4.05Å; W670-I682 HydrophobicContact CZ2-CG1 4.07Å; P677-I682 HydrophobicContact CB-CD1 4Å; P677-I682 HydrophobicContact CB-CG1 4.17Å; P677-I682 HydrophobicContact CG-CD1 4.29Å; M678-I682 WeakPolarHBondContact O-CG1 3.41Å; M678-I682 PolarHBondContact O-N 2.9Å; M678-I682 VanDerWaalsContact O-N 3.11Å; I682-Q684 VanDerWaalsContact C-N 3.34Å; I682-Q684 PolarHBondContact O-N 3.29Å; I682-V685 PolarHBondContact O-N 3.42Å; I682-V686 WeakPolarHBondContact O-CG2 3.43Å; I682-V686 PolarHBondContact O-N 3.09Å; I682-A723 HydrophobicContact CD1-CB 3.86Å; I682-A723 HydrophobicContact CG1-CB 4.36Å; I682-F726 HydrophobicContact CG2-CD1 3.58Å; I682-F726 HydrophobicContact CG2-CE1 3.8Å; I682-I727 HydrophobicContact CG2-CD1 4.23Å; I682-I727 HydrophobicContact CG2-CG1 3.81Å
683	L	87.4	Confident	85.7	Confident	89 Å²	89	61.1 Å²	61.1	47%	0.466	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-35.1	178.9	-70.4	171.2	0	0	0	112.4	E679 E680 D681 V686 K687	E679-L683 HydrophobicContact CG-CD1 4.21Å; E679-L683 WeakPolarHBondContact O-CB 3.15Å; E679-L683 VanDerWaalsContact O-CG 3.24Å; E679-L683 WeakPolarHBondContact O-CG 3.18Å; E679-L683 PolarHBondContact O-N 3.16Å; E680-L683 PolarHBondContact O-N 2.92Å; D681-L683 VanDerWaalsContact C-N 3.29Å; D681-L683 PolarHBondContact O-N 3.22Å; L683-V686 PolarHBondContact O-N 3.02Å; L683-K687 WeakPolarHBondContact O-CB 3.24Å; L683-K687 PolarHBondContact O-N 2.89Å
684	Q	87	Confident	85.7	Confident	79 Å²	79	61.8 Å²	61.8	37%	0.369	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-37.2	175.8	-173.9	58.9	38.6	0	0	112.1	L654 E680 D681 I682 Y688	L654-Q684 HydrophobicContact CD1-CG 4.29Å; E680-Q684 WeakPolarHBondContact O-CB 3.35Å; E680-Q684 PolarHBondContact O-N 3.1Å; D681-Q684 PolarHBondContact O-N 2.57Å; D681-Q684 VanDerWaalsContact O-N 3.13Å; I682-Q684 VanDerWaalsContact C-N 3.34Å; I682-Q684 PolarHBondContact O-N 3.29Å; Q684-Y688 PolarHBondContact O-N 3.03Å
685	V	89.1	Confident	85.7	Confident	7 Å²	7	62.7 Å²	62.7	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-69.1	-44.7	172.9	177	0	0	0	0	111.4	L654 L667 W670 D681 I682 K687 Y688 C689 M708 I727	L654-V685 HydrophobicContact CD1-CG2 4.01Å; L667-V685 HydrophobicContact CD2-CG1 4.39Å; L667-V685 HydrophobicContact CD2-CG2 3.98Å; W670-V685 HydrophobicContact CH2-CG2 4.43Å; W670-V685 HydrophobicContact CZ3-CG2 4.2Å; D681-V685 WeakPolarHBondContact O-CG2 3.43Å; D681-V685 PolarHBondContact O-N 3.32Å; I682-V685 PolarHBondContact O-N 3.42Å; V685-K687 VanDerWaalsContact C-N 3.3Å; V685-K687 PolarHBondContact O-N 3.37Å; V685-Y688 PolarHBondContact O-N 3.12Å; V685-C689 PolarHBondContact O-N 3.01Å; V685-M708 HydrophobicContact CG1-CE 3.7Å; V685-M708 HydrophobicContact CG1-SD 3.89Å; V685-I727 HydrophobicContact CB-CD1 4.5Å; V685-I727 HydrophobicContact CG1-CD1 4.29Å; V685-I727 HydrophobicContact CG1-CG2 4.33Å
686	V	91	Very high	86.1	Confident	14 Å²	14	65.3 Å²	65.3	9%	0.085	32%	0.316	C	S	.	.	H	α-helix	trans	-56.6	-44.8	173.5	170.5	0	0	0	0	111.1	I682 L683 C689 T690 I727 N730	I682-V686 WeakPolarHBondContact O-CG2 3.43Å; I682-V686 PolarHBondContact O-N 3.09Å; L683-V686 PolarHBondContact O-N 3.02Å; V686-C689 PolarHBondContact O-N 2.89Å; V686-T690 WeakPolarHBondContact O-CB 3.26Å; V686-T690 PolarHBondContact O-N 3.37Å; V686-T690 PolarHBondContact O-OG1 2.88Å; V686-I727 HydrophobicContact CG2-CB 4.14Å; V686-I727 HydrophobicContact CG2-CG1 3.89Å; V686-I727 HydrophobicContact CG2-CG2 4.04Å; V686-N730 HydrophobicContact CG1-CB 3.82Å; V686-N730 HydrophobicContact CG2-CB 4.32Å
687	K	88.7	Confident	86.2	Confident	113 Å²	113	61 Å²	61	49%	0.491	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-50.5	178	-176.3	-172.9	171.7	-169.3	0	111.3	L683 V685 C689 T690 D691	L683-K687 WeakPolarHBondContact O-CB 3.24Å; L683-K687 PolarHBondContact O-N 2.89Å; V685-K687 VanDerWaalsContact C-N 3.3Å; V685-K687 PolarHBondContact O-N 3.37Å; K687-C689 VanDerWaalsContact C-N 3.32Å; K687-C689 PolarHBondContact O-N 3.13Å; K687-T690 CarbonylContact O-C 3.57Å; K687-T690 WeakPolarHBondContact O-CA 3.09Å; K687-T690 VanDerWaalsContact O-CB 3.3Å; K687-T690 WeakPolarHBondContact O-CB 3.45Å; K687-T690 PolarHBondContact O-N 3.18Å; K687-D691 VanDerWaalsContact O-CG 3.28Å; K687-D691 PolarHBondContact O-N 3.06Å
688	Y	89.7	Confident	86	Confident	6 Å²	6	62.9 Å²	62.9	2%	0.024	31%	0.306	C	S	.	.	H	α-helix	trans	-58.5	-42.7	178.3	172.5	-98.7	0	0	0	112.4	P652 T653 L654 I663 Q684 V685 T690 D691 L692 I704	P652-Y688 HydrophobicContact CB-CD2 4.15Å; P652-Y688 HydrophobicContact CB-CE2 3.91Å; T653-Y688 VanDerWaalsContact C-CD2 3.42Å; L654-Y688 HydrophobicContact CB-CD1 4.25Å; L654-Y688 HydrophobicContact CB-CD2 3.98Å; L654-Y688 HydrophobicContact CB-CE2 4.38Å; L654-Y688 HydrophobicContact CB-CG 3.91Å; L654-Y688 HydrophobicContact CD1-CD1 4.45Å; L654-Y688 HydrophobicContact CD1-CG 4.11Å; I663-Y688 HydrophobicContact CD1-CE1 4.46Å; I663-Y688 HydrophobicContact CD1-CE2 4.36Å; I663-Y688 VanDerWaalsContact CD1-OH 3.25Å; I663-Y688 WeakPolarHBondContact CD1-OH 3.36Å; I663-Y688 HydrophobicContact CG2-CE1 4.41Å; Q684-Y688 PolarHBondContact O-N 3.03Å; V685-Y688 PolarHBondContact O-N 3.12Å; Y688-T690 VanDerWaalsContact C-N 3.31Å; Y688-T690 PolarHBondContact O-N 3.32Å; Y688-D691 PolarHBondContact O-N 3.17Å; Y688-L692 HydrophobicContact CD1-CD1 4.2Å; Y688-L692 HydrophobicContact CE1-CD1 3.46Å; Y688-L692 VanDerWaalsContact CE1-CD1 3.46Å; Y688-L692 HydrophobicContact CE1-CG 4.08Å; Y688-L692 HydrophobicContact CE2-CG 4.43Å; Y688-L692 PolarHBondContact O-N 3.15Å; Y688-I704 HydrophobicContact CE1-CD1 3.7Å
689	C	87.1	Confident	85.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.7	-31.4	174.1	-70.2	0	0	0	0	113	V685 V686 K687 I693 L701 I731	V685-C689 PolarHBondContact O-N 3.01Å; V686-C689 PolarHBondContact O-N 2.89Å; K687-C689 VanDerWaalsContact C-N 3.32Å; K687-C689 PolarHBondContact O-N 3.13Å; C689-I693 WeakPolarHBondContact O-CD1 3.12Å; C689-I693 VanDerWaalsContact O-CG1 3.25Å; C689-I693 WeakPolarHBondContact O-CG1 3.35Å; C689-I693 PolarHBondContact O-N 2.95Å; C689-L701 HydrophobicContact CB-CD1 3.74Å; C689-I731 HydrophobicContact CB-CD1 3.48Å; C689-I731 VanDerWaalsContact CB-CD1 3.48Å; C689-I731 HydrophobicContact CB-CG1 3.76Å
690	T	86.9	Confident	85.7	Confident	28 Å²	28	62.7 Å²	62.7	17%	0.172	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-46	173.3	-58.3	0	0	0	0	111	V686 K687 Y688 L692 I693 E694 V734	V686-T690 WeakPolarHBondContact O-CB 3.26Å; V686-T690 PolarHBondContact O-N 3.37Å; V686-T690 PolarHBondContact O-OG1 2.88Å; K687-T690 CarbonylContact O-C 3.57Å; K687-T690 WeakPolarHBondContact O-CA 3.09Å; K687-T690 VanDerWaalsContact O-CB 3.3Å; K687-T690 WeakPolarHBondContact O-CB 3.45Å; K687-T690 PolarHBondContact O-N 3.18Å; Y688-T690 VanDerWaalsContact C-N 3.31Å; Y688-T690 PolarHBondContact O-N 3.32Å; T690-L692 VanDerWaalsContact C-N 3.31Å; T690-L692 PolarHBondContact O-N 3.31Å; T690-I693 WeakPolarHBondContact O-CB 3.26Å; T690-I693 PolarHBondContact O-N 3.39Å; T690-E694 PolarHBondContact O-N 3.41Å; T690-V734 HydrophobicContact CG2-CG1 4.11Å; T690-V734 HydrophobicContact CG2-CG2 4.28Å
691	D	86.4	Confident	85.9	Confident	48 Å²	48	55.5 Å²	55.5	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-61.2	-38.6	178.1	-63.5	-23.1	0	0	0	110.9	P652 K687 Y688 I693 E694 D695	P652-D691 HydrophobicContact CB-CB 3.91Å; P652-D691 HydrophobicContact CG-CB 4Å; K687-D691 VanDerWaalsContact O-CG 3.28Å; K687-D691 PolarHBondContact O-N 3.06Å; Y688-D691 PolarHBondContact O-N 3.17Å; D691-I693 VanDerWaalsContact C-N 3.32Å; D691-I693 PolarHBondContact O-N 2.84Å; D691-E694 PolarHBondContact O-N 2.96Å; D691-D695 PolarHBondContact O-N 3.36Å
692	L	85.7	Confident	85.7	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.031	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-33.1	171.8	-74.1	177	0	0	0	113.9	P652 Y688 T690 K696 D697 K700 L701 I704	P652-L692 HydrophobicContact CB-CD2 4.41Å; Y688-L692 HydrophobicContact CD1-CD1 4.2Å; Y688-L692 HydrophobicContact CE1-CD1 3.46Å; Y688-L692 VanDerWaalsContact CE1-CD1 3.46Å; Y688-L692 HydrophobicContact CE1-CG 4.08Å; Y688-L692 HydrophobicContact CE2-CG 4.43Å; Y688-L692 PolarHBondContact O-N 3.15Å; T690-L692 VanDerWaalsContact C-N 3.31Å; T690-L692 PolarHBondContact O-N 3.31Å; L692-K696 PolarHBondContact O-N 2.93Å; L692-D697 HydrophobicContact CD2-CB 4.11Å; L692-D697 PolarHBondContact O-N 3.29Å; L692-K700 HydrophobicContact CD1-CB 4.49Å; L692-L701 HydrophobicContact CD1-CB 4.46Å; L692-L701 HydrophobicContact CD1-CD1 4.43Å; L692-I704 HydrophobicContact CD1-CD1 4.22Å
693	I	86.3	Confident	85.7	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.015	28%	0.277	C	S	.	.	H	α-helix	trans	-72.4	-40.5	176.9	-62	158.5	0	0	0	110.1	C689 T690 D691 K696 L701 I731 V734 V735 A738 Y739	C689-I693 WeakPolarHBondContact O-CD1 3.12Å; C689-I693 VanDerWaalsContact O-CG1 3.25Å; C689-I693 WeakPolarHBondContact O-CG1 3.35Å; C689-I693 PolarHBondContact O-N 2.95Å; T690-I693 WeakPolarHBondContact O-CB 3.26Å; T690-I693 PolarHBondContact O-N 3.39Å; D691-I693 VanDerWaalsContact C-N 3.32Å; D691-I693 PolarHBondContact O-N 2.84Å; I693-K696 PolarHBondContact O-N 3.45Å; I693-L701 HydrophobicContact CD1-CD2 4.09Å; I693-L701 HydrophobicContact CG1-CD2 3.47Å; I693-L701 VanDerWaalsContact CG1-CD2 3.47Å; I693-I731 HydrophobicContact CD1-CG2 4.24Å; I693-V734 HydrophobicContact CB-CG1 4.18Å; I693-V734 HydrophobicContact CD1-CB 3.94Å; I693-V734 HydrophobicContact CD1-CG1 3.73Å; I693-V734 HydrophobicContact CG2-CG1 3.97Å; I693-V735 HydrophobicContact CD1-CG2 3.53Å; I693-V735 HydrophobicContact CG1-CG2 3.89Å; I693-V735 HydrophobicContact CG2-CG2 4.31Å; I693-A738 HydrophobicContact CG2-CB 4.11Å; I693-Y739 HydrophobicContact CG2-CD2 4.32Å; I693-Y739 HydrophobicContact CG2-CE2 3.81Å
694	E	83.4	Confident	85.7	Confident	106 Å²	106	53 Å²	53	50%	0.495	26%	0.255	S	S	.	.	H	α-helix	trans	-63.3	-40.6	175.6	-69.1	-159.9	-164	0	0	112.1	R649 T690 D691 K696	R649-E694 IonicContact CZ-OE2 2.66Å; R649-E694 IonicContact NH1-OE2 3.39Å; R649-E694 PolarHBondContact NH1-OE2 2.68Å; R649-E694 IonicContact NH2-OE2 3.54Å; T690-E694 PolarHBondContact O-N 3.41Å; D691-E694 PolarHBondContact O-N 2.96Å; E694-K696 PolarHBondContact O-N 3.31Å
695	D	82	Confident	85.8	Confident	77 Å²	77	49.3 Å²	49.3	41%	0.412	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.9	177.2	-77	-0.8	0	0	0	113.7	P652 D691 D697	P652-D695 WeakPolarHBondContact CD-OD2 3.35Å; P652-D695 HydrophobicContact CG-CB 4.48Å; P652-D695 WeakPolarHBondContact CG-OD2 3.34Å; D691-D695 PolarHBondContact O-N 3.36Å; D695-D697 VanDerWaalsContact C-N 3.29Å; D695-D697 PolarHBondContact O-N 3.36Å
696	K	81.5	Confident	85.7	Confident	158 Å²	158	52.4 Å²	52.4	69%	0.687	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	18.7	176.6	-45.1	-170.6	176.6	179.3	0	116	L692 I693 E694 L698 Y739	L692-K696 PolarHBondContact O-N 2.93Å; I693-K696 PolarHBondContact O-N 3.45Å; E694-K696 PolarHBondContact O-N 3.31Å; K696-L698 VanDerWaalsContact C-N 3.26Å; K696-L698 PolarHBondContact O-N 2.86Å; K696-Y739 WeakPolarHBondContact CA-OH 3.3Å; K696-Y739 WeakPolarHBondContact CB-OH 3.5Å; K696-Y739 WeakPolarHBondContact CG-OH 3.26Å
697	D	83	Confident	85.6	Confident	44 Å²	44	53 Å²	53	24%	0.235	25%	0.25	C	C	.	.			trans	-86.1	64.9	-178.7	-159.8	-29.9	0	0	0	111.5	L692 D695 E699 K700 L701	L692-D697 HydrophobicContact CD2-CB 4.11Å; L692-D697 PolarHBondContact O-N 3.29Å; D695-D697 VanDerWaalsContact C-N 3.29Å; D695-D697 PolarHBondContact O-N 3.36Å; D697-E699 VanDerWaalsContact C-N 3.26Å; D697-E699 PolarHBondContact O-N 3.44Å; D697-K700 PolarHBondContact O-N 3.42Å; D697-K700 WeakPolarHBondContact OD1-CB 3.37Å; D697-K700 VanDerWaalsContact OD1-CG 3.27Å; D697-K700 WeakPolarHBondContact OD1-CG 3.45Å; D697-K700 PolarHBondContact OD1-N 3.01Å; D697-K700 WeakPolarHBondContact OD2-CD 2.84Å; D697-K700 WeakPolarHBondContact OD2-CE 3.39Å; D697-K700 IonicContact OD2-NZ 2.74Å; D697-K700 PolarHBondContact OD2-NZ 2.96Å; D697-L701 PolarHBondContact O-N 3.1Å
698	L	82.1	Confident	85.5	Confident	57 Å²	57	47.7 Å²	47.7	30%	0.298	23%	0.227	S	C	.	.	H	α-helix	trans	-68.9	-23	-174.4	-60.4	179.1	0	0	0	113	K696 L701 D702 Y739	K696-L698 VanDerWaalsContact C-N 3.26Å; K696-L698 PolarHBondContact O-N 2.86Å; L698-L701 HydrophobicContact CD2-CD2 4.08Å; L698-D702 PolarHBondContact O-N 3.05Å; L698-Y739 HydrophobicContact CD1-CE1 4.1Å; L698-Y739 HydrophobicContact CD1-CE2 4.45Å; L698-Y739 HydrophobicContact CD2-CE2 4.16Å
699	E	81.6	Confident	85.3	Confident	171 Å²	171	49.6 Å²	49.6	80%	0.799	24%	0.235	S	C	*	.	H	α-helix	trans	-71.9	-45.4	177.6	-66	-174.4	-173.3	0	0	111.8	D697 L701 L703	D697-E699 VanDerWaalsContact C-N 3.26Å; D697-E699 PolarHBondContact O-N 3.44Å; E699-L701 VanDerWaalsContact C-N 3.3Å; E699-L701 PolarHBondContact O-N 2.82Å; E699-L703 WeakPolarHBondContact O-CB 3.47Å; E699-L703 PolarHBondContact O-N 2.86Å
700	K	82.2	Confident	85.2	Confident	88 Å²	88	56.1 Å²	56.1	38%	0.383	26%	0.26	S	S	.	.	H	α-helix	trans	-64	-38.8	172.2	-71.1	-179.8	-160.7	147.4	0	111.2	L692 D697 L703 I704	L692-K700 HydrophobicContact CD1-CB 4.49Å; D697-K700 PolarHBondContact O-N 3.42Å; D697-K700 WeakPolarHBondContact OD1-CB 3.37Å; D697-K700 VanDerWaalsContact OD1-CG 3.27Å; D697-K700 WeakPolarHBondContact OD1-CG 3.45Å; D697-K700 PolarHBondContact OD1-N 3.01Å; D697-K700 WeakPolarHBondContact OD2-CD 2.84Å; D697-K700 WeakPolarHBondContact OD2-CE 3.39Å; D697-K700 IonicContact OD2-NZ 2.74Å; D697-K700 PolarHBondContact OD2-NZ 2.96Å; K700-L703 PolarHBondContact O-N 3.41Å; K700-I704 WeakPolarHBondContact O-CB 3.04Å; K700-I704 VanDerWaalsContact O-CG1 3.26Å; K700-I704 WeakPolarHBondContact O-CG1 3.4Å; K700-I704 PolarHBondContact O-N 3.1Å
701	L	87.1	Confident	85	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-53.7	177.9	-177.3	68.8	0	0	0	112.4	C689 L692 I693 D697 L698 E699 L703 I704 I705 V735	C689-L701 HydrophobicContact CB-CD1 3.74Å; L692-L701 HydrophobicContact CD1-CB 4.46Å; L692-L701 HydrophobicContact CD1-CD1 4.43Å; I693-L701 HydrophobicContact CD1-CD2 4.09Å; I693-L701 HydrophobicContact CG1-CD2 3.47Å; I693-L701 VanDerWaalsContact CG1-CD2 3.47Å; D697-L701 PolarHBondContact O-N 3.1Å; L698-L701 HydrophobicContact CD2-CD2 4.08Å; E699-L701 VanDerWaalsContact C-N 3.3Å; E699-L701 PolarHBondContact O-N 2.82Å; L701-L703 VanDerWaalsContact C-N 3.31Å; L701-L703 PolarHBondContact O-N 3.34Å; L701-I704 PolarHBondContact O-N 3.27Å; L701-I705 HydrophobicContact CD1-CD1 3.88Å; L701-I705 HydrophobicContact CD1-CG1 4.42Å; L701-I705 HydrophobicContact CD2-CD1 4.5Å; L701-I705 HydrophobicContact CG-CD1 3.75Å; L701-I705 VanDerWaalsContact O-CG1 3.3Å; L701-I705 WeakPolarHBondContact O-CG1 3.4Å; L701-I705 PolarHBondContact O-N 3.1Å; L701-V735 HydrophobicContact CD2-CG2 4.3Å
702	D	84.3	Confident	84.8	Confident	40 Å²	40	53.5 Å²	53.5	21%	0.214	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-43.2	178.1	175.5	84.5	0	0	0	111.4	L698 I704 I705 R706	L698-D702 PolarHBondContact O-N 3.05Å; D702-I704 VanDerWaalsContact C-N 3.33Å; D702-I704 PolarHBondContact O-N 3.04Å; D702-I705 PolarHBondContact O-N 2.93Å; D702-R706 VanDerWaalsContact CG-NE 3.32Å; D702-R706 WeakPolarHBondContact O-CB 3.24Å; D702-R706 WeakPolarHBondContact O-CG 3.44Å; D702-R706 PolarHBondContact O-N 3.14Å; D702-R706 IonicContact OD1-CZ 2.84Å; D702-R706 IonicContact OD1-NE 2.73Å; D702-R706 PolarHBondContact OD1-NE 3.22Å; D702-R706 IonicContact OD1-NH2 2.7Å; D702-R706 PolarHBondContact OD1-NH2 2.8Å; D702-R706 IonicContact OD2-CZ 2.74Å; D702-R706 IonicContact OD2-NE 3.17Å; D702-R706 PolarHBondContact OD2-NE 3.32Å; D702-R706 IonicContact OD2-NH2 3.54Å; D702-R706 PolarHBondContact OD2-NH2 2.94Å
703	L	86.5	Confident	84	Confident	66 Å²	66	58.3 Å²	58.3	35%	0.346	27%	0.267	S	S	.	.	H	α-helix	trans	-67.4	-30.9	-179.3	-174.1	50.2	0	0	0	113.3	L660 E699 K700 L701 Y707	L660-L703 HydrophobicContact CD2-CD2 3.65Å; L660-L703 HydrophobicContact CD2-CG 4.38Å; E699-L703 WeakPolarHBondContact O-CB 3.47Å; E699-L703 PolarHBondContact O-N 2.86Å; K700-L703 PolarHBondContact O-N 3.41Å; L701-L703 VanDerWaalsContact C-N 3.31Å; L701-L703 PolarHBondContact O-N 3.34Å; L703-Y707 WeakPolarHBondContact O-CB 3.43Å; L703-Y707 PolarHBondContact O-N 3.32Å
704	I	87.9	Confident	83.4	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-75.6	-45.2	173.2	-71.9	172.9	0	0	0	110.7	L660 I663 L667 Y688 L692 K700 L701 D702 R706 Y707 M708	L660-I704 HydrophobicContact CD1-CD1 3.87Å; L660-I704 HydrophobicContact CD1-CG1 3.69Å; I663-I704 HydrophobicContact CG2-CD1 3.91Å; L667-I704 HydrophobicContact CD1-CG2 3.91Å; Y688-I704 HydrophobicContact CE1-CD1 3.7Å; L692-I704 HydrophobicContact CD1-CD1 4.22Å; K700-I704 WeakPolarHBondContact O-CB 3.04Å; K700-I704 VanDerWaalsContact O-CG1 3.26Å; K700-I704 WeakPolarHBondContact O-CG1 3.4Å; K700-I704 PolarHBondContact O-N 3.1Å; L701-I704 PolarHBondContact O-N 3.27Å; D702-I704 VanDerWaalsContact C-N 3.33Å; D702-I704 PolarHBondContact O-N 3.04Å; I704-R706 PolarHBondContact O-N 2.86Å; I704-Y707 WeakPolarHBondContact O-CA 3.24Å; I704-Y707 WeakPolarHBondContact O-CB 3.29Å; I704-Y707 PolarHBondContact O-N 2.82Å; I704-M708 HydrophobicContact CG2-CG 4.37Å; I704-M708 HydrophobicContact CG2-SD 3.91Å; I704-M708 WeakPolarHBondContact O-CG 3.43Å; I704-M708 PolarHBondContact O-N 3.42Å
705	I	88.8	Confident	82.6	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-44.5	178.1	-67.1	165.4	0	0	0	111	L701 D702 Y707 M708 K709 F724 I731 L743 I745	L701-I705 HydrophobicContact CD1-CD1 3.88Å; L701-I705 HydrophobicContact CD1-CG1 4.42Å; L701-I705 HydrophobicContact CD2-CD1 4.5Å; L701-I705 HydrophobicContact CG-CD1 3.75Å; L701-I705 VanDerWaalsContact O-CG1 3.3Å; L701-I705 WeakPolarHBondContact O-CG1 3.4Å; L701-I705 PolarHBondContact O-N 3.1Å; D702-I705 PolarHBondContact O-N 2.93Å; I705-Y707 PolarHBondContact O-N 3.37Å; I705-M708 PolarHBondContact O-N 3.3Å; I705-K709 VanDerWaalsContact O-CB 3.27Å; I705-K709 WeakPolarHBondContact O-CB 3.47Å; I705-K709 PolarHBondContact O-N 3.26Å; I705-F724 HydrophobicContact CG2-CE2 4.42Å; I705-F724 HydrophobicContact CG2-CZ 4.27Å; I705-I731 HydrophobicContact CD1-CD1 4.12Å; I705-I731 HydrophobicContact CD1-CG2 3.88Å; I705-I731 HydrophobicContact CG1-CD1 4.21Å; I705-L743 HydrophobicContact CD1-CD2 3.55Å; I705-I745 HydrophobicContact CG2-CD1 3.61Å; I705-I745 HydrophobicContact CG2-CG1 3.95Å; I705-I745 HydrophobicContact CG2-CG2 4.22Å
706	R	87.7	Confident	81.5	Confident	72 Å²	72	65.2 Å²	65.2	27%	0.272	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-24.6	173.6	-71.4	-174.9	-159.8	-88.7	-8.3	113.6	D702 I704 R710 T746	D702-R706 VanDerWaalsContact CG-NE 3.32Å; D702-R706 WeakPolarHBondContact O-CB 3.24Å; D702-R706 WeakPolarHBondContact O-CG 3.44Å; D702-R706 PolarHBondContact O-N 3.14Å; D702-R706 IonicContact OD1-CZ 2.84Å; D702-R706 IonicContact OD1-NE 2.73Å; D702-R706 PolarHBondContact OD1-NE 3.22Å; D702-R706 IonicContact OD1-NH2 2.7Å; D702-R706 PolarHBondContact OD1-NH2 2.8Å; D702-R706 IonicContact OD2-CZ 2.74Å; D702-R706 IonicContact OD2-NE 3.17Å; D702-R706 PolarHBondContact OD2-NE 3.32Å; D702-R706 IonicContact OD2-NH2 3.54Å; D702-R706 PolarHBondContact OD2-NH2 2.94Å; I704-R706 PolarHBondContact O-N 2.86Å; R706-R710 WeakPolarHBondContact O-CG 3.39Å; R706-R710 PolarHBondContact O-NE 3Å; R706-T746 PolarHBondContact NH1-O 3.32Å; R706-T746 PolarHBondContact NH1-OG1 2.79Å
707	Y	87.8	Confident	80.9	Confident	25 Å²	25	62.3 Å²	62.3	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-80	-46.8	176.3	-176.3	-107.6	0	0	0	111	K664 L667 R668 L703 I704 I705 R710 L711	K664-Y707 HydrophobicContact CB-CD1 4.13Å; K664-Y707 HydrophobicContact CB-CE1 3.65Å; K664-Y707 HydrophobicContact CG-CD1 3.76Å; K664-Y707 HydrophobicContact CG-CD2 4.48Å; K664-Y707 HydrophobicContact CG-CE1 3.82Å; K664-Y707 HydrophobicContact CG-CG 4.08Å; K664-Y707 WeakPolarHBondContact O-CE1 3.42Å; K664-Y707 PolarHBondContact O-OH 3.15Å; L667-Y707 HydrophobicContact CB-CE1 4.35Å; R668-Y707 PolarHBondContact NE-OH 3.22Å; R668-Y707 PolarHBondContact NH2-OH 3.16Å; L703-Y707 WeakPolarHBondContact O-CB 3.43Å; L703-Y707 PolarHBondContact O-N 3.32Å; I704-Y707 WeakPolarHBondContact O-CA 3.24Å; I704-Y707 WeakPolarHBondContact O-CB 3.29Å; I704-Y707 PolarHBondContact O-N 2.82Å; I705-Y707 PolarHBondContact O-N 3.37Å; Y707-R710 PolarHBondContact O-N 3.45Å; Y707-L711 HydrophobicContact CD1-CD1 3.86Å; Y707-L711 HydrophobicContact CE1-CD1 3.34Å; Y707-L711 HydrophobicContact CE1-CG 4.21Å; Y707-L711 HydrophobicContact CE2-CD1 4.48Å; Y707-L711 PolarHBondContact O-N 2.65Å
708	M	87.1	Confident	80.4	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.015	32%	0.316	C	S	.	.	H	α-helix	trans	-60	-45.9	173.6	-69.6	176.1	61	0	0	112.2	L667 V685 I704 I705 R710 L711 M712 F724 I727	L667-M708 HydrophobicContact CD1-CG 3.94Å; L667-M708 HydrophobicContact CD1-SD 4.18Å; L667-M708 HydrophobicContact CD2-CG 4.37Å; L667-M708 HydrophobicContact CD2-SD 4.26Å; V685-M708 HydrophobicContact CG1-CE 3.7Å; V685-M708 HydrophobicContact CG1-SD 3.89Å; I704-M708 HydrophobicContact CG2-CG 4.37Å; I704-M708 HydrophobicContact CG2-SD 3.91Å; I704-M708 WeakPolarHBondContact O-CG 3.43Å; I704-M708 PolarHBondContact O-N 3.42Å; I705-M708 PolarHBondContact O-N 3.3Å; M708-R710 VanDerWaalsContact C-N 3.26Å; M708-R710 PolarHBondContact O-N 3.49Å; M708-L711 PolarHBondContact O-N 2.66Å; M708-L711 VanDerWaalsContact O-N 3.14Å; M708-M712 HydrophobicContact CB-SD 4.07Å; M708-M712 HydrophobicContact CE-SD 3.87Å; M708-M712 WeakPolarHBondContact O-CB 3.33Å; M708-M712 WeakPolarHBondContact O-CG 3.22Å; M708-M712 PolarHBondContact O-N 3.03Å; M708-F724 HydrophobicContact CB-CD2 4.04Å; M708-F724 HydrophobicContact CB-CE2 3.98Å; M708-I727 HydrophobicContact CE-CD1 3.67Å; M708-I727 HydrophobicContact CE-CG2 4.06Å
709	K	85.3	Confident	80.4	Confident	45 Å²	45	64 Å²	64	20%	0.196	32%	0.317	C	S	.	.	H	α-helix	trans	-50.8	-47.6	174.5	-173.7	177.2	177.8	-179.2	0	110.8	I705 Q713 F724 I745 T746	I705-K709 VanDerWaalsContact O-CB 3.27Å; I705-K709 WeakPolarHBondContact O-CB 3.47Å; I705-K709 PolarHBondContact O-N 3.26Å; K709-Q713 WeakPolarHBondContact O-CB 3.22Å; K709-Q713 WeakPolarHBondContact O-CG 3.41Å; K709-Q713 PolarHBondContact O-N 2.84Å; K709-Q713 VanDerWaalsContact O-N 3.09Å; K709-F724 HydrophobicContact CB-CE1 4.24Å; K709-F724 HydrophobicContact CB-CE2 3.83Å; K709-F724 HydrophobicContact CB-CZ 3.56Å; K709-F724 HydrophobicContact CG-CE1 4.18Å; K709-F724 HydrophobicContact CG-CZ 3.96Å; K709-I745 HydrophobicContact CD-CG2 3.88Å; K709-T746 PolarHBondContact NZ-OXT 3.14Å
710	R	85.6	Confident	80.6	Confident	138 Å²	138	56 Å²	56	52%	0.521	28%	0.28	S	S	.	.	H	α-helix	trans	-68	-41.8	178.9	-76.5	-178.8	-70.6	166.8	-3.5	113.4	R706 Y707 M708 Q714	R706-R710 WeakPolarHBondContact O-CG 3.39Å; R706-R710 PolarHBondContact O-NE 3Å; Y707-R710 PolarHBondContact O-N 3.45Å; M708-R710 VanDerWaalsContact C-N 3.26Å; M708-R710 PolarHBondContact O-N 3.49Å; R710-Q714 VanDerWaalsContact O-CB 3.26Å; R710-Q714 WeakPolarHBondContact O-CB 3.32Å; R710-Q714 VanDerWaalsContact O-CD 3.29Å; R710-Q714 WeakPolarHBondContact O-CG 3.21Å; R710-Q714 PolarHBondContact O-N 3.22Å
711	L	83.1	Confident	80.6	Confident	20 Å²	20	53.7 Å²	53.7	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-68	-51.2	178.7	-72.3	177.3	0	0	0	111.9	R668 V671 Y707 M708 Q714 S715	R668-L711 HydrophobicContact CB-CD1 4.21Å; V671-L711 HydrophobicContact CG1-CB 4.32Å; Y707-L711 HydrophobicContact CD1-CD1 3.86Å; Y707-L711 HydrophobicContact CE1-CD1 3.34Å; Y707-L711 HydrophobicContact CE1-CG 4.21Å; Y707-L711 HydrophobicContact CE2-CD1 4.48Å; Y707-L711 PolarHBondContact O-N 2.65Å; M708-L711 PolarHBondContact O-N 2.66Å; M708-L711 VanDerWaalsContact O-N 3.14Å; L711-Q714 PolarHBondContact O-N 3.36Å; L711-S715 PolarHBondContact O-N 3.16Å
712	M	81.3	Confident	80.5	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-75.4	-30.1	-170.8	-61	166.9	94	0	0	111.7	W670 V671 M708 S715 W720 A723 F724 I727	W670-M712 HydrophobicContact CH2-CE 4.46Å; W670-M712 HydrophobicContact CZ3-CE 4.19Å; V671-M712 HydrophobicContact CG1-CG 4.39Å; V671-M712 HydrophobicContact CG2-CG 3.94Å; M708-M712 HydrophobicContact CB-SD 4.07Å; M708-M712 HydrophobicContact CE-SD 3.87Å; M708-M712 WeakPolarHBondContact O-CB 3.33Å; M708-M712 WeakPolarHBondContact O-CG 3.22Å; M708-M712 PolarHBondContact O-N 3.03Å; M712-S715 PolarHBondContact O-OG 2.86Å; M712-W720 HydrophobicContact CE-CE3 3.79Å; M712-W720 HydrophobicContact CE-CZ3 4.31Å; M712-W720 HydrophobicContact CG-CE3 4.42Å; M712-A723 HydrophobicContact CE-CB 4.06Å; M712-F724 HydrophobicContact CB-CB 4.06Å; M712-F724 HydrophobicContact CE-CB 4.01Å; M712-F724 HydrophobicContact SD-CB 3.78Å; M712-F724 HydrophobicContact SD-CD2 3.86Å; M712-F724 HydrophobicContact SD-CG 4.29Å; M712-I727 HydrophobicContact CE-CD1 4.3Å
713	Q	70.3	Confident	80.6	Confident	106 Å²	106	57.7 Å²	57.7	50%	0.495	29%	0.294	S	S	.	.	H	α-helix	trans	-82.5	-11.9	172.3	-61.1	179.8	-19.5	0	0	113.9	K709	K709-Q713 WeakPolarHBondContact O-CB 3.22Å; K709-Q713 WeakPolarHBondContact O-CG 3.41Å; K709-Q713 PolarHBondContact O-N 2.84Å; K709-Q713 VanDerWaalsContact O-N 3.09Å
714	Q	72.1	Confident	80.7	Confident	152 Å²	152	54.9 Å²	54.9	71%	0.71	28%	0.279	S	S	*	.	H	α-helix	trans	-84.4	-19.5	168.9	-80	174.9	-3.2	0	0	112.6	R710 L711	R710-Q714 VanDerWaalsContact O-CB 3.26Å; R710-Q714 WeakPolarHBondContact O-CB 3.32Å; R710-Q714 VanDerWaalsContact O-CD 3.29Å; R710-Q714 WeakPolarHBondContact O-CG 3.21Å; R710-Q714 PolarHBondContact O-N 3.22Å; L711-Q714 PolarHBondContact O-N 3.36Å
715	S	67	Low	80.7	Confident	31 Å²	31	58.7 Å²	58.7	22%	0.217	30%	0.3	C	S	.	.	S	Bend	trans	-69.6	137.9	170.3	79.1	0	0	0	0	110.3	L711 M712 E717 W720	L711-S715 PolarHBondContact O-N 3.16Å; M712-S715 PolarHBondContact O-OG 2.86Å; S715-E717 PolarHBondContact O-N 3.21Å; S715-W720 WeakPolarHBondContact OG-CB 3.14Å
716	V	58.8	Low	80.8	Confident	149 Å²	149	63.3 Å²	63.3	90%	0.903	32%	0.32	S	S	*	.	S	Bend	trans	-77.1	-7.2	-177.5	-173.7	0	0	0	0	111.7
717	E	69.5	Low	80.9	Confident	96 Å²	96	60 Å²	60	45%	0.449	31%	0.307	S	S	.	.			trans	-95.9	123.4	-170.9	-64	-175.2	-177.9	0	0	112	T675 S715 V719 W720	T675-E717 VanDerWaalsContact O-OE2 3.08Å; S715-E717 PolarHBondContact O-N 3.21Å; E717-V719 PolarHBondContact O-N 3.38Å; E717-V719 VanDerWaalsContact O-N 3.09Å; E717-W720 PolarHBondContact O-N 3.42Å
718	S	72.8	Confident	81	Confident	85 Å²	85	60.3 Å²	60.3	59%	0.594	31%	0.311	S	S	*	.	H	α-helix	trans	-61.7	-21.3	-177.3	57.5	0	0	0	0	114.1	S721 M722	S718-S721 PolarHBondContact O-N 3.31Å; S718-M722 WeakPolarHBondContact O-CG 3.26Å; S718-M722 PolarHBondContact O-N 3.36Å; S718-M722 VanDerWaalsContact O-N 3.08Å
719	V	82.2	Confident	81.1	Confident	52 Å²	52	65.4 Å²	65.4	32%	0.315	34%	0.338	S	S	.	.	H	α-helix	trans	-66.8	-42.3	-179.4	-167.9	0	0	0	0	111.5	P677 E717 M722 A723	P677-V719 HydrophobicContact CG-CG1 4.09Å; E717-V719 PolarHBondContact O-N 3.38Å; E717-V719 VanDerWaalsContact O-N 3.09Å; V719-M722 PolarHBondContact O-N 2.93Å; V719-A723 PolarHBondContact O-N 3.46Å
720	W	84.9	Confident	81.2	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-69.4	-33.1	178.1	-74.2	96.4	0	0	0	112.7	W670 V671 I674 T675 P677 M712 S715 E717 A723 F724	W670-W720 HydrophobicContact CD2-CH2 4.08Å; W670-W720 AromaticContact CD2-CZ3 3.95Å; W670-W720 HydrophobicContact CD2-CZ3 3.95Å; W670-W720 AromaticContact CE3-CZ3 3.92Å; W670-W720 HydrophobicContact CE3-CZ3 3.92Å; W670-W720 HydrophobicContact CG-CH2 4.42Å; W670-W720 HydrophobicContact CH2-CZ3 4.04Å; W670-W720 HydrophobicContact CZ2-CH2 4.35Å; W670-W720 HydrophobicContact CZ2-CZ3 4.05Å; W670-W720 AromaticContact CZ3-CZ3 3.98Å; W670-W720 HydrophobicContact CZ3-CZ3 3.98Å; V671-W720 HydrophobicContact CB-CE3 4.42Å; V671-W720 HydrophobicContact CB-CZ3 4.2Å; V671-W720 HydrophobicContact CG1-CD2 4.49Å; V671-W720 HydrophobicContact CG1-CE3 4.26Å; V671-W720 HydrophobicContact CG2-CE3 3.91Å; V671-W720 HydrophobicContact CG2-CH2 4.35Å; V671-W720 HydrophobicContact CG2-CZ3 3.62Å; I674-W720 HydrophobicContact CB-CZ2 4.28Å; I674-W720 HydrophobicContact CG2-CZ2 4.17Å; I674-W720 WeakPolarHBondContact O-CZ2 3.41Å; T675-W720 PolarHBondContact O-NE1 2.96Å; P677-W720 HydrophobicContact CB-CD2 4.26Å; P677-W720 HydrophobicContact CB-CE3 3.94Å; P677-W720 HydrophobicContact CB-CH2 3.7Å; P677-W720 HydrophobicContact CB-CZ2 4.01Å; P677-W720 HydrophobicContact CB-CZ3 3.66Å; P677-W720 HydrophobicContact CG-CD2 4.1Å; P677-W720 HydrophobicContact CG-CE3 4.16Å; P677-W720 HydrophobicContact CG-CZ2 4.43Å; P677-W720 HydrophobicContact CG-CZ3 4.37Å; M712-W720 HydrophobicContact CE-CE3 3.79Å; M712-W720 HydrophobicContact CE-CZ3 4.31Å; M712-W720 HydrophobicContact CG-CE3 4.42Å; S715-W720 WeakPolarHBondContact OG-CB 3.14Å; E717-W720 PolarHBondContact O-N 3.42Å; W720-A723 PolarHBondContact O-N 3.12Å; W720-F724 PolarHBondContact O-N 2.94Å
721	S	82.2	Confident	81.4	Confident	39 Å²	39	59.6 Å²	59.6	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-45.5	170.7	-67.2	0	0	0	0	111.7	S718 A723 F724 D725	S718-S721 PolarHBondContact O-N 3.31Å; S721-A723 VanDerWaalsContact C-N 3.32Å; S721-A723 PolarHBondContact O-N 3.48Å; S721-F724 WeakPolarHBondContact O-CB 3.46Å; S721-F724 PolarHBondContact O-N 2.91Å; S721-D725 PolarHBondContact O-N 3.06Å
722	M	84.7	Confident	81.6	Confident	117 Å²	117	60.4 Å²	60.4	58%	0.576	32%	0.323	S	S	*	.	H	α-helix	trans	-63.7	-35.4	175.5	-71.3	-175.1	-68.7	0	0	112.8	S718 V719 F726	S718-M722 WeakPolarHBondContact O-CG 3.26Å; S718-M722 PolarHBondContact O-N 3.36Å; S718-M722 VanDerWaalsContact O-N 3.08Å; V719-M722 PolarHBondContact O-N 2.93Å; M722-F726 WeakPolarHBondContact O-CB 3.35Å; M722-F726 PolarHBondContact O-N 3.24Å
723	A	86.1	Confident	81.9	Confident	7 Å²	7	64.2 Å²	64.2	6%	0.058	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-41.2	173.8	0	0	0	0	0	111.9	P677 I682 M712 V719 W720 S721 F726 I727	P677-A723 HydrophobicContact CB-CB 4.22Å; P677-A723 HydrophobicContact CG-CB 3.71Å; I682-A723 HydrophobicContact CD1-CB 3.86Å; I682-A723 HydrophobicContact CG1-CB 4.36Å; M712-A723 HydrophobicContact CE-CB 4.06Å; V719-A723 PolarHBondContact O-N 3.46Å; W720-A723 PolarHBondContact O-N 3.12Å; S721-A723 VanDerWaalsContact C-N 3.32Å; S721-A723 PolarHBondContact O-N 3.48Å; A723-F726 PolarHBondContact O-N 3.49Å; A723-I727 VanDerWaalsContact O-CG1 3.23Å; A723-I727 WeakPolarHBondContact O-CG1 3.49Å; A723-I727 PolarHBondContact O-N 2.99Å
724	F	89.6	Confident	82.6	Confident	7 Å²	7	60.8 Å²	60.8	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-48.3	173.6	176.5	-98.4	0	0	0	111.8	I705 M708 K709 M712 W720 S721 F726 I727 L728	I705-F724 HydrophobicContact CG2-CE2 4.42Å; I705-F724 HydrophobicContact CG2-CZ 4.27Å; M708-F724 HydrophobicContact CB-CD2 4.04Å; M708-F724 HydrophobicContact CB-CE2 3.98Å; K709-F724 HydrophobicContact CB-CE1 4.24Å; K709-F724 HydrophobicContact CB-CE2 3.83Å; K709-F724 HydrophobicContact CB-CZ 3.56Å; K709-F724 HydrophobicContact CG-CE1 4.18Å; K709-F724 HydrophobicContact CG-CZ 3.96Å; M712-F724 HydrophobicContact CB-CB 4.06Å; M712-F724 HydrophobicContact CE-CB 4.01Å; M712-F724 HydrophobicContact SD-CB 3.78Å; M712-F724 HydrophobicContact SD-CD2 3.86Å; M712-F724 HydrophobicContact SD-CG 4.29Å; W720-F724 PolarHBondContact O-N 2.94Å; S721-F724 WeakPolarHBondContact O-CB 3.46Å; S721-F724 PolarHBondContact O-N 2.91Å; F724-F726 VanDerWaalsContact C-N 3.31Å; F724-F726 PolarHBondContact O-N 2.96Å; F724-I727 PolarHBondContact O-N 3.41Å; F724-L728 HydrophobicContact CE1-CB 4.48Å; F724-L728 HydrophobicContact CE1-CD2 3.92Å; F724-L728 HydrophobicContact CZ-CD2 4.21Å; F724-L728 WeakPolarHBondContact O-CB 3.37Å; F724-L728 PolarHBondContact O-N 3.01Å
725	D	88.1	Confident	83.3	Confident	81 Å²	81	53.9 Å²	53.9	43%	0.433	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-40.7	179.4	-67.7	-23.3	0	0	0	111.3	S721 L728 D729	S721-D725 PolarHBondContact O-N 3.06Å; D725-L728 PolarHBondContact O-N 3.44Å; D725-D729 WeakPolarHBondContact O-CB 3.38Å; D725-D729 PolarHBondContact O-N 3.29Å
726	F	89.8	Confident	84.1	Confident	100 Å²	100	57.5 Å²	57.5	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-44.8	174.2	177	-94.1	0	0	0	112.8	I682 M722 A723 F724 L728 N730	I682-F726 HydrophobicContact CG2-CD1 3.58Å; I682-F726 HydrophobicContact CG2-CE1 3.8Å; M722-F726 WeakPolarHBondContact O-CB 3.35Å; M722-F726 PolarHBondContact O-N 3.24Å; A723-F726 PolarHBondContact O-N 3.49Å; F724-F726 VanDerWaalsContact C-N 3.31Å; F724-F726 PolarHBondContact O-N 2.96Å; F726-L728 VanDerWaalsContact C-N 3.28Å; F726-L728 PolarHBondContact O-N 3.39Å; F726-N730 WeakPolarHBondContact CE1-ND2 3.42Å; F726-N730 WeakPolarHBondContact CZ-ND2 3.43Å; F726-N730 PolarHBondContact O-N 3.05Å; F726-N730 PolarHBondContact O-ND2 3.35Å
727	I	89.9	Confident	85.2	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-43.8	176.7	-66.6	166	0	0	0	109.7	W670 I682 V685 V686 M708 M712 A723 F724 N730 I731	W670-I727 HydrophobicContact CH2-CD1 4.37Å; I682-I727 HydrophobicContact CG2-CD1 4.23Å; I682-I727 HydrophobicContact CG2-CG1 3.81Å; V685-I727 HydrophobicContact CB-CD1 4.5Å; V685-I727 HydrophobicContact CG1-CD1 4.29Å; V685-I727 HydrophobicContact CG1-CG2 4.33Å; V686-I727 HydrophobicContact CG2-CB 4.14Å; V686-I727 HydrophobicContact CG2-CG1 3.89Å; V686-I727 HydrophobicContact CG2-CG2 4.04Å; M708-I727 HydrophobicContact CE-CD1 3.67Å; M708-I727 HydrophobicContact CE-CG2 4.06Å; M712-I727 HydrophobicContact CE-CD1 4.3Å; A723-I727 VanDerWaalsContact O-CG1 3.23Å; A723-I727 WeakPolarHBondContact O-CG1 3.49Å; A723-I727 PolarHBondContact O-N 2.99Å; F724-I727 PolarHBondContact O-N 3.41Å; I727-N730 PolarHBondContact O-N 3.01Å; I727-I731 HydrophobicContact CG2-CD1 3.73Å; I727-I731 VanDerWaalsContact O-CG1 3.31Å; I727-I731 WeakPolarHBondContact O-CG1 3.33Å; I727-I731 PolarHBondContact O-N 3.01Å; I727-I731 VanDerWaalsContact O-N 3.08Å
728	L	90.5	Very high	85.6	Confident	31 Å²	31	56.2 Å²	56.2	16%	0.162	31%	0.309	C	S	.	.	H	α-helix	trans	-64.9	-45.9	-179.7	176.9	54.3	0	0	0	112.7	F724 D725 F726 N730 I731 Q732 I745	F724-L728 HydrophobicContact CE1-CB 4.48Å; F724-L728 HydrophobicContact CE1-CD2 3.92Å; F724-L728 HydrophobicContact CZ-CD2 4.21Å; F724-L728 WeakPolarHBondContact O-CB 3.37Å; F724-L728 PolarHBondContact O-N 3.01Å; D725-L728 PolarHBondContact O-N 3.44Å; F726-L728 VanDerWaalsContact C-N 3.28Å; F726-L728 PolarHBondContact O-N 3.39Å; L728-N730 VanDerWaalsContact C-N 3.3Å; L728-N730 PolarHBondContact O-N 3.25Å; L728-I731 PolarHBondContact O-N 3.02Å; L728-Q732 HydrophobicContact CD1-CG 3.82Å; L728-Q732 HydrophobicContact CG-CG 4.28Å; L728-Q732 VanDerWaalsContact O-CG 3.3Å; L728-Q732 WeakPolarHBondContact O-CG 3.45Å; L728-Q732 PolarHBondContact O-N 3.03Å; L728-I745 HydrophobicContact CD1-CD1 3.16Å; L728-I745 HydrophobicContact CD2-CD1 4Å; L728-I745 HydrophobicContact CG-CD1 4.23Å
729	D	89.1	Confident	85.9	Confident	111 Å²	111	56.5 Å²	56.5	59%	0.594	30%	0.298	S	S	*	.	H	α-helix	trans	-58.2	-42.6	177.9	-86.8	-10.5	0	0	0	111.6	D725 Q732 V733	D725-D729 WeakPolarHBondContact O-CB 3.38Å; D725-D729 PolarHBondContact O-N 3.29Å; D729-Q732 PolarHBondContact O-N 3.2Å; D729-V733 WeakPolarHBondContact O-CG2 3.42Å; D729-V733 PolarHBondContact O-N 3.08Å; D729-V733 VanDerWaalsContact O-N 3.08Å
730	N	88.2	Confident	85.5	Confident	59 Å²	59	56.7 Å²	56.7	32%	0.316	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-46.1	176.2	-77.6	-84.9	0	0	0	111.5	V686 F726 I727 L728 Q732 V733 V734	V686-N730 HydrophobicContact CG1-CB 3.82Å; V686-N730 HydrophobicContact CG2-CB 4.32Å; F726-N730 WeakPolarHBondContact CE1-ND2 3.42Å; F726-N730 WeakPolarHBondContact CZ-ND2 3.43Å; F726-N730 PolarHBondContact O-N 3.05Å; F726-N730 PolarHBondContact O-ND2 3.35Å; I727-N730 PolarHBondContact O-N 3.01Å; L728-N730 VanDerWaalsContact C-N 3.3Å; L728-N730 PolarHBondContact O-N 3.25Å; N730-Q732 PolarHBondContact O-N 3.22Å; N730-V733 PolarHBondContact O-N 3.14Å; N730-V734 WeakPolarHBondContact O-CG2 3.41Å; N730-V734 PolarHBondContact O-N 3.38Å; N730-V734 VanDerWaalsContact O-N 3.12Å
731	I	89.1	Confident	85	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-58.4	-47	176	-72.6	169.4	0	0	0	111	C689 I693 I705 I727 L728 V733 V734 V735	C689-I731 HydrophobicContact CB-CD1 3.48Å; C689-I731 VanDerWaalsContact CB-CD1 3.48Å; C689-I731 HydrophobicContact CB-CG1 3.76Å; I693-I731 HydrophobicContact CD1-CG2 4.24Å; I705-I731 HydrophobicContact CD1-CD1 4.12Å; I705-I731 HydrophobicContact CD1-CG2 3.88Å; I705-I731 HydrophobicContact CG1-CD1 4.21Å; I727-I731 HydrophobicContact CG2-CD1 3.73Å; I727-I731 VanDerWaalsContact O-CG1 3.31Å; I727-I731 WeakPolarHBondContact O-CG1 3.33Å; I727-I731 PolarHBondContact O-N 3.01Å; I727-I731 VanDerWaalsContact O-N 3.08Å; L728-I731 PolarHBondContact O-N 3.02Å; I731-V733 VanDerWaalsContact C-N 3.31Å; I731-V733 PolarHBondContact O-N 3.33Å; I731-V734 PolarHBondContact O-N 3.24Å; I731-V734 VanDerWaalsContact O-N 3.14Å; I731-V735 HydrophobicContact CG2-CG2 4.17Å; I731-V735 WeakPolarHBondContact O-CG2 3.28Å; I731-V735 PolarHBondContact O-N 3.08Å
732	Q	88.1	Confident	84.9	Confident	37 Å²	37	63.7 Å²	63.7	17%	0.173	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-38.4	180	-70.7	-71.6	5.5	0	0	112.3	L728 D729 N730 H736 L743	L728-Q732 HydrophobicContact CD1-CG 3.82Å; L728-Q732 HydrophobicContact CG-CG 4.28Å; L728-Q732 VanDerWaalsContact O-CG 3.3Å; L728-Q732 WeakPolarHBondContact O-CG 3.45Å; L728-Q732 PolarHBondContact O-N 3.03Å; D729-Q732 PolarHBondContact O-N 3.2Å; N730-Q732 PolarHBondContact O-N 3.22Å; Q732-H736 WeakPolarHBondContact O-CB 3.47Å; Q732-H736 PolarHBondContact O-N 3.43Å; Q732-L743 PolarHBondContact NE2-O 2.72Å
733	V	87.2	Confident	84.4	Confident	81 Å²	81	59.4 Å²	59.4	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-42.6	174.6	169.6	0	0	0	0	111.3	D729 N730 I731 Q737	D729-V733 WeakPolarHBondContact O-CG2 3.42Å; D729-V733 PolarHBondContact O-N 3.08Å; D729-V733 VanDerWaalsContact O-N 3.08Å; N730-V733 PolarHBondContact O-N 3.14Å; I731-V733 VanDerWaalsContact C-N 3.31Å; I731-V733 PolarHBondContact O-N 3.33Å; V733-Q737 VanDerWaalsContact CG1-NE2 3.31Å; V733-Q737 VanDerWaalsContact O-CG 3.26Å; V733-Q737 WeakPolarHBondContact O-CG 3.47Å; V733-Q737 PolarHBondContact O-N 3.05Å; V733-Q737 VanDerWaalsContact O-N 3.08Å
734	V	85.7	Confident	83.7	Confident	35 Å²	35	67.9 Å²	67.9	21%	0.212	36%	0.364	C	S	.	.	H	α-helix	trans	-69.2	-47.4	178.1	178.6	0	0	0	0	111.4	T690 I693 N730 I731 H736 Q737 A738	T690-V734 HydrophobicContact CG2-CG1 4.11Å; T690-V734 HydrophobicContact CG2-CG2 4.28Å; I693-V734 HydrophobicContact CB-CG1 4.18Å; I693-V734 HydrophobicContact CD1-CB 3.94Å; I693-V734 HydrophobicContact CD1-CG1 3.73Å; I693-V734 HydrophobicContact CG2-CG1 3.97Å; N730-V734 WeakPolarHBondContact O-CG2 3.41Å; N730-V734 PolarHBondContact O-N 3.38Å; N730-V734 VanDerWaalsContact O-N 3.12Å; I731-V734 PolarHBondContact O-N 3.24Å; I731-V734 VanDerWaalsContact O-N 3.14Å; V734-H736 VanDerWaalsContact C-N 3.32Å; V734-H736 PolarHBondContact O-N 3.12Å; V734-Q737 PolarHBondContact O-N 3.3Å; V734-Q737 VanDerWaalsContact O-N 3.11Å; V734-A738 PolarHBondContact O-N 3.4Å
735	V	85.1	Confident	82.5	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-59.8	-43	177.4	179	0	0	0	0	110.7	I693 L701 I731 Q737 A738 Y739	I693-V735 HydrophobicContact CD1-CG2 3.53Å; I693-V735 HydrophobicContact CG1-CG2 3.89Å; I693-V735 HydrophobicContact CG2-CG2 4.31Å; L701-V735 HydrophobicContact CD2-CG2 4.3Å; I731-V735 HydrophobicContact CG2-CG2 4.17Å; I731-V735 WeakPolarHBondContact O-CG2 3.28Å; I731-V735 PolarHBondContact O-N 3.08Å; V735-Q737 VanDerWaalsContact C-N 3.32Å; V735-Q737 PolarHBondContact O-N 3.38Å; V735-A738 PolarHBondContact O-N 3.15Å; V735-Y739 HydrophobicContact CG1-CD2 4.37Å; V735-Y739 WeakPolarHBondContact O-CB 3.36Å; V735-Y739 PolarHBondContact O-N 3.47Å
736	H	84.6	Confident	80.6	Confident	106 Å²	106	71.9 Å²	71.9	49%	0.491	39%	0.391	S	S	.	.	H	α-helix	trans	-64.1	-35.2	176.4	-175.4	-71.2	0	0	0	112.6	Q732 V734 G740 S741	Q732-H736 WeakPolarHBondContact O-CB 3.47Å; Q732-H736 PolarHBondContact O-N 3.43Å; V734-H736 VanDerWaalsContact C-N 3.32Å; V734-H736 PolarHBondContact O-N 3.12Å; H736-G740 VanDerWaalsContact O-CA 3.28Å; H736-G740 WeakPolarHBondContact O-CA 3.49Å; H736-G740 PolarHBondContact O-N 3Å; H736-S741 WeakPolarHBondContact CA-O 3.42Å
737	Q	80.9	Confident	80.1	Confident	153 Å²	153	70.5 Å²	70.5	72%	0.715	39%	0.389	S	S	*	.	H	α-helix	trans	-71.2	-39.1	175.3	-75.3	174.9	27.2	0	0	112.8	V733 V734 V735	V733-Q737 VanDerWaalsContact CG1-NE2 3.31Å; V733-Q737 VanDerWaalsContact O-CG 3.26Å; V733-Q737 WeakPolarHBondContact O-CG 3.47Å; V733-Q737 PolarHBondContact O-N 3.05Å; V733-Q737 VanDerWaalsContact O-N 3.08Å; V734-Q737 PolarHBondContact O-N 3.3Å; V734-Q737 VanDerWaalsContact O-N 3.11Å; V735-Q737 VanDerWaalsContact C-N 3.32Å; V735-Q737 PolarHBondContact O-N 3.38Å
738	A	78.3	Confident	79.6	Confident	65 Å²	65	74.1 Å²	74.1	54%	0.537	41%	0.409	S	S	.	.	H	α-helix	trans	-82.3	-33.1	-176.7	0	0	0	0	0	113.9	I693 V734 V735	I693-A738 HydrophobicContact CG2-CB 4.11Å; V734-A738 PolarHBondContact O-N 3.4Å; V735-A738 PolarHBondContact O-N 3.15Å
739	Y	78.8	Confident	79	Confident	92 Å²	92	76.5 Å²	76.5	36%	0.361	42%	0.422	S	S	.	.	H	α-helix	trans	-124.5	-4.2	-171.2	-65.3	-89.7	0	0	0	114.8	I693 K696 L698 V735 S741	I693-Y739 HydrophobicContact CG2-CD2 4.32Å; I693-Y739 HydrophobicContact CG2-CE2 3.81Å; K696-Y739 WeakPolarHBondContact CA-OH 3.3Å; K696-Y739 WeakPolarHBondContact CB-OH 3.5Å; K696-Y739 WeakPolarHBondContact CG-OH 3.26Å; L698-Y739 HydrophobicContact CD1-CE1 4.1Å; L698-Y739 HydrophobicContact CD1-CE2 4.45Å; L698-Y739 HydrophobicContact CD2-CE2 4.16Å; V735-Y739 HydrophobicContact CG1-CD2 4.37Å; V735-Y739 WeakPolarHBondContact O-CB 3.36Å; V735-Y739 PolarHBondContact O-N 3.47Å; Y739-S741 PolarHBondContact O-N 3.27Å
740	G	74.9	Confident	78.4	Confident	56 Å²	56	74.5 Å²	74.5	58%	0.577	41%	0.412	S	S	*	.	S	Bend	trans	64.8	20.5	179.1	0	0	0	0	0	114.4	H736	H736-G740 VanDerWaalsContact O-CA 3.28Å; H736-G740 WeakPolarHBondContact O-CA 3.49Å; H736-G740 PolarHBondContact O-N 3Å
741	S	75.2	Confident	77.8	Confident	76 Å²	76	75.4 Å²	75.4	53%	0.531	42%	0.418	S	S	.	.	S	Bend	trans	-147.9	156.9	-179	-76.7	0	0	0	0	110.4	H736 Y739	H736-S741 WeakPolarHBondContact CA-O 3.42Å; Y739-S741 PolarHBondContact O-N 3.27Å
742	I	78.9	Confident	77.1	Confident	113 Å²	113	80.4 Å²	80.4	58%	0.579	45%	0.446	S	S	*	.			trans	-93.1	146.8	176.7	57.8	172.5	0	0	0	111.6	K744	I742-K744 PolarHBondContact O-N 2.83Å
743	L	75.1	Confident	76.3	Confident	28 Å²	28	83.5 Å²	83.5	15%	0.147	47%	0.465	C	S	.	.			trans	-73.6	115.8	176.8	-156.1	85	0	0	0	109.6	I705 Q732 I745	I705-L743 HydrophobicContact CD1-CD2 3.55Å; Q732-L743 PolarHBondContact NE2-O 2.72Å; L743-I745 HydrophobicContact CD2-CD1 4.22Å; L743-I745 HydrophobicContact CD2-CG1 3.96Å; L743-I745 HydrophobicContact CG-CG1 4.45Å; L743-I745 PolarHBondContact O-N 3.01Å; L743-I745 VanDerWaalsContact O-N 3.12Å
744	K	71.4	Confident	75.4	Confident	184 Å²	184	83.7 Å²	83.7	80%	0.8	46%	0.463	S	S	*	.			trans	-80.3	90.8	179.5	-72.9	-174.6	178.7	178.9	0	111.4	I742 T746	I742-K744 PolarHBondContact O-N 2.83Å; K744-T746 PolarHBondContact O-N 3.29Å
745	I	63.7	Low	74.6	Confident	33 Å²	33	87.8 Å²	87.8	17%	0.169	48%	0.484	C	S	.	.			trans	-88.3	96.4	178.4	-58.5	148.6	0	0	0	110	I705 K709 L728 L743	I705-I745 HydrophobicContact CG2-CD1 3.61Å; I705-I745 HydrophobicContact CG2-CG1 3.95Å; I705-I745 HydrophobicContact CG2-CG2 4.22Å; K709-I745 HydrophobicContact CD-CG2 3.88Å; L728-I745 HydrophobicContact CD1-CD1 3.16Å; L728-I745 HydrophobicContact CD2-CD1 4Å; L728-I745 HydrophobicContact CG-CD1 4.23Å; L743-I745 HydrophobicContact CD2-CD1 4.22Å; L743-I745 HydrophobicContact CD2-CG1 3.96Å; L743-I745 HydrophobicContact CG-CG1 4.45Å; L743-I745 PolarHBondContact O-N 3.01Å; L743-I745 VanDerWaalsContact O-N 3.12Å
746	T	47.9	Very low	73.6	Confident	140 Å²	140	95.1 Å²	95.1	86%	0.859	52%	0.524	S	S	*	.			trans	-69.7	0	163.4	34	0	0	0	0	111.1	R706 K709 K744	R706-T746 PolarHBondContact NH1-O 3.32Å; R706-T746 PolarHBondContact NH1-OG1 2.79Å; K709-T746 PolarHBondContact NZ-OXT 3.14Å; K744-T746 PolarHBondContact O-N 3.29Å

Retrieved 746 of 746 residues in 110.1 ms (Link to these results)

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