A0A3Q0KMA1_SCHMA Loading...

Putative elf1

AlphaFold DB , UniProt , Accession A0A3Q0KMA1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 524 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	32.4	Very low	41.6	Very low	233 Å²	233	120.5 Å²	120.5	100%	1.148	62%	0.621	S	S	*	*				0	5.7	0	-68.2	-51.8	-172	0	0	114.3
2	N	37.2	Very low	41.7	Very low	164 Å²	164	121.5 Å²	121.5	88%	0.877	62%	0.617	S	S	*	*			trans	-118	35.7	-157.1	-55.7	23.6	0	0	0	114.2
3	N	37.7	Very low	41.9	Very low	82 Å²	82	124.8 Å²	124.8	44%	0.439	62%	0.619	S	S	.	*			trans	-134.8	116.2	179.4	-168.4	-16.7	0	0	0	111.3	R5 N6	N3-R5 PolarHBondContact O-N 3.36Å; N3-R5 WeakPolarHBondContact OD1-CB 3.4Å; N3-R5 PolarHBondContact OD1-N 3.4Å; N3-R5 VanDerWaalsContact OD1-N 3.11Å; N3-N6 WeakPolarHBondContact O-CB 3.15Å; N3-N6 PolarHBondContact O-N 3.08Å
4	P	40	Very low	42.8	Very low	109 Å²	109	124.6 Å²	124.6	71%	0.708	61%	0.613	S	S	*	*	H	α-helix	trans	-65.2	-21.7	-179.4	25.9	-34	0	0	0	113.5	N6 L7 L8	P4-N6 VanDerWaalsContact C-N 3.28Å; P4-N6 PolarHBondContact O-N 3.2Å; P4-L7 PolarHBondContact O-N 3.1Å; P4-L8 PolarHBondContact O-N 3.48Å
5	R	40.5	Very low	42.6	Very low	199 Å²	199	120.1 Å²	120.1	75%	0.751	59%	0.59	S	S	*	*	H	α-helix	trans	-59	-39.9	169.8	-75.2	-172.8	174.7	176.7	-0.6	111.7	N3 L7 L8 C9	N3-R5 PolarHBondContact O-N 3.36Å; N3-R5 WeakPolarHBondContact OD1-CB 3.4Å; N3-R5 PolarHBondContact OD1-N 3.4Å; N3-R5 VanDerWaalsContact OD1-N 3.11Å; R5-L7 PolarHBondContact O-N 3.32Å; R5-L8 PolarHBondContact O-N 3.22Å; R5-C9 PolarHBondContact O-N 3.15Å; R5-C9 VanDerWaalsContact O-N 3.08Å; R5-C9 PolarHBondContact O-SG 2.69Å; R5-C9 VanDerWaalsContact O-SG 3.37Å
6	N	46	Very low	42.4	Very low	106 Å²	106	120.6 Å²	120.6	57%	0.567	60%	0.595	S	S	*	*	H	α-helix	trans	-68.5	-35	-178.3	-69.2	36.4	0	0	0	112	N3 P4 L8 C9 E10	N3-N6 WeakPolarHBondContact O-CB 3.15Å; N3-N6 PolarHBondContact O-N 3.08Å; P4-N6 VanDerWaalsContact C-N 3.28Å; P4-N6 PolarHBondContact O-N 3.2Å; N6-L8 VanDerWaalsContact C-N 3.34Å; N6-C9 PolarHBondContact O-N 3.35Å; N6-E10 PolarHBondContact O-N 3.34Å
7	L	46.6	Very low	42.6	Very low	98 Å²	98	121.1 Å²	121.1	51%	0.513	60%	0.6	S	S	.	*	H	α-helix	trans	-63.8	-42.3	175.6	-167.7	76.8	0	0	0	110.9	P4 R5 C9 E10 L11	P4-L7 PolarHBondContact O-N 3.1Å; R5-L7 PolarHBondContact O-N 3.32Å; L7-C9 VanDerWaalsContact C-N 3.35Å; L7-C9 PolarHBondContact O-N 3.04Å; L7-E10 PolarHBondContact O-N 3.07Å; L7-L11 HydrophobicContact CG-CD1 4.17Å; L7-L11 WeakPolarHBondContact O-CB 3.44Å; L7-L11 VanDerWaalsContact O-CG 3.3Å; L7-L11 WeakPolarHBondContact O-CG 3.44Å; L7-L11 PolarHBondContact O-N 3.03Å
8	L	40.5	Very low	42.6	Very low	87 Å²	87	118.3 Å²	118.3	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-60.5	-45.1	175.5	-159.6	80.9	0	0	0	111.1	P4 R5 N6 L11 F12	P4-L8 PolarHBondContact O-N 3.48Å; R5-L8 PolarHBondContact O-N 3.22Å; N6-L8 VanDerWaalsContact C-N 3.34Å; L8-L11 PolarHBondContact O-N 3.15Å; L8-F12 WeakPolarHBondContact O-CB 3.37Å; L8-F12 PolarHBondContact O-N 3.06Å
9	C	41.8	Very low	42.6	Very low	88 Å²	88	117.5 Å²	117.5	60%	0.595	60%	0.595	S	S	*	*	H	α-helix	trans	-63.9	-41.6	176.1	-65	0	0	0	0	112.9	R5 N6 L7 F12 Y13	R5-C9 PolarHBondContact O-N 3.15Å; R5-C9 VanDerWaalsContact O-N 3.08Å; R5-C9 PolarHBondContact O-SG 2.69Å; R5-C9 VanDerWaalsContact O-SG 3.37Å; N6-C9 PolarHBondContact O-N 3.35Å; L7-C9 VanDerWaalsContact C-N 3.35Å; L7-C9 PolarHBondContact O-N 3.04Å; C9-F12 PolarHBondContact O-N 3.46Å; C9-Y13 WeakPolarHBondContact O-CB 3.3Å; C9-Y13 PolarHBondContact O-N 2.87Å
10	E	49.7	Very low	42.8	Very low	104 Å²	104	117.6 Å²	117.6	49%	0.486	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-42.1	177	-122.1	-150.3	110.8	0	0	112	N6 L7 Y13 K14	N6-E10 PolarHBondContact O-N 3.34Å; L7-E10 PolarHBondContact O-N 3.07Å; E10-Y13 PolarHBondContact O-N 3.48Å; E10-K14 WeakPolarHBondContact O-CB 3.48Å; E10-K14 PolarHBondContact O-N 2.86Å; E10-K14 IonicContact OE1-NZ 3.94Å; E10-K14 PolarHBondContact OE1-NZ 2.97Å
11	L	45.4	Very low	42.7	Very low	55 Å²	55	119.3 Å²	119.3	29%	0.288	60%	0.6	S	S	.	*	H	α-helix	trans	-66.3	-39.1	176.3	-70.5	169.9	0	0	0	111.3	L7 L8 K14 H15 L28	L7-L11 HydrophobicContact CG-CD1 4.17Å; L7-L11 WeakPolarHBondContact O-CB 3.44Å; L7-L11 VanDerWaalsContact O-CG 3.3Å; L7-L11 WeakPolarHBondContact O-CG 3.44Å; L7-L11 PolarHBondContact O-N 3.03Å; L8-L11 PolarHBondContact O-N 3.15Å; L11-K14 PolarHBondContact O-N 3.4Å; L11-H15 WeakPolarHBondContact O-CB 3.34Å; L11-H15 PolarHBondContact O-N 3.33Å; L11-L28 HydrophobicContact CB-CD2 4.46Å
12	F	42.8	Very low	43.1	Very low	133 Å²	133	115.8 Å²	115.8	58%	0.583	58%	0.581	S	S	*	*	H	α-helix	trans	-64	-40.8	173.6	-140.5	-90.5	0	0	0	112	L8 C9 H15 L16	L8-F12 WeakPolarHBondContact O-CB 3.37Å; L8-F12 PolarHBondContact O-N 3.06Å; C9-F12 PolarHBondContact O-N 3.46Å; F12-H15 WeakPolarHBondContact O-CB 3.11Å; F12-H15 PolarHBondContact O-N 2.89Å; F12-L16 HydrophobicContact CD1-CD1 4.2Å; F12-L16 WeakPolarHBondContact O-CG 3.39Å; F12-L16 PolarHBondContact O-N 3.12Å; F12-L16 VanDerWaalsContact O-N 3.09Å
13	Y	44.8	Very low	43.3	Very low	164 Å²	164	112.3 Å²	112.3	64%	0.643	57%	0.569	S	S	*	*	H	α-helix	trans	-67.5	-40.7	177.4	-151.8	-91.1	0	0	0	111.9	C9 E10 H15 L16 N17	C9-Y13 WeakPolarHBondContact O-CB 3.3Å; C9-Y13 PolarHBondContact O-N 2.87Å; E10-Y13 PolarHBondContact O-N 3.48Å; Y13-H15 VanDerWaalsContact C-N 3.33Å; Y13-L16 PolarHBondContact O-N 2.82Å; Y13-N17 PolarHBondContact O-N 3.4Å
14	K	53.8	Low	43.3	Very low	122 Å²	122	110.9 Å²	110.9	53%	0.53	56%	0.562	S	S	.	*	H	α-helix	trans	-65.5	-32.5	171	-81.6	167.8	171.9	150.2	0	112.8	E10 L11	E10-K14 WeakPolarHBondContact O-CB 3.48Å; E10-K14 PolarHBondContact O-N 2.86Å; E10-K14 IonicContact OE1-NZ 3.94Å; E10-K14 PolarHBondContact OE1-NZ 2.97Å; L11-K14 PolarHBondContact O-N 3.4Å
15	H	40.8	Very low	43.1	Very low	58 Å²	58	110.1 Å²	110.1	27%	0.269	55%	0.551	S	S	.	*	H	α-helix	trans	-68	-40.2	176.7	-174.8	16	0	0	0	112.2	L11 F12 Y13 L28	L11-H15 WeakPolarHBondContact O-CB 3.34Å; L11-H15 PolarHBondContact O-N 3.33Å; F12-H15 WeakPolarHBondContact O-CB 3.11Å; F12-H15 PolarHBondContact O-N 2.89Å; Y13-H15 VanDerWaalsContact C-N 3.33Å; H15-L28 HydrophobicContact CB-CD1 3.83Å; H15-L28 VanDerWaalsContact CG-CD1 3.48Å
16	L	38.8	Very low	43.3	Very low	128 Å²	128	104.8 Å²	104.8	67%	0.67	54%	0.54	S	S	*	.	H	α-helix	trans	-68.5	-35.3	178.4	-70.9	168.1	0	0	0	113.1	F12 Y13	F12-L16 HydrophobicContact CD1-CD1 4.2Å; F12-L16 WeakPolarHBondContact O-CG 3.39Å; F12-L16 PolarHBondContact O-N 3.12Å; F12-L16 VanDerWaalsContact O-N 3.09Å; Y13-L16 PolarHBondContact O-N 2.82Å
17	N	45.4	Very low	43.2	Very low	128 Å²	128	104.6 Å²	104.6	68%	0.684	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	3.4	-173	-90.6	-4.3	0	0	0	116	Y13	Y13-N17 PolarHBondContact O-N 3.4Å
18	N	42.6	Very low	42.8	Very low	72 Å²	72	101.8 Å²	101.8	39%	0.385	52%	0.522	S	S	.	.			trans	-119.6	127.7	-173.1	-156.8	-27.2	0	0	0	113.1	N20 L24	N18-N20 PolarHBondContact O-N 3.44Å; N18-L24 HydrophobicContact CB-CD1 3.94Å
19	S	43.8	Very low	42.8	Very low	102 Å²	102	102.3 Å²	102.3	71%	0.713	53%	0.525	S	S	*	.	S	Bend	trans	-75.3	-21.7	-173.1	54.1	0	0	0	0	114.3	K21	S19-K21 PolarHBondContact O-N 3.17Å
20	N	45.3	Very low	43.2	Very low	119 Å²	119	101.5 Å²	101.5	64%	0.636	52%	0.517	S	S	*	.			trans	-78	58.2	179.1	-82.3	-25.7	0	0	0	112.7	N18 H22	N18-N20 PolarHBondContact O-N 3.44Å; N20-H22 VanDerWaalsContact C-N 3.28Å; N20-H22 PolarHBondContact O-N 3.14Å; N20-H22 VanDerWaalsContact O-N 3.14Å
21	K	41.2	Very low	43.1	Very low	154 Å²	154	100.5 Å²	100.5	67%	0.67	51%	0.512	S	S	*	.	H	α-helix	trans	-55.5	-35.1	-169.3	-69	-179	178.6	-178.6	0	114.2	S19 L25	S19-K21 PolarHBondContact O-N 3.17Å; K21-L25 WeakPolarHBondContact O-CB 3.29Å; K21-L25 PolarHBondContact O-N 3.39Å
22	H	40.2	Very low	42.8	Very low	160 Å²	160	103.3 Å²	103.3	74%	0.741	52%	0.52	S	S	*	.	H	α-helix	trans	-83.9	-35.2	-166.8	-146.6	-46.8	0	0	0	115.3	N20 T26	N20-H22 VanDerWaalsContact C-N 3.28Å; N20-H22 PolarHBondContact O-N 3.14Å; N20-H22 VanDerWaalsContact O-N 3.14Å; H22-T26 PolarHBondContact O-OG1 3.18Å
23	S	41.8	Very low	42.9	Very low	90 Å²	90	100.1 Å²	100.1	63%	0.629	51%	0.509	S	S	*	.	H	α-helix	trans	-74.7	-42.6	175.1	166.7	0	0	0	0	110.8	L25 T26 Q27	S23-L25 VanDerWaalsContact C-N 3.32Å; S23-L25 PolarHBondContact O-N 3.47Å; S23-T26 PolarHBondContact O-N 3.13Å; S23-Q27 PolarHBondContact O-N 3.07Å; S23-Q27 VanDerWaalsContact O-N 3.14Å
24	L	37.4	Very low	43.1	Very low	53 Å²	53	97.8 Å²	97.8	28%	0.277	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-33.2	174.3	-93.1	162.6	0	0	0	112.5	N18 Q27 L28	N18-L24 HydrophobicContact CB-CD1 3.94Å; L24-Q27 PolarHBondContact O-N 3.14Å; L24-L28 WeakPolarHBondContact O-CB 3.44Å; L24-L28 WeakPolarHBondContact O-CD1 3.46Å; L24-L28 VanDerWaalsContact O-CG 3.24Å; L24-L28 WeakPolarHBondContact O-CG 3.33Å; L24-L28 PolarHBondContact O-N 3.28Å
25	L	35.4	Very low	42.7	Very low	93 Å²	93	94.8 Å²	94.8	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-44.5	175.4	-140.9	76.8	0	0	0	112	K21 S23 N29	K21-L25 WeakPolarHBondContact O-CB 3.29Å; K21-L25 PolarHBondContact O-N 3.39Å; S23-L25 VanDerWaalsContact C-N 3.32Å; S23-L25 PolarHBondContact O-N 3.47Å; L25-N29 WeakPolarHBondContact O-CB 3.4Å; L25-N29 PolarHBondContact O-N 3.38Å
26	T	44.4	Very low	43.2	Very low	86 Å²	86	96.1 Å²	96.1	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-45.1	178.9	-50.8	0	0	0	0	110.9	H22 S23 N29 T30	H22-T26 PolarHBondContact O-OG1 3.18Å; S23-T26 PolarHBondContact O-N 3.13Å; T26-N29 PolarHBondContact O-N 2.99Å; T26-T30 PolarHBondContact O-N 3.08Å; T26-T30 PolarHBondContact O-OG1 3Å
27	Q	45.6	Very low	43.6	Very low	103 Å²	103	93.6 Å²	93.6	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-69.1	-41.4	179.9	-171.4	167.4	-11	0	0	112.5	S23 L24 N29 T30 E31	S23-Q27 PolarHBondContact O-N 3.07Å; S23-Q27 VanDerWaalsContact O-N 3.14Å; L24-Q27 PolarHBondContact O-N 3.14Å; Q27-N29 VanDerWaalsContact C-N 3.3Å; Q27-N29 PolarHBondContact O-N 3.34Å; Q27-T30 WeakPolarHBondContact CA-OG1 3.44Å; Q27-T30 PolarHBondContact O-N 3.26Å; Q27-T30 PolarHBondContact O-OG1 3.41Å; Q27-E31 PolarHBondContact NE2-OE1 3.23Å; Q27-E31 WeakPolarHBondContact O-CB 3.39Å; Q27-E31 PolarHBondContact O-N 3.08Å
28	L	36.8	Very low	43.8	Very low	39 Å²	39	90.9 Å²	90.9	20%	0.204	47%	0.472	C	S	.	.	H	α-helix	trans	-61.3	-38.3	170.6	-77.7	165.5	0	0	0	111.2	L11 H15 L24 Y32	L11-L28 HydrophobicContact CB-CD2 4.46Å; H15-L28 HydrophobicContact CB-CD1 3.83Å; H15-L28 VanDerWaalsContact CG-CD1 3.48Å; L24-L28 WeakPolarHBondContact O-CB 3.44Å; L24-L28 WeakPolarHBondContact O-CD1 3.46Å; L24-L28 VanDerWaalsContact O-CG 3.24Å; L24-L28 WeakPolarHBondContact O-CG 3.33Å; L24-L28 PolarHBondContact O-N 3.28Å; L28-Y32 WeakPolarHBondContact O-CA 3.47Å; L28-Y32 WeakPolarHBondContact O-CB 3.42Å; L28-Y32 PolarHBondContact O-N 2.95Å
29	N	41.4	Very low	44.2	Very low	97 Å²	97	90.4 Å²	90.4	52%	0.519	47%	0.472	S	S	.	.	H	α-helix	trans	-70.8	-39	178.3	-162.9	18.5	0	0	0	111.5	L25 T26 Q27 N33	L25-N29 WeakPolarHBondContact O-CB 3.4Å; L25-N29 PolarHBondContact O-N 3.38Å; T26-N29 PolarHBondContact O-N 2.99Å; Q27-N29 VanDerWaalsContact C-N 3.3Å; Q27-N29 PolarHBondContact O-N 3.34Å; N29-N33 WeakPolarHBondContact O-CB 3.49Å; N29-N33 PolarHBondContact O-N 3.1Å; N29-N33 PolarHBondContact O-ND2 3.33Å; N29-N33 PolarHBondContact OD1-ND2 3.37Å
30	T	50.5	Low	44.2	Very low	71 Å²	71	91.2 Å²	91.2	44%	0.436	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-45	173.7	48.4	0	0	0	0	112.3	T26 Q27 Q34	T26-T30 PolarHBondContact O-N 3.08Å; T26-T30 PolarHBondContact O-OG1 3Å; Q27-T30 WeakPolarHBondContact CA-OG1 3.44Å; Q27-T30 PolarHBondContact O-N 3.26Å; Q27-T30 PolarHBondContact O-OG1 3.41Å; T30-Q34 WeakPolarHBondContact O-CB 3.34Å; T30-Q34 WeakPolarHBondContact O-CG 3.43Å; T30-Q34 PolarHBondContact O-N 3.3Å
31	E	47.4	Very low	44.2	Very low	83 Å²	83	87.4 Å²	87.4	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-72.9	-35.7	178.8	-71.4	-172.6	-140.6	0	0	111.6	Q27 Q34 I35	Q27-E31 PolarHBondContact NE2-OE1 3.23Å; Q27-E31 WeakPolarHBondContact O-CB 3.39Å; Q27-E31 PolarHBondContact O-N 3.08Å; E31-Q34 PolarHBondContact O-N 3.21Å; E31-I35 WeakPolarHBondContact O-CB 3.41Å; E31-I35 WeakPolarHBondContact O-CD1 3.38Å; E31-I35 WeakPolarHBondContact O-CG1 3.33Å; E31-I35 PolarHBondContact O-N 2.65Å
32	Y	39.5	Very low	44.6	Very low	115 Å²	115	83.9 Å²	83.9	45%	0.451	43%	0.432	S	S	.	.	H	α-helix	trans	-65.9	-40.1	173.6	-175.8	-94.5	0	0	0	111.9	L28 Q36	L28-Y32 WeakPolarHBondContact O-CA 3.47Å; L28-Y32 WeakPolarHBondContact O-CB 3.42Å; L28-Y32 PolarHBondContact O-N 2.95Å; Y32-Q36 HydrophobicContact CD1-CG 4.13Å; Y32-Q36 VanDerWaalsContact CE1-CD 3.44Å; Y32-Q36 HydrophobicContact CE1-CG 3.78Å; Y32-Q36 VanDerWaalsContact O-CB 3.28Å; Y32-Q36 WeakPolarHBondContact O-CB 3.42Å; Y32-Q36 WeakPolarHBondContact O-CG 3.46Å; Y32-Q36 PolarHBondContact O-N 2.91Å; Y32-Q36 PolarHBondContact OH-NE2 2.84Å
33	N	44.1	Very low	44.8	Very low	65 Å²	65	83.8 Å²	83.8	35%	0.348	43%	0.427	S	S	.	.	H	α-helix	trans	-68.2	-41.8	172.9	-81	-72.2	0	0	0	111.9	N29 Q36 Q37	N29-N33 WeakPolarHBondContact O-CB 3.49Å; N29-N33 PolarHBondContact O-N 3.1Å; N29-N33 PolarHBondContact O-ND2 3.33Å; N29-N33 PolarHBondContact OD1-ND2 3.37Å; N33-Q36 PolarHBondContact O-N 3.31Å; N33-Q37 VanDerWaalsContact O-CB 3.31Å; N33-Q37 WeakPolarHBondContact O-CB 3.21Å; N33-Q37 VanDerWaalsContact O-CG 3.23Å; N33-Q37 WeakPolarHBondContact O-CG 3.4Å; N33-Q37 PolarHBondContact O-N 3.12Å
34	Q	49.3	Very low	45	Very low	115 Å²	115	82.1 Å²	82.1	54%	0.537	41%	0.411	S	S	.	.	H	α-helix	trans	-66.2	-37.4	175.4	-75.5	-177.7	-0.5	0	0	112.4	T30 E31 T38	T30-Q34 WeakPolarHBondContact O-CB 3.34Å; T30-Q34 WeakPolarHBondContact O-CG 3.43Å; T30-Q34 PolarHBondContact O-N 3.3Å; E31-Q34 PolarHBondContact O-N 3.21Å; Q34-T38 WeakPolarHBondContact O-CB 3.35Å; Q34-T38 PolarHBondContact O-N 3.33Å; Q34-T38 PolarHBondContact O-OG1 2.82Å
35	I	44.7	Very low	45.4	Very low	60 Å²	60	80.6 Å²	80.6	31%	0.308	40%	0.404	S	S	.	.	H	α-helix	trans	-67.2	-47.5	172.8	-71.2	164.4	0	0	0	109.6	E31 T38 T39	E31-I35 WeakPolarHBondContact O-CB 3.41Å; E31-I35 WeakPolarHBondContact O-CD1 3.38Å; E31-I35 WeakPolarHBondContact O-CG1 3.33Å; E31-I35 PolarHBondContact O-N 2.65Å; I35-T38 PolarHBondContact O-N 2.9Å; I35-T39 HydrophobicContact CG2-CG2 4.13Å; I35-T39 WeakPolarHBondContact O-CB 3.47Å; I35-T39 VanDerWaalsContact O-CG2 3.26Å; I35-T39 WeakPolarHBondContact O-CG2 3.42Å; I35-T39 PolarHBondContact O-N 3.26Å; I35-T39 PolarHBondContact O-OG1 2.92Å
36	Q	51.6	Low	46	Very low	85 Å²	85	82.2 Å²	82.2	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-57.9	-51.4	175	-85.9	-157.2	-13.1	0	0	111.2	Y32 N33 T38 T39 M40	Y32-Q36 HydrophobicContact CD1-CG 4.13Å; Y32-Q36 VanDerWaalsContact CE1-CD 3.44Å; Y32-Q36 HydrophobicContact CE1-CG 3.78Å; Y32-Q36 VanDerWaalsContact O-CB 3.28Å; Y32-Q36 WeakPolarHBondContact O-CB 3.42Å; Y32-Q36 WeakPolarHBondContact O-CG 3.46Å; Y32-Q36 PolarHBondContact O-N 2.91Å; Y32-Q36 PolarHBondContact OH-NE2 2.84Å; N33-Q36 PolarHBondContact O-N 3.31Å; Q36-T38 PolarHBondContact O-N 2.99Å; Q36-T39 WeakPolarHBondContact CA-OG1 3.34Å; Q36-T39 PolarHBondContact O-N 3.16Å; Q36-T39 PolarHBondContact O-OG1 2.94Å; Q36-M40 VanDerWaalsContact O-CB 3.23Å; Q36-M40 WeakPolarHBondContact O-CB 3.34Å; Q36-M40 WeakPolarHBondContact O-CG 3.45Å; Q36-M40 PolarHBondContact O-N 2.74Å
37	Q	48.4	Very low	45.9	Very low	76 Å²	76	81.1 Å²	81.1	36%	0.355	41%	0.405	S	S	.	.	H	α-helix	trans	-59.9	-43.4	177.1	-72	173.3	0.4	0	0	112.1	N33 F41 L83	N33-Q37 VanDerWaalsContact O-CB 3.31Å; N33-Q37 WeakPolarHBondContact O-CB 3.21Å; N33-Q37 VanDerWaalsContact O-CG 3.23Å; N33-Q37 WeakPolarHBondContact O-CG 3.4Å; N33-Q37 PolarHBondContact O-N 3.12Å; Q37-F41 WeakPolarHBondContact O-CB 3.19Å; Q37-F41 PolarHBondContact O-N 2.86Å; Q37-L83 HydrophobicContact CB-CD2 4.39Å
38	T	48.4	Very low	45.8	Very low	70 Å²	70	78 Å²	78	43%	0.429	39%	0.391	S	S	.	.	H	α-helix	trans	-69.1	-36.6	178.5	-59.7	0	0	0	0	111.9	Q34 I35 Q36 N42	Q34-T38 WeakPolarHBondContact O-CB 3.35Å; Q34-T38 PolarHBondContact O-N 3.33Å; Q34-T38 PolarHBondContact O-OG1 2.82Å; I35-T38 PolarHBondContact O-N 2.9Å; Q36-T38 PolarHBondContact O-N 2.99Å; T38-N42 VanDerWaalsContact O-CB 3.22Å; T38-N42 WeakPolarHBondContact O-CB 3.36Å; T38-N42 PolarHBondContact O-N 3.35Å; T38-N42 PolarHBondContact O-ND2 3.2Å
39	T	50.7	Low	46.2	Very low	63 Å²	63	83.3 Å²	83.3	39%	0.387	42%	0.419	S	S	.	.	H	α-helix	trans	-73	-41.9	174.4	57.8	0	0	0	0	111.7	I35 Q36 N42 Y43	I35-T39 HydrophobicContact CG2-CG2 4.13Å; I35-T39 WeakPolarHBondContact O-CB 3.47Å; I35-T39 VanDerWaalsContact O-CG2 3.26Å; I35-T39 WeakPolarHBondContact O-CG2 3.42Å; I35-T39 PolarHBondContact O-N 3.26Å; I35-T39 PolarHBondContact O-OG1 2.92Å; Q36-T39 WeakPolarHBondContact CA-OG1 3.34Å; Q36-T39 PolarHBondContact O-N 3.16Å; Q36-T39 PolarHBondContact O-OG1 2.94Å; T39-N42 CarbonylContact O-C 3.51Å; T39-N42 PolarHBondContact O-N 3.19Å; T39-Y43 VanDerWaalsContact O-CB 3.29Å; T39-Y43 WeakPolarHBondContact O-CB 3.43Å; T39-Y43 VanDerWaalsContact O-CD2 3.31Å; T39-Y43 WeakPolarHBondContact O-CD2 3.49Å; T39-Y43 PolarHBondContact O-N 2.99Å
40	M	44.7	Very low	46.2	Very low	119 Å²	119	82.8 Å²	82.8	59%	0.586	42%	0.423	S	S	*	.	H	α-helix	trans	-59.9	-44.9	172.6	-81.2	-74.3	-78.5	0	0	111	Q36 Y43 L44	Q36-M40 VanDerWaalsContact O-CB 3.23Å; Q36-M40 WeakPolarHBondContact O-CB 3.34Å; Q36-M40 WeakPolarHBondContact O-CG 3.45Å; Q36-M40 PolarHBondContact O-N 2.74Å; M40-Y43 PolarHBondContact O-N 3.02Å; M40-L44 WeakPolarHBondContact O-CB 3.28Å; M40-L44 PolarHBondContact O-N 3.15Å
41	F	45.6	Very low	45.7	Very low	38 Å²	38	82.6 Å²	82.6	17%	0.167	42%	0.419	C	S	.	.	H	α-helix	trans	-63.8	-46.2	175	-173.2	-92.6	0	0	0	111.7	Q37 Y43 L44 C45 S87 F91	Q37-F41 WeakPolarHBondContact O-CB 3.19Å; Q37-F41 PolarHBondContact O-N 2.86Å; F41-Y43 VanDerWaalsContact C-N 3.34Å; F41-Y43 PolarHBondContact O-N 2.95Å; F41-L44 PolarHBondContact O-N 3.48Å; F41-C45 WeakPolarHBondContact O-CB 3.46Å; F41-C45 PolarHBondContact O-N 3.16Å; F41-C45 PolarHBondContact O-SG 2.87Å; F41-S87 WeakPolarHBondContact CZ-O 3.43Å; F41-F91 HydrophobicContact CE2-CB 3.95Å; F41-F91 AromaticContact CE2-CD2 3.85Å; F41-F91 HydrophobicContact CE2-CD2 3.85Å; F41-F91 HydrophobicContact CE2-CG 4.29Å; F41-F91 HydrophobicContact CZ-CB 4.19Å
42	N	48.1	Very low	45.3	Very low	80 Å²	80	84.3 Å²	84.3	43%	0.428	43%	0.431	S	S	.	.	H	α-helix	trans	-66.5	-34	176.1	-77.3	-41.3	0	0	0	112.5	T38 T39 Q46	T38-N42 VanDerWaalsContact O-CB 3.22Å; T38-N42 WeakPolarHBondContact O-CB 3.36Å; T38-N42 PolarHBondContact O-N 3.35Å; T38-N42 PolarHBondContact O-ND2 3.2Å; T39-N42 CarbonylContact O-C 3.51Å; T39-N42 PolarHBondContact O-N 3.19Å; N42-Q46 VanDerWaalsContact O-CB 3.27Å; N42-Q46 WeakPolarHBondContact O-CB 3.35Å; N42-Q46 VanDerWaalsContact O-CG 3.27Å; N42-Q46 WeakPolarHBondContact O-CG 3.22Å; N42-Q46 PolarHBondContact O-N 3.03Å
43	Y	46.1	Very low	45.3	Very low	159 Å²	159	83.4 Å²	83.4	62%	0.624	43%	0.429	S	S	*	.	H	α-helix	trans	-67.8	-44.3	171.5	-95.6	-71.2	0	0	0	110.7	T39 M40 F41 C45 Q46 S47	T39-Y43 VanDerWaalsContact O-CB 3.29Å; T39-Y43 WeakPolarHBondContact O-CB 3.43Å; T39-Y43 VanDerWaalsContact O-CD2 3.31Å; T39-Y43 WeakPolarHBondContact O-CD2 3.49Å; T39-Y43 PolarHBondContact O-N 2.99Å; M40-Y43 PolarHBondContact O-N 3.02Å; F41-Y43 VanDerWaalsContact C-N 3.34Å; F41-Y43 PolarHBondContact O-N 2.95Å; Y43-C45 PolarHBondContact O-N 3.19Å; Y43-Q46 PolarHBondContact O-N 3.17Å; Y43-S47 VanDerWaalsContact O-CB 3.3Å; Y43-S47 WeakPolarHBondContact O-CB 3.43Å; Y43-S47 PolarHBondContact O-N 2.98Å; Y43-S47 PolarHBondContact O-OG 3.44Å
44	L	45.8	Very low	45	Very low	55 Å²	55	88.1 Å²	88.1	29%	0.288	45%	0.451	S	S	.	.	H	α-helix	trans	-59.8	-45.7	173.9	-111.2	162.3	0	0	0	111.4	M40 F41 S47 L48 F67 F70	M40-L44 WeakPolarHBondContact O-CB 3.28Å; M40-L44 PolarHBondContact O-N 3.15Å; F41-L44 PolarHBondContact O-N 3.48Å; L44-S47 PolarHBondContact O-N 2.99Å; L44-L48 HydrophobicContact CD2-CD1 4.29Å; L44-L48 VanDerWaalsContact O-CB 3.31Å; L44-L48 WeakPolarHBondContact O-CB 3.49Å; L44-L48 WeakPolarHBondContact O-CG 3.19Å; L44-L48 PolarHBondContact O-N 3.35Å; L44-F67 HydrophobicContact CD2-CE2 4.41Å; L44-F70 HydrophobicContact CD1-CE1 4.11Å
45	C	45.5	Very low	44.4	Very low	21 Å²	21	87.8 Å²	87.8	14%	0.142	45%	0.453	C	S	.	.	H	α-helix	trans	-65.2	-39.3	174.6	-72.6	0	0	0	0	112.6	F41 Y43 L49	F41-C45 WeakPolarHBondContact O-CB 3.46Å; F41-C45 PolarHBondContact O-N 3.16Å; F41-C45 PolarHBondContact O-SG 2.87Å; Y43-C45 PolarHBondContact O-N 3.19Å; C45-L49 VanDerWaalsContact O-CB 3.26Å; C45-L49 WeakPolarHBondContact O-CB 3.41Å; C45-L49 WeakPolarHBondContact O-CD1 3.44Å; C45-L49 WeakPolarHBondContact O-CG 3.39Å; C45-L49 PolarHBondContact O-N 3.29Å
46	Q	46.7	Very low	44.1	Very low	126 Å²	126	87.6 Å²	87.6	59%	0.589	45%	0.452	S	S	*	.	H	α-helix	trans	-68.3	-42.6	175.4	-79.6	-176	14.3	0	0	111.8	N42 Y43 L49 S50	N42-Q46 VanDerWaalsContact O-CB 3.27Å; N42-Q46 WeakPolarHBondContact O-CB 3.35Å; N42-Q46 VanDerWaalsContact O-CG 3.27Å; N42-Q46 WeakPolarHBondContact O-CG 3.22Å; N42-Q46 PolarHBondContact O-N 3.03Å; Y43-Q46 PolarHBondContact O-N 3.17Å; Q46-L49 CarbonylContact O-C 3.51Å; Q46-L49 PolarHBondContact O-N 3.29Å; Q46-S50 VanDerWaalsContact O-CB 3.22Å; Q46-S50 WeakPolarHBondContact O-CB 3.46Å; Q46-S50 PolarHBondContact O-N 2.92Å; Q46-S50 PolarHBondContact O-OG 3.31Å
47	S	42.7	Very low	43.4	Very low	63 Å²	63	90.9 Å²	90.9	44%	0.441	47%	0.472	S	S	.	.	H	α-helix	trans	-56	-53.6	172.2	-66.6	0	0	0	0	110.2	Y43 L44 L49 S50 I51	Y43-S47 VanDerWaalsContact O-CB 3.3Å; Y43-S47 WeakPolarHBondContact O-CB 3.43Å; Y43-S47 PolarHBondContact O-N 2.98Å; Y43-S47 PolarHBondContact O-OG 3.44Å; L44-S47 PolarHBondContact O-N 2.99Å; S47-L49 VanDerWaalsContact C-N 3.28Å; S47-L49 PolarHBondContact O-N 3.46Å; S47-S50 WeakPolarHBondContact CA-OG 3.2Å; S47-S50 CarbonylContact O-C 3.58Å; S47-S50 WeakPolarHBondContact O-CA 3.39Å; S47-S50 PolarHBondContact O-N 3.42Å; S47-S50 PolarHBondContact O-OG 2.77Å; S47-I51 PolarHBondContact O-N 3.21Å
48	L	43.6	Very low	43.1	Very low	37 Å²	37	95.5 Å²	95.5	19%	0.194	49%	0.494	C	S	.	.	H	α-helix	trans	-61.3	-31.4	177.3	-72.1	168.7	0	0	0	113.7	L44 I51 F67 I98	L44-L48 HydrophobicContact CD2-CD1 4.29Å; L44-L48 VanDerWaalsContact O-CB 3.31Å; L44-L48 WeakPolarHBondContact O-CB 3.49Å; L44-L48 WeakPolarHBondContact O-CG 3.19Å; L44-L48 PolarHBondContact O-N 3.35Å; L48-I51 HydrophobicContact CD2-CD1 4.23Å; L48-F67 HydrophobicContact CD1-CZ 4.45Å; L48-F67 HydrophobicContact CD2-CE2 3.97Å; L48-F67 HydrophobicContact CD2-CZ 3.96Å; L48-I98 HydrophobicContact CD1-CD1 4.47Å; L48-I98 HydrophobicContact CD2-CD1 4.12Å
49	L	44.8	Very low	42.7	Very low	151 Å²	151	95 Å²	95	79%	0.791	49%	0.488	S	S	*	.	H	α-helix	trans	-80	-20.5	173.2	-73.6	167	0	0	0	113.5	C45 Q46 S47	C45-L49 VanDerWaalsContact O-CB 3.26Å; C45-L49 WeakPolarHBondContact O-CB 3.41Å; C45-L49 WeakPolarHBondContact O-CD1 3.44Å; C45-L49 WeakPolarHBondContact O-CG 3.39Å; C45-L49 PolarHBondContact O-N 3.29Å; Q46-L49 CarbonylContact O-C 3.51Å; Q46-L49 PolarHBondContact O-N 3.29Å; S47-L49 VanDerWaalsContact C-N 3.28Å; S47-L49 PolarHBondContact O-N 3.46Å
50	S	41	Very low	42.4	Very low	86 Å²	86	97 Å²	97	60%	0.601	50%	0.496	S	S	*	.	H	α-helix	trans	-91.2	-14.9	178.4	73.2	0	0	0	0	113.9	Q46 S47 N52	Q46-S50 VanDerWaalsContact O-CB 3.22Å; Q46-S50 WeakPolarHBondContact O-CB 3.46Å; Q46-S50 PolarHBondContact O-N 2.92Å; Q46-S50 PolarHBondContact O-OG 3.31Å; S47-S50 WeakPolarHBondContact CA-OG 3.2Å; S47-S50 CarbonylContact O-C 3.58Å; S47-S50 WeakPolarHBondContact O-CA 3.39Å; S47-S50 PolarHBondContact O-N 3.42Å; S47-S50 PolarHBondContact O-OG 2.77Å; S50-N52 PolarHBondContact O-N 2.96Å
51	I	41.9	Very low	42.4	Very low	67 Å²	67	96.8 Å²	96.8	34%	0.344	50%	0.497	S	S	.	.	S	Bend	trans	-64.4	102.7	168	-61.4	165.1	0	0	0	107	S47 L48 F53 I59	S47-I51 PolarHBondContact O-N 3.21Å; L48-I51 HydrophobicContact CD2-CD1 4.23Å; I51-F53 VanDerWaalsContact C-N 3.28Å; I51-F53 HydrophobicContact CB-CD2 4.01Å; I51-F53 HydrophobicContact CB-CE2 3.6Å; I51-F53 HydrophobicContact CB-CZ 3.88Å; I51-F53 HydrophobicContact CD1-CE2 4.37Å; I51-F53 HydrophobicContact CD1-CZ 4.03Å; I51-F53 HydrophobicContact CG2-CD1 3.77Å; I51-F53 HydrophobicContact CG2-CD2 3.72Å; I51-F53 HydrophobicContact CG2-CE1 3.58Å; I51-F53 HydrophobicContact CG2-CE2 3.51Å; I51-F53 HydrophobicContact CG2-CG 3.85Å; I51-F53 HydrophobicContact CG2-CZ 3.44Å; I51-F53 VanDerWaalsContact CG2-CZ 3.44Å; I51-F53 WeakPolarHBondContact O-CD2 3.16Å; I51-F53 PolarHBondContact O-N 3.35Å; I51-I59 HydrophobicContact CG2-CD1 4.16Å
52	N	38.6	Very low	42.5	Very low	119 Å²	119	99.2 Å²	99.2	64%	0.636	51%	0.509	S	S	*	.			trans	-78.8	81.2	-179.7	-164.9	19.2	0	0	0	108.7	S50 M54	S50-N52 PolarHBondContact O-N 2.96Å; N52-M54 PolarHBondContact O-N 3.1Å
53	F	39.8	Very low	42.4	Very low	97 Å²	97	100.3 Å²	100.3	43%	0.425	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	31.9	-175.6	-71.6	-79.1	0	0	0	115.2	I51 I56 I59	I51-F53 VanDerWaalsContact C-N 3.28Å; I51-F53 HydrophobicContact CB-CD2 4.01Å; I51-F53 HydrophobicContact CB-CE2 3.6Å; I51-F53 HydrophobicContact CB-CZ 3.88Å; I51-F53 HydrophobicContact CD1-CE2 4.37Å; I51-F53 HydrophobicContact CD1-CZ 4.03Å; I51-F53 HydrophobicContact CG2-CD1 3.77Å; I51-F53 HydrophobicContact CG2-CD2 3.72Å; I51-F53 HydrophobicContact CG2-CE1 3.58Å; I51-F53 HydrophobicContact CG2-CE2 3.51Å; I51-F53 HydrophobicContact CG2-CG 3.85Å; I51-F53 HydrophobicContact CG2-CZ 3.44Å; I51-F53 VanDerWaalsContact CG2-CZ 3.44Å; I51-F53 WeakPolarHBondContact O-CD2 3.16Å; I51-F53 PolarHBondContact O-N 3.35Å; F53-I56 HydrophobicContact CB-CD1 4.36Å; F53-I56 HydrophobicContact CB-CG1 4.34Å; F53-I56 HydrophobicContact CD1-CG1 4.35Å; F53-I56 WeakPolarHBondContact O-CD1 3.18Å; F53-I56 WeakPolarHBondContact O-CG1 3.27Å; F53-I59 HydrophobicContact CD1-CD1 3.83Å; F53-I59 HydrophobicContact CE1-CD1 4.18Å
54	M	36.9	Very low	42.4	Very low	163 Å²	163	95.4 Å²	95.4	80%	0.803	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-28.7	166.8	-71.6	-69.6	166.5	0	0	111.9	N52 I56	N52-M54 PolarHBondContact O-N 3.1Å; M54-I56 PolarHBondContact O-N 3.32Å
55	D	36.2	Very low	42.4	Very low	109 Å²	109	97.5 Å²	97.5	58%	0.583	51%	0.505	S	S	*	.			trans	-98.3	39.9	-178.8	-61.4	-55.8	0	0	0	113	N57 Q58	D55-N57 PolarHBondContact O-N 3.41Å; D55-Q58 PolarHBondContact O-N 3Å
56	I	39.7	Very low	42.7	Very low	55 Å²	55	101.6 Å²	101.6	28%	0.282	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-55.8	-26.9	-178.8	-63.3	172.1	0	0	0	112.1	F53 M54 Q58 I59 Y105	F53-I56 HydrophobicContact CB-CD1 4.36Å; F53-I56 HydrophobicContact CB-CG1 4.34Å; F53-I56 HydrophobicContact CD1-CG1 4.35Å; F53-I56 WeakPolarHBondContact O-CD1 3.18Å; F53-I56 WeakPolarHBondContact O-CG1 3.27Å; M54-I56 PolarHBondContact O-N 3.32Å; I56-Q58 PolarHBondContact O-N 2.83Å; I56-I59 HydrophobicContact CG1-CD1 4.28Å; I56-I59 PolarHBondContact O-N 2.79Å; I56-Y105 HydrophobicContact CB-CE2 4.48Å; I56-Y105 HydrophobicContact CG2-CD2 3.79Å; I56-Y105 HydrophobicContact CG2-CE1 4.21Å; I56-Y105 HydrophobicContact CG2-CE2 3.42Å; I56-Y105 VanDerWaalsContact CG2-CE2 3.42Å; I56-Y105 HydrophobicContact CG2-CG 4.33Å
57	N	36.5	Very low	42.7	Very low	154 Å²	154	97.9 Å²	97.9	82%	0.824	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-58.8	-15	175.8	-64.8	-15	0	0	0	114.7	D55	D55-N57 PolarHBondContact O-N 3.41Å
58	Q	41.2	Very low	42.9	Very low	173 Å²	173	99 Å²	99	81%	0.808	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-124.9	4.2	177	-73.9	-175.2	-26.7	0	0	114.1	D55 I56 N60	D55-Q58 PolarHBondContact O-N 3Å; I56-Q58 PolarHBondContact O-N 2.83Å; Q58-N60 PolarHBondContact O-N 2.73Å
59	I	40.6	Very low	43.3	Very low	59 Å²	59	101.7 Å²	101.7	30%	0.303	52%	0.516	S	S	.	.			trans	-72.1	102.8	176.7	-62.7	179.8	0	0	0	108.7	I51 F53 I56 L61	I51-I59 HydrophobicContact CG2-CD1 4.16Å; F53-I59 HydrophobicContact CD1-CD1 3.83Å; F53-I59 HydrophobicContact CE1-CD1 4.18Å; I56-I59 HydrophobicContact CG1-CD1 4.28Å; I56-I59 PolarHBondContact O-N 2.79Å; I59-L61 PolarHBondContact O-N 3.13Å
60	N	43.8	Very low	43.5	Very low	105 Å²	105	99.7 Å²	99.7	56%	0.561	50%	0.501	S	S	*	.			trans	-56.8	129.7	-173.7	-154.9	-12.3	0	0	0	110.9	Q58 E62 I63	Q58-N60 PolarHBondContact O-N 2.73Å; N60-E62 PolarHBondContact O-N 3.32Å; N60-I63 HydrophobicContact CB-CD1 4.09Å; N60-I63 HydrophobicContact CB-CG1 4.24Å; N60-I63 WeakPolarHBondContact O-CB 3.46Å; N60-I63 PolarHBondContact O-N 3.08Å
61	L	45.9	Very low	43.8	Very low	115 Å²	115	96.9 Å²	96.9	60%	0.602	48%	0.479	S	S	*	.	H	α-helix	trans	-56.2	-29.4	-175.5	-159.9	75.6	0	0	0	111.6	I59 I63 L64 K65	I59-L61 PolarHBondContact O-N 3.13Å; L61-I63 PolarHBondContact O-N 3.3Å; L61-L64 WeakPolarHBondContact O-CB 3.48Å; L61-L64 PolarHBondContact O-N 3.47Å; L61-K65 WeakPolarHBondContact O-CG 3.29Å; L61-K65 PolarHBondContact O-N 2.88Å
62	E	46.3	Very low	44	Very low	89 Å²	89	99 Å²	99	42%	0.416	49%	0.486	S	S	.	.	H	α-helix	trans	-62	-34.4	175.3	-130.1	58.7	-161.7	0	0	114	N60 L64 K65 N66	N60-E62 PolarHBondContact O-N 3.32Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-K65 PolarHBondContact O-N 3.33Å; E62-K65 IonicContact OE1-NZ 2.73Å; E62-K65 PolarHBondContact OE1-NZ 3.37Å; E62-K65 WeakPolarHBondContact OE2-CE 3.44Å; E62-K65 IonicContact OE2-NZ 2.73Å; E62-K65 PolarHBondContact OE2-NZ 3.35Å; E62-N66 VanDerWaalsContact O-CB 3.29Å; E62-N66 WeakPolarHBondContact O-CB 3.4Å; E62-N66 PolarHBondContact O-N 3.05Å; E62-N66 PolarHBondContact O-ND2 3.41Å
63	I	46.5	Very low	44.2	Very low	104 Å²	104	99.2 Å²	99.2	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-67.1	-40	175.5	-60.8	170	0	0	0	109.5	N60 L61 F67	N60-I63 HydrophobicContact CB-CD1 4.09Å; N60-I63 HydrophobicContact CB-CG1 4.24Å; N60-I63 WeakPolarHBondContact O-CB 3.46Å; N60-I63 PolarHBondContact O-N 3.08Å; L61-I63 PolarHBondContact O-N 3.3Å; I63-F67 WeakPolarHBondContact O-CB 3.22Å; I63-F67 PolarHBondContact O-N 3.11Å
64	L	46	Very low	44.2	Very low	56 Å²	56	95.9 Å²	95.9	29%	0.293	48%	0.475	S	S	.	.	H	α-helix	trans	-66	-46	176.6	-151.2	87.4	0	0	0	111.1	L61 E62 F67 F68 Y102	L61-L64 WeakPolarHBondContact O-CB 3.48Å; L61-L64 PolarHBondContact O-N 3.47Å; E62-L64 VanDerWaalsContact C-N 3.32Å; L64-F67 PolarHBondContact O-N 3.25Å; L64-F68 HydrophobicContact CD2-CD2 4.48Å; L64-F68 HydrophobicContact CD2-CE2 4.03Å; L64-F68 HydrophobicContact CG-CD2 4.23Å; L64-F68 HydrophobicContact CG-CE2 4.04Å; L64-F68 VanDerWaalsContact O-CD2 3.27Å; L64-F68 WeakPolarHBondContact O-CD2 3.45Å; L64-F68 PolarHBondContact O-N 2.83Å; L64-Y102 HydrophobicContact CD2-CD2 4.23Å; L64-Y102 HydrophobicContact CD2-CE2 4.01Å
65	K	47.1	Very low	44.3	Very low	99 Å²	99	95.6 Å²	95.6	43%	0.43	47%	0.472	S	S	.	.	H	α-helix	trans	-58.9	-49.6	175	-70.5	177	-171.6	162.4	0	112.2	L61 E62 F67 F68 E69	L61-K65 WeakPolarHBondContact O-CG 3.29Å; L61-K65 PolarHBondContact O-N 2.88Å; E62-K65 PolarHBondContact O-N 3.33Å; E62-K65 IonicContact OE1-NZ 2.73Å; E62-K65 PolarHBondContact OE1-NZ 3.37Å; E62-K65 WeakPolarHBondContact OE2-CE 3.44Å; E62-K65 IonicContact OE2-NZ 2.73Å; E62-K65 PolarHBondContact OE2-NZ 3.35Å; K65-F67 PolarHBondContact O-N 2.8Å; K65-F68 PolarHBondContact O-N 2.79Å; K65-E69 PolarHBondContact O-N 3.31Å
66	N	50.7	Low	44.4	Very low	106 Å²	106	95.2 Å²	95.2	57%	0.567	47%	0.473	S	S	*	.	H	α-helix	trans	-62.3	-34.5	-179.6	-71.7	-19	0	0	0	111.6	E62 F70	E62-N66 VanDerWaalsContact O-CB 3.29Å; E62-N66 WeakPolarHBondContact O-CB 3.4Å; E62-N66 PolarHBondContact O-N 3.05Å; E62-N66 PolarHBondContact O-ND2 3.41Å; N66-F70 VanDerWaalsContact O-CB 3.28Å; N66-F70 WeakPolarHBondContact O-CB 3.45Å; N66-F70 PolarHBondContact O-N 3Å
67	F	47.9	Very low	44.1	Very low	48 Å²	48	95 Å²	95	21%	0.211	48%	0.476	C	S	.	.	H	α-helix	trans	-67.2	-41.8	171.7	-178.9	-106.1	0	0	0	112.6	L44 L48 I63 L64 K65 F70 L71 I98	L44-F67 HydrophobicContact CD2-CE2 4.41Å; L48-F67 HydrophobicContact CD1-CZ 4.45Å; L48-F67 HydrophobicContact CD2-CE2 3.97Å; L48-F67 HydrophobicContact CD2-CZ 3.96Å; I63-F67 WeakPolarHBondContact O-CB 3.22Å; I63-F67 PolarHBondContact O-N 3.11Å; L64-F67 PolarHBondContact O-N 3.25Å; K65-F67 PolarHBondContact O-N 2.8Å; F67-F70 PolarHBondContact O-N 3.3Å; F67-L71 HydrophobicContact CD1-CD1 4.01Å; F67-L71 HydrophobicContact CE1-CD1 3.55Å; F67-L71 HydrophobicContact CE1-CG 4.35Å; F67-L71 HydrophobicContact CZ-CD1 3.91Å; F67-L71 HydrophobicContact CZ-CG 4.34Å; F67-L71 WeakPolarHBondContact O-CG 3.45Å; F67-L71 PolarHBondContact O-N 3.21Å; F67-I98 HydrophobicContact CE1-CD1 4.15Å; F67-I98 HydrophobicContact CZ-CD1 4.08Å
68	F	46.7	Very low	44.2	Very low	86 Å²	86	93.5 Å²	93.5	38%	0.377	48%	0.478	S	S	.	.	H	α-helix	trans	-66.2	-42.6	175.2	-86	-68.4	0	0	0	113	L64 K65 L71 K72	L64-F68 HydrophobicContact CD2-CD2 4.48Å; L64-F68 HydrophobicContact CD2-CE2 4.03Å; L64-F68 HydrophobicContact CG-CD2 4.23Å; L64-F68 HydrophobicContact CG-CE2 4.04Å; L64-F68 VanDerWaalsContact O-CD2 3.27Å; L64-F68 WeakPolarHBondContact O-CD2 3.45Å; L64-F68 PolarHBondContact O-N 2.83Å; K65-F68 PolarHBondContact O-N 2.79Å; F68-L71 PolarHBondContact O-N 3.26Å; F68-K72 WeakPolarHBondContact O-CB 3.49Å; F68-K72 PolarHBondContact O-N 3.27Å
69	E	52.2	Low	43.8	Very low	94 Å²	94	89.4 Å²	89.4	44%	0.439	47%	0.469	S	S	.	.	H	α-helix	trans	-66.2	-36.4	174	-74.7	-60.4	142	0	0	111.8	K65 L71 K72 M73	K65-E69 PolarHBondContact O-N 3.31Å; E69-L71 PolarHBondContact O-N 3.13Å; E69-K72 WeakPolarHBondContact O-CB 3.36Å; E69-K72 PolarHBondContact O-N 3.29Å; E69-K72 WeakPolarHBondContact OE1-CD 3.44Å; E69-K72 IonicContact OE1-NZ 2.99Å; E69-K72 PolarHBondContact OE1-NZ 2.99Å; E69-K72 IonicContact OE2-NZ 2.69Å; E69-M73 WeakPolarHBondContact O-CG 3.3Å; E69-M73 PolarHBondContact O-N 2.87Å
70	F	48.4	Very low	43.5	Very low	110 Å²	110	93.7 Å²	93.7	48%	0.482	49%	0.485	S	S	.	.	H	α-helix	trans	-62.1	-40.6	171.5	-176.5	-92.4	0	0	0	112.4	L44 N66 F67 K72 M73 A74	L44-F70 HydrophobicContact CD1-CE1 4.11Å; N66-F70 VanDerWaalsContact O-CB 3.28Å; N66-F70 WeakPolarHBondContact O-CB 3.45Å; N66-F70 PolarHBondContact O-N 3Å; F67-F70 PolarHBondContact O-N 3.3Å; F70-K72 VanDerWaalsContact C-N 3.33Å; F70-K72 PolarHBondContact O-N 2.9Å; F70-M73 PolarHBondContact O-N 3.35Å; F70-A74 WeakPolarHBondContact O-CB 3.45Å; F70-A74 PolarHBondContact O-N 3.46Å
71	L	47.5	Very low	43.1	Very low	26 Å²	26	93.9 Å²	93.9	14%	0.136	49%	0.49	C	S	.	.	H	α-helix	trans	-65	-35.8	173.5	-72.8	174	0	0	0	112.6	F67 F68 E69 A74 Q75 F91	F67-L71 HydrophobicContact CD1-CD1 4.01Å; F67-L71 HydrophobicContact CE1-CD1 3.55Å; F67-L71 HydrophobicContact CE1-CG 4.35Å; F67-L71 HydrophobicContact CZ-CD1 3.91Å; F67-L71 HydrophobicContact CZ-CG 4.34Å; F67-L71 WeakPolarHBondContact O-CG 3.45Å; F67-L71 PolarHBondContact O-N 3.21Å; F68-L71 PolarHBondContact O-N 3.26Å; E69-L71 PolarHBondContact O-N 3.13Å; L71-A74 CarbonylContact O-C 3.58Å; L71-A74 WeakPolarHBondContact O-CB 3.49Å; L71-A74 PolarHBondContact O-N 2.96Å; L71-Q75 WeakPolarHBondContact O-CG 3.45Å; L71-Q75 PolarHBondContact O-N 3.29Å; L71-F91 HydrophobicContact CD2-CZ 3.79Å
72	K	46	Very low	42.4	Very low	112 Å²	112	93.4 Å²	93.4	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-71	-35.4	177	-167.5	170.3	162.3	-165.5	0	111.9	F68 E69 F70 Q75 T76	F68-K72 WeakPolarHBondContact O-CB 3.49Å; F68-K72 PolarHBondContact O-N 3.27Å; E69-K72 WeakPolarHBondContact O-CB 3.36Å; E69-K72 PolarHBondContact O-N 3.29Å; E69-K72 WeakPolarHBondContact OE1-CD 3.44Å; E69-K72 IonicContact OE1-NZ 2.99Å; E69-K72 PolarHBondContact OE1-NZ 2.99Å; E69-K72 IonicContact OE2-NZ 2.69Å; F70-K72 VanDerWaalsContact C-N 3.33Å; F70-K72 PolarHBondContact O-N 2.9Å; K72-Q75 PolarHBondContact O-N 3.49Å; K72-T76 PolarHBondContact O-N 3.03Å; K72-T76 VanDerWaalsContact O-N 3.13Å; K72-T76 PolarHBondContact O-OG1 3.35Å
73	M	41.6	Very low	41.9	Very low	123 Å²	123	91.8 Å²	91.8	61%	0.606	49%	0.489	S	S	*	.	H	α-helix	trans	-65.3	-38.4	167.2	-64.5	-109.2	72.2	0	0	111.8	E69 F70 Q75 T76 S77	E69-M73 WeakPolarHBondContact O-CG 3.3Å; E69-M73 PolarHBondContact O-N 2.87Å; F70-M73 PolarHBondContact O-N 3.35Å; M73-Q75 VanDerWaalsContact C-N 3.34Å; M73-T76 WeakPolarHBondContact CA-OG1 3.39Å; M73-T76 PolarHBondContact O-N 3.31Å; M73-T76 PolarHBondContact O-OG1 3.24Å; M73-S77 PolarHBondContact O-N 2.91Å; M73-S77 VanDerWaalsContact O-N 3.13Å; M73-S77 PolarHBondContact O-OG 3.14Å
74	A	41.3	Very low	41.7	Very low	27 Å²	27	93.2 Å²	93.2	22%	0.223	50%	0.498	C	S	.	.	H	α-helix	trans	-70.1	-26	175.1	0	0	0	0	0	113.7	F70 L71 S77 F80	F70-A74 WeakPolarHBondContact O-CB 3.45Å; F70-A74 PolarHBondContact O-N 3.46Å; L71-A74 CarbonylContact O-C 3.58Å; L71-A74 WeakPolarHBondContact O-CB 3.49Å; L71-A74 PolarHBondContact O-N 2.96Å; A74-S77 WeakPolarHBondContact CA-OG 3.49Å; A74-S77 PolarHBondContact O-OG 2.93Å; A74-F80 HydrophobicContact CB-CE2 4.24Å
75	Q	37.8	Very low	41.6	Very low	158 Å²	158	95.1 Å²	95.1	74%	0.738	51%	0.508	S	S	*	.	H	α-helix	trans	-80	-27.8	172.3	-76.8	-178	-27.5	0	0	113.6	L71 K72 M73	L71-Q75 WeakPolarHBondContact O-CG 3.45Å; L71-Q75 PolarHBondContact O-N 3.29Å; K72-Q75 PolarHBondContact O-N 3.49Å; M73-Q75 VanDerWaalsContact C-N 3.34Å
76	T	39.2	Very low	41.4	Very low	101 Å²	101	99 Å²	99	62%	0.62	53%	0.525	S	S	*	.	H	α-helix	trans	-90.1	-12.7	-179.5	43.9	0	0	0	0	113.5	K72 M73 S78	K72-T76 PolarHBondContact O-N 3.03Å; K72-T76 VanDerWaalsContact O-N 3.13Å; K72-T76 PolarHBondContact O-OG1 3.35Å; M73-T76 WeakPolarHBondContact CA-OG1 3.39Å; M73-T76 PolarHBondContact O-N 3.31Å; M73-T76 PolarHBondContact O-OG1 3.24Å; T76-S78 PolarHBondContact O-N 3.18Å
77	S	33.6	Very low	41.2	Very low	49 Å²	49	95.4 Å²	95.4	34%	0.343	51%	0.509	S	S	.	.			trans	-82.3	108.7	171	33.1	0	0	0	0	110.9	M73 A74 S79	M73-S77 PolarHBondContact O-N 2.91Å; M73-S77 VanDerWaalsContact O-N 3.13Å; M73-S77 PolarHBondContact O-OG 3.14Å; A74-S77 WeakPolarHBondContact CA-OG 3.49Å; A74-S77 PolarHBondContact O-OG 2.93Å; S77-S79 PolarHBondContact O-N 3.39Å
78	S	37.1	Very low	41.2	Very low	124 Å²	124	100.3 Å²	100.3	87%	0.867	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	20.6	-176.5	52.5	0	0	0	0	115.4	T76	T76-S78 PolarHBondContact O-N 3.18Å
79	S	32.6	Very low	41.3	Very low	87 Å²	87	100.9 Å²	100.9	61%	0.608	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	4	-169.8	51.4	0	0	0	0	114.7	S77 V81	S77-S79 PolarHBondContact O-N 3.39Å; S79-V81 PolarHBondContact O-N 3.04Å
80	F	35.1	Very low	41.1	Very low	149 Å²	149	100.9 Å²	100.9	65%	0.654	53%	0.533	S	S	*	.			trans	-74.6	55.9	171.4	-98.9	-79.4	0	0	0	113	A74 L83	A74-F80 HydrophobicContact CB-CE2 4.24Å; F80-L83 HydrophobicContact CD1-CD1 4.2Å; F80-L83 HydrophobicContact CE1-CD1 3.86Å
81	V	35.6	Very low	41.1	Very low	109 Å²	109	99.6 Å²	99.6	66%	0.661	53%	0.527	S	S	*	.			trans	-105.7	138.8	171.3	-176.2	0	0	0	0	108.2	S79	S79-V81 PolarHBondContact O-N 3.04Å
82	C	31.3	Very low	41.3	Very low	104 Å²	104	101.6 Å²	101.6	70%	0.703	54%	0.538	S	S	*	.			trans	68.5	69.2	-178.4	-62	0	0	0	0	117
83	L	35.6	Very low	41.5	Very low	55 Å²	55	99.8 Å²	99.8	29%	0.288	53%	0.533	S	S	.	.			trans	-125.9	127.1	150.5	-73.2	176.8	0	0	0	110	Q37 F80	Q37-L83 HydrophobicContact CB-CD2 4.39Å; F80-L83 HydrophobicContact CD1-CD1 4.2Å; F80-L83 HydrophobicContact CE1-CD1 3.86Å
84	N	41.4	Very low	41.9	Very low	135 Å²	135	95.9 Å²	95.9	72%	0.722	52%	0.517	S	S	*	.			trans	-47.9	146.3	-175.5	-70.7	-63.2	0	0	0	113.4	K86 S87 Y88	N84-K86 PolarHBondContact O-N 3.44Å; N84-S87 WeakPolarHBondContact O-CA 3.44Å; N84-S87 VanDerWaalsContact O-CB 3.31Å; N84-S87 WeakPolarHBondContact O-CB 3.42Å; N84-S87 PolarHBondContact O-N 2.99Å; N84-S87 PolarHBondContact O-OG 3.26Å; N84-Y88 PolarHBondContact O-N 3.01Å
85	D	44.3	Very low	42.5	Very low	96 Å²	96	98.5 Å²	98.5	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-45.2	-42.4	-175.3	-53	-41.9	0	0	0	113.9	S87 Y88 I89	D85-S87 PolarHBondContact O-N 3.22Å; D85-Y88 PolarHBondContact O-N 2.91Å; D85-I89 HydrophobicContact CB-CD1 4.47Å; D85-I89 WeakPolarHBondContact O-CB 3.24Å; D85-I89 WeakPolarHBondContact O-CD1 3.5Å; D85-I89 WeakPolarHBondContact O-CG1 3.18Å; D85-I89 PolarHBondContact O-N 3.4Å
86	K	43	Very low	43.2	Very low	179 Å²	179	92.5 Å²	92.5	78%	0.778	49%	0.494	S	S	*	.	H	α-helix	trans	-61.4	-39.5	179.1	-68.1	175.9	-178	168.3	0	112.8	N84 Q90	N84-K86 PolarHBondContact O-N 3.44Å; K86-Q90 WeakPolarHBondContact O-CB 3.48Å; K86-Q90 PolarHBondContact O-N 2.98Å
87	S	47.9	Very low	43.8	Very low	32 Å²	32	91.6 Å²	91.6	22%	0.224	49%	0.486	C	S	.	.	H	α-helix	trans	-66.2	-46.5	178.3	-37.4	0	0	0	0	110.7	F41 N84 D85 Q90 F91	F41-S87 WeakPolarHBondContact CZ-O 3.43Å; N84-S87 WeakPolarHBondContact O-CA 3.44Å; N84-S87 VanDerWaalsContact O-CB 3.31Å; N84-S87 WeakPolarHBondContact O-CB 3.42Å; N84-S87 PolarHBondContact O-N 2.99Å; N84-S87 PolarHBondContact O-OG 3.26Å; D85-S87 PolarHBondContact O-N 3.22Å; S87-Q90 PolarHBondContact O-N 3.41Å; S87-F91 PolarHBondContact O-N 3.24Å
88	Y	47.8	Very low	44.7	Very low	151 Å²	151	91.6 Å²	91.6	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-67.2	-43.3	-179.8	-172.4	-107.4	0	0	0	111.8	N84 D85 Q90 F91 L92	N84-Y88 PolarHBondContact O-N 3.01Å; D85-Y88 PolarHBondContact O-N 2.91Å; Y88-Q90 VanDerWaalsContact C-N 3.33Å; Y88-Q90 PolarHBondContact O-N 3.33Å; Y88-F91 WeakPolarHBondContact O-CB 3.44Å; Y88-F91 PolarHBondContact O-N 3.46Å; Y88-L92 HydrophobicContact CD1-CD1 3.77Å; Y88-L92 HydrophobicContact CE1-CD1 3.28Å; Y88-L92 HydrophobicContact CE2-CD1 4.39Å; Y88-L92 HydrophobicContact CG-CD1 4.49Å; Y88-L92 PolarHBondContact O-N 3.31Å
89	I	47	Very low	45.5	Very low	97 Å²	97	87.2 Å²	87.2	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-41.1	172.9	-69.7	166	0	0	0	111.1	D85 L92 L93	D85-I89 HydrophobicContact CB-CD1 4.47Å; D85-I89 WeakPolarHBondContact O-CB 3.24Å; D85-I89 WeakPolarHBondContact O-CD1 3.5Å; D85-I89 WeakPolarHBondContact O-CG1 3.18Å; D85-I89 PolarHBondContact O-N 3.4Å; I89-L92 PolarHBondContact O-N 3.09Å; I89-L93 HydrophobicContact CG2-CD1 3.93Å; I89-L93 HydrophobicContact CG2-CG 4.48Å; I89-L93 WeakPolarHBondContact O-CB 3.1Å; I89-L93 VanDerWaalsContact O-CG 3.27Å; I89-L93 WeakPolarHBondContact O-CG 3.33Å; I89-L93 PolarHBondContact O-N 2.9Å
90	Q	47.9	Very low	46.4	Very low	95 Å²	95	87.4 Å²	87.4	44%	0.444	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-38.7	176.6	-169.4	77	-5.6	0	0	111.8	K86 S87 Y88 L93 C94	K86-Q90 WeakPolarHBondContact O-CB 3.48Å; K86-Q90 PolarHBondContact O-N 2.98Å; S87-Q90 PolarHBondContact O-N 3.41Å; Y88-Q90 VanDerWaalsContact C-N 3.33Å; Y88-Q90 PolarHBondContact O-N 3.33Å; Q90-L93 PolarHBondContact O-N 2.97Å; Q90-C94 PolarHBondContact O-N 2.86Å
91	F	48.6	Very low	47.1	Very low	82 Å²	82	85.5 Å²	85.5	36%	0.36	43%	0.434	S	S	.	.	H	α-helix	trans	-63.9	-47.7	174.7	-170.6	-104.9	0	0	0	112	F41 L71 S87 Y88 L93 C94 Y95	F41-F91 HydrophobicContact CE2-CB 3.95Å; F41-F91 AromaticContact CE2-CD2 3.85Å; F41-F91 HydrophobicContact CE2-CD2 3.85Å; F41-F91 HydrophobicContact CE2-CG 4.29Å; F41-F91 HydrophobicContact CZ-CB 4.19Å; L71-F91 HydrophobicContact CD2-CZ 3.79Å; S87-F91 PolarHBondContact O-N 3.24Å; Y88-F91 WeakPolarHBondContact O-CB 3.44Å; Y88-F91 PolarHBondContact O-N 3.46Å; F91-L93 VanDerWaalsContact C-N 3.32Å; F91-L93 PolarHBondContact O-N 3.44Å; F91-C94 WeakPolarHBondContact O-CB 3.18Å; F91-C94 PolarHBondContact O-N 3.35Å; F91-C94 VanDerWaalsContact O-N 3.15Å; F91-Y95 WeakPolarHBondContact O-CB 3.48Å; F91-Y95 PolarHBondContact O-N 3.33Å
92	L	51.5	Low	47.8	Very low	69 Å²	69	86 Å²	86	36%	0.361	42%	0.424	S	S	.	.	H	α-helix	trans	-58.8	-41.2	174	-107.9	134	0	0	0	112.2	Y88 I89 Y95 I96	Y88-L92 HydrophobicContact CD1-CD1 3.77Å; Y88-L92 HydrophobicContact CE1-CD1 3.28Å; Y88-L92 HydrophobicContact CE2-CD1 4.39Å; Y88-L92 HydrophobicContact CG-CD1 4.49Å; Y88-L92 PolarHBondContact O-N 3.31Å; I89-L92 PolarHBondContact O-N 3.09Å; L92-Y95 PolarHBondContact O-N 2.96Å; L92-I96 HydrophobicContact CD2-CD1 4.34Å; L92-I96 WeakPolarHBondContact O-CB 3.24Å; L92-I96 VanDerWaalsContact O-CG1 3.27Å; L92-I96 WeakPolarHBondContact O-CG1 3.39Å; L92-I96 PolarHBondContact O-N 3.44Å
93	L	51.2	Low	48.8	Very low	74 Å²	74	84.7 Å²	84.7	39%	0.387	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-41.8	174.4	-75.6	166.7	0	0	0	111.9	I89 Q90 F91 N97	I89-L93 HydrophobicContact CG2-CD1 3.93Å; I89-L93 HydrophobicContact CG2-CG 4.48Å; I89-L93 WeakPolarHBondContact O-CB 3.1Å; I89-L93 VanDerWaalsContact O-CG 3.27Å; I89-L93 WeakPolarHBondContact O-CG 3.33Å; I89-L93 PolarHBondContact O-N 2.9Å; Q90-L93 PolarHBondContact O-N 2.97Å; F91-L93 VanDerWaalsContact C-N 3.32Å; F91-L93 PolarHBondContact O-N 3.44Å; L93-N97 PolarHBondContact O-N 2.98Å; L93-N97 PolarHBondContact O-ND2 3.47Å
94	C	49.3	Very low	49.5	Very low	40 Å²	40	86 Å²	86	27%	0.27	41%	0.412	S	S	.	.	H	α-helix	trans	-62.6	-46.8	173.2	-81.5	0	0	0	0	111.9	Q90 F91 I96 N97 I98	Q90-C94 PolarHBondContact O-N 2.86Å; F91-C94 WeakPolarHBondContact O-CB 3.18Å; F91-C94 PolarHBondContact O-N 3.35Å; F91-C94 VanDerWaalsContact O-N 3.15Å; C94-I96 PolarHBondContact O-N 3.48Å; C94-N97 PolarHBondContact O-N 3.21Å; C94-I98 WeakPolarHBondContact O-CG1 3.26Å; C94-I98 PolarHBondContact O-N 2.91Å
95	Y	54.1	Low	50.1	Low	82 Å²	82	83.7 Å²	83.7	32%	0.322	39%	0.394	S	S	.	.	H	α-helix	trans	-57.4	-46.8	177.3	179.7	-106.1	0	0	0	112.3	F91 L92 N97 I98 I99	F91-Y95 WeakPolarHBondContact O-CB 3.48Å; F91-Y95 PolarHBondContact O-N 3.33Å; L92-Y95 PolarHBondContact O-N 2.96Å; Y95-N97 PolarHBondContact O-N 2.97Å; Y95-I98 PolarHBondContact O-N 3.48Å; Y95-I99 HydrophobicContact CD1-CD1 3.94Å; Y95-I99 HydrophobicContact CE1-CD1 3.47Å; Y95-I99 VanDerWaalsContact CE1-CD1 3.47Å; Y95-I99 HydrophobicContact CE2-CD1 4.15Å; Y95-I99 HydrophobicContact CG-CD1 4.46Å; Y95-I99 PolarHBondContact O-N 3.11Å
96	I	52.7	Low	50.3	Low	32 Å²	32	83.3 Å²	83.3	16%	0.164	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-40.2	176.4	-68.4	164.8	0	0	0	111.6	L92 C94 I99 Q100	L92-I96 HydrophobicContact CD2-CD1 4.34Å; L92-I96 WeakPolarHBondContact O-CB 3.24Å; L92-I96 VanDerWaalsContact O-CG1 3.27Å; L92-I96 WeakPolarHBondContact O-CG1 3.39Å; L92-I96 PolarHBondContact O-N 3.44Å; C94-I96 PolarHBondContact O-N 3.48Å; I96-I99 PolarHBondContact O-N 3.29Å; I96-Q100 HydrophobicContact CG2-CG 4.5Å; I96-Q100 WeakPolarHBondContact O-CB 3.35Å; I96-Q100 VanDerWaalsContact O-CG 3.31Å; I96-Q100 WeakPolarHBondContact O-CG 3.31Å; I96-Q100 PolarHBondContact O-N 2.8Å
97	N	51.6	Low	50.7	Low	83 Å²	83	77.1 Å²	77.1	44%	0.444	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-37.3	176.5	-83.8	-101.1	0	0	0	112.1	L93 C94 Y95 Q100 M101	L93-N97 PolarHBondContact O-N 2.98Å; L93-N97 PolarHBondContact O-ND2 3.47Å; C94-N97 PolarHBondContact O-N 3.21Å; Y95-N97 PolarHBondContact O-N 2.97Å; N97-Q100 PolarHBondContact O-N 3.41Å; N97-M101 WeakPolarHBondContact O-CB 3.22Å; N97-M101 VanDerWaalsContact O-CG 3.24Å; N97-M101 WeakPolarHBondContact O-CG 3.29Å; N97-M101 PolarHBondContact O-N 2.94Å
98	I	52.3	Low	50.8	Low	49 Å²	49	80.5 Å²	80.5	25%	0.251	38%	0.377	S	S	.	.	H	α-helix	trans	-65.6	-44.4	176.6	-68.1	163.6	0	0	0	110.5	L48 F67 C94 Y95 Q100 M101 Y102	L48-I98 HydrophobicContact CD1-CD1 4.47Å; L48-I98 HydrophobicContact CD2-CD1 4.12Å; F67-I98 HydrophobicContact CE1-CD1 4.15Å; F67-I98 HydrophobicContact CZ-CD1 4.08Å; C94-I98 WeakPolarHBondContact O-CG1 3.26Å; C94-I98 PolarHBondContact O-N 2.91Å; Y95-I98 PolarHBondContact O-N 3.48Å; I98-Q100 PolarHBondContact O-N 3.32Å; I98-M101 PolarHBondContact O-N 2.84Å; I98-Y102 WeakPolarHBondContact O-CB 3.27Å; I98-Y102 PolarHBondContact O-N 3.35Å
99	I	53.8	Low	50.7	Low	31 Å²	31	76.1 Å²	76.1	16%	0.159	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-43.7	175.1	-69.7	172.4	0	0	0	111.2	Y95 I96 Y102 Y103	Y95-I99 HydrophobicContact CD1-CD1 3.94Å; Y95-I99 HydrophobicContact CE1-CD1 3.47Å; Y95-I99 VanDerWaalsContact CE1-CD1 3.47Å; Y95-I99 HydrophobicContact CE2-CD1 4.15Å; Y95-I99 HydrophobicContact CG-CD1 4.46Å; Y95-I99 PolarHBondContact O-N 3.11Å; I96-I99 PolarHBondContact O-N 3.29Å; I99-Y102 PolarHBondContact O-N 3.09Å; I99-Y103 WeakPolarHBondContact O-CB 3.27Å; I99-Y103 PolarHBondContact O-N 2.98Å
100	Q	52.3	Low	50.5	Low	91 Å²	91	76.3 Å²	76.3	43%	0.425	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-44.5	176.9	-75.3	173.7	-17.9	0	0	111.8	I96 N97 I98 Y102 Y103 D104	I96-Q100 HydrophobicContact CG2-CG 4.5Å; I96-Q100 WeakPolarHBondContact O-CB 3.35Å; I96-Q100 VanDerWaalsContact O-CG 3.31Å; I96-Q100 WeakPolarHBondContact O-CG 3.31Å; I96-Q100 PolarHBondContact O-N 2.8Å; N97-Q100 PolarHBondContact O-N 3.41Å; I98-Q100 PolarHBondContact O-N 3.32Å; Q100-Y102 PolarHBondContact O-N 3.19Å; Q100-Y103 PolarHBondContact O-N 2.88Å; Q100-D104 PolarHBondContact O-N 3.43Å
101	M	50.6	Low	50.2	Low	110 Å²	110	77.8 Å²	77.8	54%	0.542	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-37.5	177.4	-69.9	-93.9	58.9	0	0	112.8	N97 I98 D104 Y105	N97-M101 WeakPolarHBondContact O-CB 3.22Å; N97-M101 VanDerWaalsContact O-CG 3.24Å; N97-M101 WeakPolarHBondContact O-CG 3.29Å; N97-M101 PolarHBondContact O-N 2.94Å; I98-M101 PolarHBondContact O-N 2.84Å; M101-D104 HydrophobicContact CE-CB 4.36Å; M101-Y105 WeakPolarHBondContact O-CB 3.39Å; M101-Y105 PolarHBondContact O-N 2.9Å
102	Y	50.6	Low	49.8	Very low	118 Å²	118	81.5 Å²	81.5	46%	0.463	39%	0.393	S	S	.	.	H	α-helix	trans	-64.9	-41.6	173.1	-178.1	-98.8	0	0	0	111.9	L64 I98 I99 Q100 Y105 Y106	L64-Y102 HydrophobicContact CD2-CD2 4.23Å; L64-Y102 HydrophobicContact CD2-CE2 4.01Å; I98-Y102 WeakPolarHBondContact O-CB 3.27Å; I98-Y102 PolarHBondContact O-N 3.35Å; I99-Y102 PolarHBondContact O-N 3.09Å; Q100-Y102 PolarHBondContact O-N 3.19Å; Y102-Y105 PolarHBondContact O-N 2.93Å; Y102-Y106 VanDerWaalsContact O-CB 3.31Å; Y102-Y106 WeakPolarHBondContact O-CB 3.22Å; Y102-Y106 PolarHBondContact O-N 3.37Å
103	Y	51.4	Low	49	Very low	78 Å²	78	83.7 Å²	83.7	31%	0.306	41%	0.405	S	S	.	.	H	α-helix	trans	-66.9	-41.4	177.3	-169.3	-109.8	0	0	0	112.3	I99 Q100 Y106 N107 R130	I99-Y103 WeakPolarHBondContact O-CB 3.27Å; I99-Y103 PolarHBondContact O-N 2.98Å; Q100-Y103 PolarHBondContact O-N 2.88Å; Y103-Y106 PolarHBondContact O-N 3.48Å; Y103-N107 WeakPolarHBondContact CD1-ND2 3.5Å; Y103-N107 WeakPolarHBondContact CE1-ND2 3.1Å; Y103-N107 WeakPolarHBondContact O-CB 3.14Å; Y103-N107 VanDerWaalsContact O-CG 3.31Å; Y103-N107 PolarHBondContact O-N 2.89Å; Y103-N107 PolarHBondContact O-ND2 3.22Å; Y103-R130 PolarHBondContact OH-NE 3.49Å; Y103-R130 PolarHBondContact OH-NH2 2.97Å; Y103-R130 VanDerWaalsContact OH-NH2 3.13Å
104	D	51.3	Low	48.4	Very low	81 Å²	81	87.7 Å²	87.7	43%	0.433	42%	0.423	S	S	.	.	H	α-helix	trans	-63.2	-43.8	174.2	-75.2	-15.2	0	0	0	111.3	Q100 M101 N108	Q100-D104 PolarHBondContact O-N 3.43Å; M101-D104 HydrophobicContact CE-CB 4.36Å; D104-N108 WeakPolarHBondContact O-CB 3.26Å; D104-N108 VanDerWaalsContact O-CG 3.29Å; D104-N108 PolarHBondContact O-N 2.9Å; D104-N108 PolarHBondContact O-ND2 3.24Å
105	Y	52.6	Low	47.7	Very low	88 Å²	88	93.4 Å²	93.4	35%	0.345	45%	0.451	S	S	.	.	H	α-helix	trans	-61.7	-47.4	174.5	176.3	-115.7	0	0	0	112.1	I56 M101 Y102 N107 N108 N109	I56-Y105 HydrophobicContact CB-CE2 4.48Å; I56-Y105 HydrophobicContact CG2-CD2 3.79Å; I56-Y105 HydrophobicContact CG2-CE1 4.21Å; I56-Y105 HydrophobicContact CG2-CE2 3.42Å; I56-Y105 VanDerWaalsContact CG2-CE2 3.42Å; I56-Y105 HydrophobicContact CG2-CG 4.33Å; M101-Y105 WeakPolarHBondContact O-CB 3.39Å; M101-Y105 PolarHBondContact O-N 2.9Å; Y102-Y105 PolarHBondContact O-N 2.93Å; Y105-N107 PolarHBondContact O-N 2.74Å; Y105-N108 PolarHBondContact O-N 2.95Å; Y105-N109 WeakPolarHBondContact CE2-ND2 3.3Å; Y105-N109 PolarHBondContact O-N 2.71Å; Y105-N109 PolarHBondContact OH-ND2 3.38Å
106	Y	48.9	Very low	46.7	Very low	87 Å²	87	98.8 Å²	98.8	34%	0.341	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-42.3	178.9	-175.3	-96.8	0	0	0	112	Y102 Y103 N109 K110	Y102-Y106 VanDerWaalsContact O-CB 3.31Å; Y102-Y106 WeakPolarHBondContact O-CB 3.22Å; Y102-Y106 PolarHBondContact O-N 3.37Å; Y103-Y106 PolarHBondContact O-N 3.48Å; Y106-N109 PolarHBondContact O-N 2.79Å; Y106-K110 HydrophobicContact CE1-CD 4.02Å; Y106-K110 VanDerWaalsContact O-CB 3.24Å; Y106-K110 WeakPolarHBondContact O-CB 3.36Å; Y106-K110 PolarHBondContact O-N 3.31Å
107	N	51.9	Low	45.6	Very low	49 Å²	49	100.7 Å²	100.7	26%	0.262	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-41.4	176.4	-73.2	-41.2	0	0	0	112.7	Y103 Y105 N109 K110 N111	Y103-N107 WeakPolarHBondContact CD1-ND2 3.5Å; Y103-N107 WeakPolarHBondContact CE1-ND2 3.1Å; Y103-N107 WeakPolarHBondContact O-CB 3.14Å; Y103-N107 VanDerWaalsContact O-CG 3.31Å; Y103-N107 PolarHBondContact O-N 2.89Å; Y103-N107 PolarHBondContact O-ND2 3.22Å; Y105-N107 PolarHBondContact O-N 2.74Å; N107-N109 VanDerWaalsContact C-N 3.32Å; N107-N109 PolarHBondContact O-N 3.48Å; N107-K110 PolarHBondContact O-N 2.79Å; N107-N111 PolarHBondContact O-N 3.21Å; N107-N111 PolarHBondContact O-ND2 3.22Å
108	N	50.5	Low	44.7	Very low	104 Å²	104	103.9 Å²	103.9	56%	0.556	52%	0.521	S	S	*	.	H	α-helix	trans	-61.4	-41	175.8	-76.1	-46.2	0	0	0	111.6	D104 Y105	D104-N108 WeakPolarHBondContact O-CB 3.26Å; D104-N108 VanDerWaalsContact O-CG 3.29Å; D104-N108 PolarHBondContact O-N 2.9Å; D104-N108 PolarHBondContact O-ND2 3.24Å; Y105-N108 PolarHBondContact O-N 2.95Å
109	N	45.3	Very low	43.9	Very low	59 Å²	59	107.7 Å²	107.7	32%	0.316	54%	0.542	S	S	.	.	H	α-helix	trans	-73.8	-33.5	175.3	-78	-7.9	0	0	0	113.4	Y105 Y106 N107 N111 M112 N113	Y105-N109 WeakPolarHBondContact CE2-ND2 3.3Å; Y105-N109 PolarHBondContact O-N 2.71Å; Y105-N109 PolarHBondContact OH-ND2 3.38Å; Y106-N109 PolarHBondContact O-N 2.79Å; N107-N109 VanDerWaalsContact C-N 3.32Å; N107-N109 PolarHBondContact O-N 3.48Å; N109-N111 VanDerWaalsContact C-N 3.27Å; N109-N111 PolarHBondContact O-N 3.47Å; N109-M112 PolarHBondContact O-N 3Å; N109-N113 WeakPolarHBondContact O-CB 3.37Å; N109-N113 PolarHBondContact O-N 2.9Å
110	K	42.9	Very low	43.2	Very low	100 Å²	100	111.8 Å²	111.8	44%	0.435	56%	0.564	S	S	.	*	H	α-helix	trans	-63.7	-33.8	175	-171.2	168.9	-175.8	170.3	0	111.9	Y106 N107 M112	Y106-K110 HydrophobicContact CE1-CD 4.02Å; Y106-K110 VanDerWaalsContact O-CB 3.24Å; Y106-K110 WeakPolarHBondContact O-CB 3.36Å; Y106-K110 PolarHBondContact O-N 3.31Å; N107-K110 PolarHBondContact O-N 2.79Å; K110-M112 PolarHBondContact O-N 2.73Å
111	N	41.9	Very low	42.6	Very low	127 Å²	127	113.7 Å²	113.7	68%	0.679	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-14.9	172.9	-69.3	-23	0	0	0	113.9	N107 N109	N107-N111 PolarHBondContact O-N 3.21Å; N107-N111 PolarHBondContact O-ND2 3.22Å; N109-N111 VanDerWaalsContact C-N 3.27Å; N109-N111 PolarHBondContact O-N 3.47Å
112	M	39.9	Very low	42	Very low	160 Å²	160	113.8 Å²	113.8	79%	0.788	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-30.3	173.6	-71.4	-68.3	-175.4	0	0	113.2	N109 K110	N109-M112 PolarHBondContact O-N 3Å; K110-M112 PolarHBondContact O-N 2.73Å
113	N	34.5	Very low	41.5	Very low	114 Å²	114	110.9 Å²	110.9	61%	0.61	57%	0.572	S	S	*	*			trans	-103.2	40	-170.7	-77.3	-37.9	0	0	0	114.9	N109 N115	N109-N113 WeakPolarHBondContact O-CB 3.37Å; N109-N113 PolarHBondContact O-N 2.9Å; N113-N115 PolarHBondContact O-N 2.98Å
114	M	37.2	Very low	41	Very low	158 Å²	158	114.4 Å²	114.4	78%	0.778	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	5.8	175.9	-70.8	-74.3	-83.9	0	0	114.8
115	N	35.2	Very low	40.6	Very low	161 Å²	161	117.6 Å²	117.6	86%	0.861	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	8.2	-170.5	-83.1	-11.6	0	0	0	116	N113	N113-N115 PolarHBondContact O-N 2.98Å
116	K	32.8	Very low	39.7	Very low	195 Å²	195	115.1 Å²	115.1	85%	0.848	60%	0.601	S	S	*	*			trans	-133.9	117	168.3	-80.8	-171.5	174.4	179.2	0	111.6
117	G	30.7	Very low	39.3	Very low	71 Å²	71	114.8 Å²	114.8	73%	0.732	60%	0.602	S	S	*	*			trans	-80.9	-172.1	173.9	0	0	0	0	0	113.4
118	N	33.2	Very low	38.9	Very low	151 Å²	151	118 Å²	118	81%	0.807	62%	0.619	S	S	*	*			trans	60.5	91	-175.2	-67.3	-6	0	0	0	114.9
119	N	35.3	Very low	38.3	Very low	129 Å²	129	116.1 Å²	116.1	69%	0.69	61%	0.609	S	S	*	*			trans	-177.5	67.1	138	-91.4	-24.4	0	0	0	109.7
120	N	39.1	Very low	37.9	Very low	116 Å²	116	117.9 Å²	117.9	62%	0.62	61%	0.612	S	S	*	*			trans	-72.4	-29.9	-172.7	-68.2	-1.9	0	0	0	113.4	N122 I123	N120-N122 VanDerWaalsContact C-N 3.29Å; N120-N122 PolarHBondContact O-N 3.29Å; N120-I123 WeakPolarHBondContact O-CB 3.41Å; N120-I123 PolarHBondContact O-N 3.02Å; N120-I123 VanDerWaalsContact O-N 3.12Å
121	N	38.7	Very low	37.8	Very low	131 Å²	131	116.4 Å²	116.4	70%	0.701	61%	0.611	S	S	*	*	H	α-helix	trans	-64.7	-31.7	-170	-55.5	21.8	0	0	0	112.8	I123	N121-I123 PolarHBondContact O-N 2.91Å
122	N	38.4	Very low	37.5	Very low	112 Å²	112	115.6 Å²	115.6	60%	0.599	61%	0.606	S	S	*	*	H	α-helix	trans	-77.5	1.6	-179.2	-58.3	13	0	0	0	113.1	N120	N120-N122 VanDerWaalsContact C-N 3.29Å; N120-N122 PolarHBondContact O-N 3.29Å
123	I	40.4	Very low	37.2	Very low	58 Å²	58	109.1 Å²	109.1	30%	0.297	58%	0.575	S	S	.	*	H	α-helix	trans	-92.5	-31.2	-179.2	-59.1	178.4	0	0	0	110.9	N120 N121 A126 E127	N120-I123 WeakPolarHBondContact O-CB 3.41Å; N120-I123 PolarHBondContact O-N 3.02Å; N120-I123 VanDerWaalsContact O-N 3.12Å; N121-I123 PolarHBondContact O-N 2.91Å; I123-A126 PolarHBondContact O-N 2.93Å; I123-E127 PolarHBondContact O-N 2.82Å; I123-E127 VanDerWaalsContact O-N 3.11Å
124	E	41.6	Very low	37.3	Very low	152 Å²	152	107.7 Å²	107.7	71%	0.71	57%	0.567	S	S	*	*	H	α-helix	trans	-74	-44	-178.2	-65.2	-173.8	132.4	0	0	112	A126 E127 D128	E124-A126 PolarHBondContact O-N 2.74Å; E124-E127 PolarHBondContact O-N 2.86Å; E124-D128 PolarHBondContact O-N 3.41Å
125	E	42.2	Very low	37.3	Very low	147 Å²	147	108.3 Å²	108.3	69%	0.687	57%	0.566	S	S	*	*	H	α-helix	trans	-57.7	-33.3	172.3	-69.5	-171.2	126.3	0	0	112.4	L129	E125-L129 WeakPolarHBondContact O-CG 3.17Å; E125-L129 PolarHBondContact O-N 3.02Å
126	A	34.1	Very low	37.2	Very low	37 Å²	37	103.4 Å²	103.4	31%	0.306	54%	0.541	S	S	.	.	H	α-helix	trans	-74	-31.3	176.7	0	0	0	0	0	112.9	I123 E124 R130	I123-A126 PolarHBondContact O-N 2.93Å; E124-A126 PolarHBondContact O-N 2.74Å; A126-R130 WeakPolarHBondContact O-CB 3.45Å; A126-R130 PolarHBondContact O-N 3.03Å
127	E	40.2	Very low	37.2	Very low	79 Å²	79	98 Å²	98	37%	0.369	52%	0.522	S	S	.	.	H	α-helix	trans	-77.1	-31.7	172.7	-76.7	-70.4	147.9	0	0	112.4	I123 E124 R130 V131	I123-E127 PolarHBondContact O-N 2.82Å; I123-E127 VanDerWaalsContact O-N 3.11Å; E124-E127 PolarHBondContact O-N 2.86Å; E127-R130 VanDerWaalsContact CD-NH1 3.29Å; E127-R130 CarbonylContact O-C 3.48Å; E127-R130 WeakPolarHBondContact O-CA 3.09Å; E127-R130 WeakPolarHBondContact O-CB 3.47Å; E127-R130 PolarHBondContact O-N 3.1Å; E127-R130 WeakPolarHBondContact OE1-CD 3.39Å; E127-R130 IonicContact OE1-CZ 3.58Å; E127-R130 IonicContact OE1-NE 2.75Å; E127-R130 IonicContact OE1-NH1 3.7Å; E127-R130 PolarHBondContact OE1-NH1 3.09Å; E127-R130 WeakPolarHBondContact OE2-CD 3.14Å; E127-R130 IonicContact OE2-CZ 3.23Å; E127-R130 IonicContact OE2-NE 3.4Å; E127-R130 IonicContact OE2-NH1 2.67Å; E127-R130 PolarHBondContact OE2-NH1 3.2Å; E127-V131 WeakPolarHBondContact O-CG2 3.18Å; E127-V131 PolarHBondContact O-N 3.23Å
128	D	42.6	Very low	37.2	Very low	116 Å²	116	100 Å²	100	62%	0.62	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-44.7	175.2	-99.6	-16.3	0	0	0	112.1	E124 R130 V131 I132	E124-D128 PolarHBondContact O-N 3.41Å; D128-R130 PolarHBondContact O-N 3.31Å; D128-V131 PolarHBondContact O-N 3.18Å; D128-V131 VanDerWaalsContact O-N 3.12Å; D128-I132 PolarHBondContact O-N 3.24Å; D128-I132 VanDerWaalsContact O-N 3.16Å
129	L	38.4	Very low	37.2	Very low	66 Å²	66	97.8 Å²	97.8	35%	0.346	50%	0.503	S	S	.	.	H	α-helix	trans	-57.1	-35.1	169.7	-69.4	172.5	0	0	0	111.5	E125 I132 V133	E125-L129 WeakPolarHBondContact O-CG 3.17Å; E125-L129 PolarHBondContact O-N 3.02Å; L129-I132 PolarHBondContact O-N 3.29Å; L129-V133 WeakPolarHBondContact O-CG2 3.44Å; L129-V133 PolarHBondContact O-N 3.25Å
130	R	37.6	Very low	37	Very low	95 Å²	95	96 Å²	96	36%	0.358	50%	0.501	S	S	.	.	H	α-helix	trans	-71.4	-31.8	178.3	-164.6	171.3	175.4	-103.6	6.5	112.4	Y103 A126 E127 D128 N134	Y103-R130 PolarHBondContact OH-NE 3.49Å; Y103-R130 PolarHBondContact OH-NH2 2.97Å; Y103-R130 VanDerWaalsContact OH-NH2 3.13Å; A126-R130 WeakPolarHBondContact O-CB 3.45Å; A126-R130 PolarHBondContact O-N 3.03Å; E127-R130 VanDerWaalsContact CD-NH1 3.29Å; E127-R130 CarbonylContact O-C 3.48Å; E127-R130 WeakPolarHBondContact O-CA 3.09Å; E127-R130 WeakPolarHBondContact O-CB 3.47Å; E127-R130 PolarHBondContact O-N 3.1Å; E127-R130 WeakPolarHBondContact OE1-CD 3.39Å; E127-R130 IonicContact OE1-CZ 3.58Å; E127-R130 IonicContact OE1-NE 2.75Å; E127-R130 IonicContact OE1-NH1 3.7Å; E127-R130 PolarHBondContact OE1-NH1 3.09Å; E127-R130 WeakPolarHBondContact OE2-CD 3.14Å; E127-R130 IonicContact OE2-CZ 3.23Å; E127-R130 IonicContact OE2-NE 3.4Å; E127-R130 IonicContact OE2-NH1 2.67Å; E127-R130 PolarHBondContact OE2-NH1 3.2Å; D128-R130 PolarHBondContact O-N 3.31Å; R130-N134 VanDerWaalsContact CG-ND2 3.33Å; R130-N134 WeakPolarHBondContact CG-ND2 3.39Å; R130-N134 WeakPolarHBondContact O-CB 3.34Å; R130-N134 PolarHBondContact O-N 2.84Å; R130-N134 PolarHBondContact O-ND2 3.46Å
131	V	39.7	Very low	36.7	Very low	70 Å²	70	93.3 Å²	93.3	42%	0.424	49%	0.49	S	S	.	.	H	α-helix	trans	-68.9	-41.6	172.5	171.7	0	0	0	0	111.2	E127 D128 K135	E127-V131 WeakPolarHBondContact O-CG2 3.18Å; E127-V131 PolarHBondContact O-N 3.23Å; D128-V131 PolarHBondContact O-N 3.18Å; D128-V131 VanDerWaalsContact O-N 3.12Å; V131-K135 HydrophobicContact CG1-CD 4.38Å; V131-K135 PolarHBondContact O-N 3.03Å; V131-K135 VanDerWaalsContact O-N 3.16Å
132	I	35.9	Very low	36.3	Very low	110 Å²	110	88.4 Å²	88.4	56%	0.564	47%	0.466	S	S	*	.	H	α-helix	trans	-62.8	-55	176.6	-63.6	168.8	0	0	0	109.8	D128 L129 N134 K135 T136	D128-I132 PolarHBondContact O-N 3.24Å; D128-I132 VanDerWaalsContact O-N 3.16Å; L129-I132 PolarHBondContact O-N 3.29Å; I132-N134 PolarHBondContact O-N 3.14Å; I132-K135 PolarHBondContact O-N 3.44Å; I132-T136 PolarHBondContact O-N 3.33Å; I132-T136 PolarHBondContact O-OG1 3.14Å
133	V	33.4	Very low	36.2	Very low	24 Å²	24	87.1 Å²	87.1	15%	0.145	46%	0.459	C	S	.	.	H	α-helix	trans	-63.1	-40.2	-177.8	173.1	0	0	0	0	111.9	L129 T136	L129-V133 WeakPolarHBondContact O-CG2 3.44Å; L129-V133 PolarHBondContact O-N 3.25Å; V133-T136 WeakPolarHBondContact CA-OG1 3.42Å; V133-T136 PolarHBondContact O-N 3.37Å; V133-T136 PolarHBondContact O-OG1 2.79Å
134	N	36.8	Very low	35.8	Very low	84 Å²	84	88.4 Å²	88.4	45%	0.449	47%	0.466	S	S	.	.	H	α-helix	trans	-75.5	-25	-178.1	-75.9	-63.1	0	0	0	114.7	R130 I132 T136 N137	R130-N134 VanDerWaalsContact CG-ND2 3.33Å; R130-N134 WeakPolarHBondContact CG-ND2 3.39Å; R130-N134 WeakPolarHBondContact O-CB 3.34Å; R130-N134 PolarHBondContact O-N 2.84Å; R130-N134 PolarHBondContact O-ND2 3.46Å; I132-N134 PolarHBondContact O-N 3.14Å; N134-T136 VanDerWaalsContact C-N 3.28Å; N134-N137 WeakPolarHBondContact CA-ND2 2.93Å; N134-N137 PolarHBondContact O-ND2 3.46Å; N134-N137 PolarHBondContact OD1-ND2 2.82Å
135	K	36.4	Very low	35.4	Very low	171 Å²	171	88.6 Å²	88.6	74%	0.743	47%	0.471	S	S	*	.	H	α-helix	trans	-68.3	-28.1	167.7	-83.3	174.4	176.3	167.1	0	112.3	V131 I132 N137	V131-K135 HydrophobicContact CG1-CD 4.38Å; V131-K135 PolarHBondContact O-N 3.03Å; V131-K135 VanDerWaalsContact O-N 3.16Å; I132-K135 PolarHBondContact O-N 3.44Å; K135-N137 VanDerWaalsContact C-N 3.34Å
136	T	33.4	Very low	34.8	Very low	57 Å²	57	87.8 Å²	87.8	35%	0.35	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	7.7	177.7	54.6	0	0	0	0	115	I132 V133 N134 D138 I139	I132-T136 PolarHBondContact O-N 3.33Å; I132-T136 PolarHBondContact O-OG1 3.14Å; V133-T136 WeakPolarHBondContact CA-OG1 3.42Å; V133-T136 PolarHBondContact O-N 3.37Å; V133-T136 PolarHBondContact O-OG1 2.79Å; N134-T136 VanDerWaalsContact C-N 3.28Å; T136-D138 CarbonylContact O-C 3.47Å; T136-D138 PolarHBondContact O-N 2.98Å; T136-D138 VanDerWaalsContact O-N 3.13Å; T136-I139 WeakPolarHBondContact O-CG1 3.28Å; T136-I139 PolarHBondContact O-N 2.87Å
137	N	32.5	Very low	34.5	Very low	82 Å²	82	88.9 Å²	88.9	44%	0.439	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.7	-179.5	-88.9	-42.8	0	0	0	114.3	N134 K135 I139	N134-N137 WeakPolarHBondContact CA-ND2 2.93Å; N134-N137 PolarHBondContact O-ND2 3.46Å; N134-N137 PolarHBondContact OD1-ND2 2.82Å; K135-N137 VanDerWaalsContact C-N 3.34Å; N137-I139 PolarHBondContact O-N 3.45Å
138	D	31.9	Very low	34.1	Very low	112 Å²	112	90 Å²	90	60%	0.599	49%	0.493	S	S	*	.			trans	-92.7	76.3	161.6	-76.9	-35.3	0	0	0	110.1	T136 S140 S141 S142	T136-D138 CarbonylContact O-C 3.47Å; T136-D138 PolarHBondContact O-N 2.98Å; T136-D138 VanDerWaalsContact O-N 3.13Å; D138-S140 PolarHBondContact O-N 3.36Å; D138-S140 VanDerWaalsContact O-N 3.13Å; D138-S141 WeakPolarHBondContact CB-OG 3.35Å; D138-S141 PolarHBondContact O-N 2.92Å; D138-S141 PolarHBondContact O-OG 2.73Å; D138-S142 PolarHBondContact O-N 3.04Å; D138-S142 PolarHBondContact O-OG 2.74Å
139	I	33.1	Very low	33.3	Very low	106 Å²	106	88.8 Å²	88.8	54%	0.544	49%	0.494	S	S	.	.	H	α-helix	trans	-55.9	-31	174	-58.9	176.6	0	0	0	110.6	T136 N137 I143	T136-I139 WeakPolarHBondContact O-CG1 3.28Å; T136-I139 PolarHBondContact O-N 2.87Å; N137-I139 PolarHBondContact O-N 3.45Å; I139-I143 WeakPolarHBondContact O-CD1 3.23Å; I139-I143 WeakPolarHBondContact O-CG1 3.45Å; I139-I143 PolarHBondContact O-N 3.38Å
140	S	31.1	Very low	32.8	Very low	92 Å²	92	91.2 Å²	91.2	64%	0.643	51%	0.507	S	S	*	.	H	α-helix	trans	-71.2	-30	176.8	-164.2	0	0	0	0	114.3	D138	D138-S140 PolarHBondContact O-N 3.36Å; D138-S140 VanDerWaalsContact O-N 3.13Å
141	S	32.7	Very low	32.2	Very low	58 Å²	58	91.7 Å²	91.7	41%	0.406	53%	0.525	S	S	.	.	H	α-helix	trans	-88.7	-26.8	175.6	72.8	0	0	0	0	112.1	D138 I143 D144 L145	D138-S141 WeakPolarHBondContact CB-OG 3.35Å; D138-S141 PolarHBondContact O-N 2.92Å; D138-S141 PolarHBondContact O-OG 2.73Å; S141-I143 VanDerWaalsContact C-N 3.27Å; S141-I143 PolarHBondContact O-N 2.93Å; S141-D144 PolarHBondContact O-N 3.38Å; S141-L145 WeakPolarHBondContact O-CB 3.31Å; S141-L145 PolarHBondContact O-N 2.8Å
142	S	30.9	Very low	31.6	Very low	28 Å²	28	95.9 Å²	95.9	20%	0.196	54%	0.544	C	S	.	.	H	α-helix	trans	-62.3	-33.9	175.5	-56.5	0	0	0	0	112.2	D138 L145 L146	D138-S142 PolarHBondContact O-N 3.04Å; D138-S142 PolarHBondContact O-OG 2.74Å; S142-L145 PolarHBondContact O-N 2.7Å; S142-L146 WeakPolarHBondContact O-CB 3.43Å; S142-L146 VanDerWaalsContact O-CG 3.28Å; S142-L146 WeakPolarHBondContact O-CG 3.11Å; S142-L146 PolarHBondContact O-N 2.85Å
143	I	35.4	Very low	31.1	Very low	85 Å²	85	95.3 Å²	95.3	44%	0.436	55%	0.55	S	S	.	.	H	α-helix	trans	-66	-44.7	174.6	-67.7	163	0	0	0	111.3	I139 S141 L145 L148	I139-I143 WeakPolarHBondContact O-CD1 3.23Å; I139-I143 WeakPolarHBondContact O-CG1 3.45Å; I139-I143 PolarHBondContact O-N 3.38Å; S141-I143 VanDerWaalsContact C-N 3.27Å; S141-I143 PolarHBondContact O-N 2.93Å; I143-L145 VanDerWaalsContact C-N 3.34Å; I143-L148 PolarHBondContact O-N 3.42Å
144	D	31.9	Very low	30.7	Very low	86 Å²	86	100.3 Å²	100.3	46%	0.46	59%	0.586	S	S	.	*	H	α-helix	trans	-67.8	-33.6	176.4	-75.2	-20.2	0	0	0	111.8	S141 G147	S141-D144 PolarHBondContact O-N 3.38Å; D144-G147 PolarHBondContact O-N 2.75Å
145	L	32.3	Very low	30.3	Very low	156 Å²	156	101.5 Å²	101.5	82%	0.817	60%	0.601	S	S	*	*	H	α-helix	trans	-77.2	-27.4	-178.8	-162.3	70	0	0	0	113.6	S141 S142 I143 G147	S141-L145 WeakPolarHBondContact O-CB 3.31Å; S141-L145 PolarHBondContact O-N 2.8Å; S142-L145 PolarHBondContact O-N 2.7Å; I143-L145 VanDerWaalsContact C-N 3.34Å; L145-G147 VanDerWaalsContact C-N 3.27Å; L145-G147 PolarHBondContact O-N 2.73Å
146	L	30.6	Very low	29.9	Very low	130 Å²	130	99.3 Å²	99.3	68%	0.681	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	2.8	174.6	-70.4	170.6	0	0	0	113.5	S142 L148	S142-L146 WeakPolarHBondContact O-CB 3.43Å; S142-L146 VanDerWaalsContact O-CG 3.28Å; S142-L146 WeakPolarHBondContact O-CG 3.11Å; S142-L146 PolarHBondContact O-N 2.85Å; L146-L148 VanDerWaalsContact C-N 3.25Å; L146-L148 HydrophobicContact CB-CD1 4.28Å; L146-L148 HydrophobicContact CB-CG 4.21Å; L146-L148 PolarHBondContact O-N 3.28Å
147	G	27.8	Very low	29.7	Very low	59 Å²	59	102.1 Å²	102.1	61%	0.608	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.5	8.1	177.1	0	0	0	0	0	115.1	D144 L145 S149	D144-G147 PolarHBondContact O-N 2.75Å; L145-G147 VanDerWaalsContact C-N 3.27Å; L145-G147 PolarHBondContact O-N 2.73Å; G147-S149 PolarHBondContact O-N 3.31Å
148	L	32.1	Very low	29.6	Very low	102 Å²	102	103.1 Å²	103.1	53%	0.534	64%	0.643	S	S	.	*			trans	-80.2	47.9	-174.5	-61.2	176.8	0	0	0	113.1	I143 L146 L150	I143-L148 PolarHBondContact O-N 3.42Å; L146-L148 VanDerWaalsContact C-N 3.25Å; L146-L148 HydrophobicContact CB-CD1 4.28Å; L146-L148 HydrophobicContact CB-CG 4.21Å; L146-L148 PolarHBondContact O-N 3.28Å; L148-L150 PolarHBondContact O-N 2.82Å
149	S	24.9	Very low	29.7	Very low	91 Å²	91	103.1 Å²	103.1	64%	0.636	65%	0.651	S	S	*	*			trans	-74	69.2	173.9	-74.7	0	0	0	0	112	G147 S151	G147-S149 PolarHBondContact O-N 3.31Å; S149-S151 VanDerWaalsContact C-N 3.35Å; S149-S151 PolarHBondContact O-N 2.74Å
150	L	28.8	Very low	29.8	Very low	117 Å²	117	103.3 Å²	103.3	61%	0.613	66%	0.662	S	S	*	*			trans	-73.4	87.4	172.2	-77.1	173.6	0	0	0	110.6	L148 L152	L148-L150 PolarHBondContact O-N 2.82Å; L150-L152 VanDerWaalsContact C-N 3.32Å; L150-L152 HydrophobicContact CB-CD1 4.21Å; L150-L152 PolarHBondContact O-N 3.05Å
151	S	23.9	Very low	30.1	Very low	106 Å²	106	104.8 Å²	104.8	74%	0.741	67%	0.669	S	S	*	*			trans	-68.9	85.9	170.6	56.1	0	0	0	0	110.6	S149 S153	S149-S151 VanDerWaalsContact C-N 3.35Å; S149-S151 PolarHBondContact O-N 2.74Å; S151-S153 VanDerWaalsContact C-N 3.32Å; S151-S153 PolarHBondContact O-N 3.23Å
152	L	27.9	Very low	30.4	Very low	157 Å²	157	107.5 Å²	107.5	82%	0.822	69%	0.686	S	S	*	*			trans	-70.3	87.7	172.3	-104.5	69.4	0	0	0	110.7	L150 S154	L150-L152 VanDerWaalsContact C-N 3.32Å; L150-L152 HydrophobicContact CB-CD1 4.21Å; L150-L152 PolarHBondContact O-N 3.05Å; L152-S154 PolarHBondContact O-N 2.89Å
153	S	25.6	Very low	30.6	Very low	98 Å²	98	114 Å²	114	69%	0.685	72%	0.717	S	S	*	*			trans	-54	125.8	167	-59	0	0	0	0	110.4	S151 S155	S151-S153 VanDerWaalsContact C-N 3.32Å; S151-S153 PolarHBondContact O-N 3.23Å; S153-S155 PolarHBondContact O-N 3.43Å
154	S	24.7	Very low	30.7	Very low	129 Å²	129	114.7 Å²	114.7	90%	0.902	73%	0.73	S	S	*	*			trans	-74.7	94.4	178.2	55.9	0	0	0	0	111.2	L152	L152-S154 PolarHBondContact O-N 2.89Å
155	S	28.6	Very low	31	Very low	109 Å²	109	115.5 Å²	115.5	76%	0.762	74%	0.742	S	S	*	*			trans	-112.7	105.3	173.9	44	0	0	0	0	111.3	S153	S153-S155 PolarHBondContact O-N 3.43Å
156	S	27	Very low	31.3	Very low	125 Å²	125	113.3 Å²	113.3	87%	0.874	74%	0.74	S	S	*	*			trans	-87.1	121.5	173.8	53.1	0	0	0	0	111.5
157	S	30.1	Very low	31.8	Very low	117 Å²	117	112.4 Å²	112.4	82%	0.818	75%	0.745	S	S	*	*			trans	-151.9	159.6	167.2	73.7	0	0	0	0	108.1
158	S	30.6	Very low	32.3	Very low	103 Å²	103	115.3 Å²	115.3	72%	0.72	75%	0.752	S	S	*	*			cis	-153.9	-167.7	10.9	60.9	0	0	0	0	111
159	S	33.6	Very low	32.6	Very low	111 Å²	111	118.5 Å²	118.5	78%	0.776	77%	0.769	S	S	*	*			trans	73.6	140	-177.6	80.1	0	0	0	0	114.8
160	S	35.8	Very low	33.2	Very low	111 Å²	111	118.6 Å²	118.6	78%	0.776	77%	0.77	S	S	*	*			cis	-135.8	170.3	11.2	-73.8	0	0	0	0	112.3
161	P	36.8	Very low	33.7	Very low	122 Å²	122	118.1 Å²	118.1	79%	0.792	78%	0.777	S	S	*	*			trans	-113.7	-150.3	-151.1	42.5	-29.6	0	0	0	115.5
162	P	38.1	Very low	34.4	Very low	115 Å²	115	118 Å²	118	75%	0.747	78%	0.776	S	S	*	*				-130.1	179.6	-101.1	42	-24.5	0	0	0	115.5
163	L	35.7	Very low	34.8	Very low	165 Å²	165	118.2 Å²	118.2	86%	0.864	78%	0.777	S	S	*	*			trans	-170.9	155.3	148.3	-107.8	160.9	0	0	0	114.8
164	S	37.5	Very low	35.3	Very low	99 Å²	99	118 Å²	118	69%	0.692	78%	0.775	S	S	*	*			trans	60.5	110.9	156.8	53.7	0	0	0	0	123.8
165	S	38	Very low	36	Very low	103 Å²	103	117.5 Å²	117.5	72%	0.72	77%	0.772	S	S	*	*				76	124.8	127.1	62.3	0	0	0	0	125
166	S	39.5	Very low	36.5	Very low	110 Å²	110	118.1 Å²	118.1	77%	0.769	77%	0.773	S	S	*	*			trans	61.5	140.5	144.4	53.6	0	0	0	0	120.8
167	S	41.3	Very low	37.4	Very low	112 Å²	112	117.7 Å²	117.7	78%	0.783	77%	0.768	S	S	*	*			cis	-163.6	162.8	-10	35.6	0	0	0	0	110.4
168	P	37.3	Very low	37.5	Very low	119 Å²	119	117.2 Å²	117.2	77%	0.773	76%	0.764	S	S	*	*			trans	-106.4	-169.7	-163.8	42.2	-37.3	0	0	0	115.9
169	L	38.1	Very low	37.6	Very low	169 Å²	169	118 Å²	118	89%	0.885	77%	0.77	S	S	*	*			trans	113	140.1	175.6	-66	164.7	0	0	0	112.6
170	S	38.8	Very low	37.6	Very low	94 Å²	94	117.5 Å²	117.5	66%	0.657	77%	0.766	S	S	*	*			cis	-163.6	155.8	-2.4	47.1	0	0	0	0	112.3
171	S	39.1	Very low	37.4	Very low	107 Å²	107	120 Å²	120	75%	0.748	77%	0.768	S	S	*	*			trans	47.9	143.1	148.2	55.5	0	0	0	0	121.7
172	S	37.7	Very low	37	Very low	104 Å²	104	120 Å²	120	73%	0.727	77%	0.766	S	S	*	*			cis	-171.9	167.6	1.5	43	0	0	0	0	112.3
173	L	36	Very low	36.7	Very low	161 Å²	161	119 Å²	119	84%	0.843	76%	0.761	S	S	*	*			trans	4.4	152.4	146.8	-75.9	76.3	0	0	0	120.4
174	S	36.8	Very low	36.5	Very low	93 Å²	93	116.5 Å²	116.5	65%	0.65	76%	0.758	S	S	*	*			cis	-176.1	152.3	0	46.5	0	0	0	0	113.8
175	S	39.1	Very low	36.2	Very low	118 Å²	118	116.1 Å²	116.1	83%	0.825	76%	0.755	S	S	*	*			trans	55.6	152.5	144.8	-53.5	0	0	0	0	124
176	P	39.7	Very low	35.9	Very low	122 Å²	122	118.2 Å²	118.2	79%	0.792	76%	0.758	S	S	*	*			trans	-126.5	-143.5	-172.1	33.1	-6.9	0	0	0	113.4
177	P	45.5	Very low	35.4	Very low	117 Å²	117	119.1 Å²	119.1	76%	0.76	75%	0.753	S	S	*	*				-130.4	170.5	-85.3	41	-25.9	0	0	0	115.9
178	S	32.1	Very low	35	Very low	107 Å²	107	120.3 Å²	120.3	75%	0.748	75%	0.749	S	S	*	*			trans	-164	139.2	164.9	54.3	0	0	0	0	117.5
179	S	33	Very low	34.6	Very low	120 Å²	120	121 Å²	121	84%	0.839	75%	0.746	S	S	*	*			trans	61	165	161.1	71.6	0	0	0	0	118.3
180	S	33.3	Very low	34.3	Very low	100 Å²	100	120.5 Å²	120.5	70%	0.699	74%	0.744	S	S	*	*			cis	-150.1	137.4	6	54.8	0	0	0	0	111.5
181	M	31.8	Very low	33.9	Very low	164 Å²	164	123.9 Å²	123.9	81%	0.808	75%	0.749	S	S	*	*				70.6	126.3	111.1	-60	-154.6	82.4	0	0	122
182	T	29.8	Very low	33.5	Very low	122 Å²	122	127.5 Å²	127.5	75%	0.748	75%	0.751	S	S	*	*			trans	66.1	159.3	147.3	56.4	0	0	0	0	118.6
183	S	30.6	Very low	32.9	Very low	94 Å²	94	128 Å²	128	66%	0.657	75%	0.746	S	S	*	*			cis	-152.2	161.1	14.4	-42.8	0	0	0	0	113.1
184	S	32.6	Very low	32.5	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	74%	0.741	S	S	*	*			trans	64.7	160	145.7	-55.7	0	0	0	0	121.1
185	S	30.5	Very low	32.1	Very low	91 Å²	91	131 Å²	131	64%	0.636	74%	0.741	S	S	*	*			cis	-171.6	171.5	-27.8	-87.8	0	0	0	0	109.8
186	N	31.2	Very low	31.5	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	74%	0.741	S	S	*	*			trans	75.1	150.4	157.8	-61.6	-13.5	0	0	0	117.4
187	I	30.3	Very low	30.9	Very low	130 Å²	130	132.4 Å²	132.4	67%	0.667	73%	0.734	S	S	*	*			cis	-164.3	146.7	-3.7	-118.4	170.4	0	0	0	111.3
188	I	31.9	Very low	30	Very low	137 Å²	137	134.9 Å²	134.9	70%	0.703	74%	0.735	S	S	*	*			trans	45.6	144.1	140.1	-64.5	170.9	0	0	0	120.4
189	D	29.2	Very low	29.8	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	73%	0.729	S	S	*	*			cis	-176.6	-170.4	-21.3	-122.6	-57	0	0	0	110.4
190	L	32	Very low	29.5	Very low	158 Å²	158	137.2 Å²	137.2	83%	0.827	72%	0.724	S	S	*	*			trans	71.6	122.4	168.1	-56.2	167.6	0	0	0	116.6
191	Q	29.1	Very low	29.1	Very low	165 Å²	165	136.4 Å²	136.4	77%	0.771	72%	0.718	S	S	*	*			cis	71.9	107.1	31.9	-69.7	-152	20.5	0	0	118.8
192	K	30.5	Very low	29	Very low	183 Å²	183	136.3 Å²	136.3	80%	0.796	72%	0.719	S	S	*	*				178.4	130.5	112	-96.6	177.2	179	174.4	0	110.3
193	N	27.1	Very low	29.1	Very low	115 Å²	115	135.9 Å²	135.9	62%	0.615	72%	0.718	S	S	*	*				66	142.1	85.8	-87.1	-15.9	0	0	0	114.7
194	R	26.4	Very low	28.9	Very low	195 Å²	195	136.7 Å²	136.7	74%	0.736	72%	0.724	S	S	*	*			cis	-175.7	176.6	-13.9	-150	-178	172.8	116.5	-10.9	110
195	N	28.4	Very low	28.6	Very low	121 Å²	121	136.1 Å²	136.1	65%	0.647	72%	0.72	S	S	*	*			trans	76	137.1	165.4	-45.7	-20.2	0	0	0	114.1
196	E	26.9	Very low	28.5	Very low	178 Å²	178	138 Å²	138	83%	0.832	72%	0.723	S	S	*	*			cis	70.3	139.4	37.3	-52.3	-176.2	149.7	0	0	111.8
197	S	27.8	Very low	28.2	Very low	91 Å²	91	138.9 Å²	138.9	64%	0.636	72%	0.722	S	S	*	*			cis	-169.4	154.1	37.6	58.9	0	0	0	0	115
198	Q	26.7	Very low	28.1	Very low	170 Å²	170	142.6 Å²	142.6	79%	0.794	73%	0.729	S	S	*	*			trans	67.6	159.9	147.5	-66.6	176.2	22	0	0	119
199	L	26.1	Very low	27.7	Very low	118 Å²	118	141.8 Å²	141.8	62%	0.618	73%	0.725	S	S	*	*			cis	-160.6	172.7	-14	-116	171.3	0	0	0	112.1
200	H	28.2	Very low	27.8	Very low	158 Å²	158	142.2 Å²	142.2	73%	0.731	72%	0.724	S	S	*	*			trans	68.6	157.1	158.1	-66	-33.3	0	0	0	120.3
201	S	25.2	Very low	27.3	Very low	83 Å²	83	141.2 Å²	141.2	58%	0.58	72%	0.72	S	S	*	*			cis	-170.2	131.1	-31.9	-97.4	0	0	0	0	112.3
202	I	27.8	Very low	27.4	Very low	162 Å²	162	143.2 Å²	143.2	83%	0.831	72%	0.722	S	S	*	*			trans	70.7	149.1	142.6	-65	173.5	0	0	0	118.8
203	P	33.2	Very low	27.1	Very low	112 Å²	112	139.5 Å²	139.5	73%	0.727	72%	0.719	S	S	*	*			trans	-123.8	-179.7	-163.5	43.6	-29.7	0	0	0	115.7
204	S	25.9	Very low	26.9	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	72%	0.722	S	S	*	*			trans	-168.7	147.6	148.7	-88.3	0	0	0	0	116.9
205	S	25.6	Very low	27	Very low	101 Å²	101	140.3 Å²	140.3	71%	0.706	73%	0.729	S	S	*	*			trans	61.9	167.3	143.4	68.2	0	0	0	0	123.5
206	N	29.4	Very low	26.8	Very low	131 Å²	131	141.4 Å²	141.4	70%	0.701	73%	0.73	S	S	*	*			trans	71.7	100.8	175.3	-49.1	-9.5	0	0	0	113.9
207	H	24.8	Very low	26.8	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.755	73%	0.732	S	S	*	*			cis	65.1	92.9	27.5	-144	89.4	0	0	0	113.4
208	Y	27.8	Very low	26.9	Very low	209 Å²	209	144 Å²	144	82%	0.82	73%	0.733	S	S	*	*			trans	-140.5	117.4	165	-100.7	-79.9	0	0	0	110
209	I	24.7	Very low	26.8	Very low	119 Å²	119	144.9 Å²	144.9	61%	0.61	74%	0.735	S	S	*	*			trans	-94	136.5	165.6	-64.4	169.7	0	0	0	106.6
210	M	29.4	Very low	26.8	Very low	143 Å²	143	146.4 Å²	146.4	70%	0.704	75%	0.749	S	S	*	*			trans	-133.9	95.4	165.8	-81.7	-64.2	-116.6	0	0	109.6	Y212	M210-Y212 HydrophobicContact CE-CE2 3.9Å; M210-Y212 HydrophobicContact SD-CE2 4.4Å
211	N	23.3	Very low	26.6	Very low	137 Å²	137	144.6 Å²	144.6	73%	0.733	75%	0.749	S	S	*	*			trans	-76.6	138.4	159.3	-75	-23.6	0	0	0	108.3
212	Y	29.6	Very low	26.8	Very low	208 Å²	208	149 Å²	149	82%	0.816	76%	0.761	S	S	*	*			trans	-128.4	138.4	154.7	-95.5	-81.5	0	0	0	109.2	M210	M210-Y212 HydrophobicContact CE-CE2 3.9Å; M210-Y212 HydrophobicContact SD-CE2 4.4Å
213	S	24.6	Very low	26.5	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	75%	0.753	S	S	*	*			trans	-97.5	153.4	-158.9	-56.5	0	0	0	0	113.6
214	M	23.8	Very low	26.2	Very low	140 Å²	140	148.2 Å²	148.2	69%	0.69	76%	0.756	S	S	*	*			trans	30.4	115.7	137.6	-71	-84.5	-73.7	0	0	118.8	Q216	M214-Q216 HydrophobicContact CE-CG 3.98Å; M214-Q216 HydrophobicContact SD-CG 4.12Å
215	E	27.9	Very low	26.1	Very low	187 Å²	187	147.9 Å²	147.9	87%	0.874	75%	0.754	S	S	*	*				-127	140.4	127	-75	-162.4	125.3	0	0	109.5
216	Q	24.2	Very low	25.9	Very low	144 Å²	144	150.4 Å²	150.4	67%	0.673	76%	0.758	S	S	*	*			trans	-127.9	137	170.2	-66.9	-176.7	4.3	0	0	108.2	M214	M214-Q216 HydrophobicContact CE-CG 3.98Å; M214-Q216 HydrophobicContact SD-CG 4.12Å
217	Y	26.3	Very low	25.7	Very low	220 Å²	220	153 Å²	153	86%	0.863	77%	0.765	S	S	*	*			trans	-140.1	147.4	154.3	-86.9	-77.1	0	0	0	111
218	P	29.5	Very low	25.7	Very low	103 Å²	103	151.5 Å²	151.5	67%	0.669	76%	0.762	S	S	*	*			trans	-127.3	165.6	-155.3	41.2	-26	0	0	0	116.4
219	K	25.8	Very low	25.9	Very low	189 Å²	189	147 Å²	147	82%	0.822	76%	0.758	S	S	*	*			trans	48.7	126.3	147.7	-68.3	172.6	-179.9	178.4	0	119.9
220	T	26.1	Very low	25.9	Very low	150 Å²	150	148.9 Å²	148.9	92%	0.92	77%	0.768	S	S	*	*				-150.2	161.6	120	-8.5	0	0	0	0	110.5
221	T	24.7	Very low	25.7	Very low	120 Å²	120	149.7 Å²	149.7	74%	0.736	77%	0.772	S	S	*	*			trans	-122.7	160.1	-166	-39.7	0	0	0	0	110.3
222	Q	27.7	Very low	25.9	Very low	176 Å²	176	150.6 Å²	150.6	82%	0.822	78%	0.776	S	S	*	*			trans	154.4	159.9	147	-74.1	-112.1	25.6	0	0	108.4
223	L	21.7	Very low	25.7	Very low	127 Å²	127	147.3 Å²	147.3	67%	0.665	77%	0.773	S	S	*	*				-173.7	155.9	-51.2	-118.9	167.6	0	0	0	106.1
224	T	26.5	Very low	25.8	Very low	131 Å²	131	150.8 Å²	150.8	80%	0.804	78%	0.783	S	S	*	*			trans	59.3	163.4	172.9	72	0	0	0	0	117.9
225	S	24.2	Very low	25.9	Very low	104 Å²	104	148.3 Å²	148.3	73%	0.727	78%	0.779	S	S	*	*			cis	-159.7	144.6	-38.8	51.6	0	0	0	0	112.4
226	I	22.5	Very low	25.8	Very low	154 Å²	154	151.1 Å²	151.1	79%	0.79	78%	0.783	S	S	*	*			trans	-3.7	128	162	-56.2	157.4	0	0	0	119.2	I228	I226-I228 HydrophobicContact CG2-CG1 4.4Å
227	H	24.4	Very low	25.8	Very low	184 Å²	184	150.7 Å²	150.7	85%	0.852	79%	0.786	S	S	*	*			trans	-151.8	156.8	133.2	-154.4	-87.6	0	0	0	110.8
228	I	24.4	Very low	26	Very low	133 Å²	133	148 Å²	148	68%	0.682	78%	0.784	S	S	*	*			trans	-129.4	-169.8	-177.1	-13.7	179.9	0	0	0	111.1	I226	I226-I228 HydrophobicContact CG2-CG1 4.4Å
229	P	32.1	Very low	25.8	Very low	114 Å²	114	147.5 Å²	147.5	74%	0.74	78%	0.784	S	S	*	*				-120.9	171.6	-128.9	42.2	-25.1	0	0	0	116.1
230	I	25.7	Very low	26	Very low	159 Å²	159	143.1 Å²	143.1	82%	0.815	78%	0.782	S	S	*	*			trans	-137	128.6	167.7	-64.5	-175.4	0	0	0	112.2
231	M	24.2	Very low	26	Very low	159 Å²	159	145.3 Å²	145.3	78%	0.783	78%	0.782	S	S	*	*			trans	15	140.3	151.1	-58.8	172.2	167.8	0	0	122.3
232	N	28.5	Very low	26.2	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	78%	0.783	S	S	*	*				-163.8	152.9	97.1	-103.9	9.8	0	0	0	113.2
233	D	24.8	Very low	26.2	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	78%	0.782	S	S	*	*			trans	-81.4	165.6	-171.1	-57.4	-90.6	0	0	0	115.4
234	L	27.4	Very low	26.3	Very low	178 Å²	178	142.1 Å²	142.1	93%	0.932	79%	0.787	S	S	*	*				-157.1	137.6	123.3	-108.4	163.4	0	0	0	110.7
235	S	24.3	Very low	26.5	Very low	88 Å²	88	144.7 Å²	144.7	62%	0.615	79%	0.792	S	S	*	*			trans	-105.5	161.8	-166.2	57.8	0	0	0	0	113.4
236	Y	27.6	Very low	26.6	Very low	245 Å²	245	146.6 Å²	146.6	96%	0.961	79%	0.794	S	S	*	*			trans	-143.6	148.6	140.5	-102.4	-76.9	0	0	0	109.3
237	N	24	Very low	26.9	Very low	136 Å²	136	145 Å²	145	73%	0.727	79%	0.787	S	S	*	*			trans	-129.3	157.6	-157.9	-162.1	-3.7	0	0	0	111.3
238	I	29	Very low	27.2	Very low	162 Å²	162	142.6 Å²	142.6	83%	0.831	78%	0.78	S	S	*	*			trans	164	135.8	161.8	-90.4	150.9	0	0	0	108.1
239	S	25.5	Very low	27.2	Very low	94 Å²	94	142.2 Å²	142.2	66%	0.657	78%	0.78	S	S	*	*			cis	176	112.2	-49.9	47.6	0	0	0	0	109.3
240	A	31.3	Very low	27.2	Very low	96 Å²	96	147 Å²	147	79%	0.793	78%	0.784	S	S	*	*			trans	159.1	96.2	162.9	0	0	0	0	0	107.8
241	Q	26.3	Very low	27.3	Very low	197 Å²	197	145.4 Å²	145.4	92%	0.921	78%	0.777	S	S	*	*				58.7	101.4	63.4	-69.5	-171.4	-30	0	0	116.1
242	S	28	Very low	27.5	Very low	107 Å²	107	145.1 Å²	145.1	75%	0.748	78%	0.777	S	S	*	*				-172.5	123.4	117.6	58.8	0	0	0	0	113.1
243	I	27.1	Very low	27.4	Very low	158 Å²	158	145.3 Å²	145.3	81%	0.81	77%	0.773	S	S	*	*			trans	46.7	113.2	142.3	-49.1	165.5	0	0	0	117.5
244	A	25.7	Very low	27.8	Very low	91 Å²	91	143.9 Å²	143.9	75%	0.752	77%	0.771	S	S	*	*			cis	88.7	88.1	25.4	0	0	0	0	0	117.6
245	M	29	Very low	27.7	Very low	185 Å²	185	142.3 Å²	142.3	91%	0.911	76%	0.763	S	S	*	*			trans	-154.5	118.7	142.9	-65.8	-163	-170.1	0	0	105.4
246	N	26.2	Very low	27.8	Very low	143 Å²	143	142.8 Å²	142.8	77%	0.765	77%	0.766	S	S	*	*			cis	80.2	93.2	35.7	-145.5	69.7	0	0	0	114.1
247	N	30.2	Very low	27.8	Very low	122 Å²	122	137.4 Å²	137.4	65%	0.652	75%	0.753	S	S	*	*				173	134.5	122.1	-84.8	-10	0	0	0	111.9
248	N	29.7	Very low	27.9	Very low	133 Å²	133	136.3 Å²	136.3	71%	0.711	75%	0.747	S	S	*	*			trans	47.6	143.4	133.2	-52.7	10.7	0	0	0	119.7
249	D	25.8	Very low	27.8	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	74%	0.742	S	S	*	*			cis	168.5	-177.3	-15.5	-128.1	-50.6	0	0	0	104.5
250	Y	31.1	Very low	27.8	Very low	213 Å²	213	140.9 Å²	140.9	84%	0.835	75%	0.752	S	S	*	*			trans	76.2	140.2	175.1	-51.9	-80.8	0	0	0	117.5
251	N	26.9	Very low	27.6	Very low	126 Å²	126	140.1 Å²	140.1	67%	0.674	75%	0.746	S	S	*	*			cis	173.6	168.7	-35.4	-115.2	-51.3	0	0	0	107.3
252	I	30.1	Very low	27.7	Very low	153 Å²	153	138.1 Å²	138.1	79%	0.785	74%	0.742	S	S	*	*			trans	78.3	84.4	163.6	-58.2	140.8	0	0	0	117.5
253	H	26.6	Very low	27.8	Very low	160 Å²	160	138 Å²	138	74%	0.741	74%	0.739	S	S	*	*				57.9	130.9	112.7	-127.9	-79.5	0	0	0	123
254	P	33	Very low	27.8	Very low	109 Å²	109	137.7 Å²	137.7	71%	0.708	74%	0.735	S	S	*	*			trans	-95	171.4	164	39.3	-35.7	0	0	0	113.2
255	L	25.5	Very low	27.9	Very low	146 Å²	146	138.9 Å²	138.9	76%	0.764	73%	0.728	S	S	*	*			trans	175.7	147.3	148.1	-99.8	160.4	0	0	0	113
256	C	26.2	Very low	28.1	Very low	98 Å²	98	138.5 Å²	138.5	66%	0.662	72%	0.724	S	S	*	*			trans	62.4	160.5	151.9	-69.5	0	0	0	0	120.3
257	N	26.3	Very low	28.2	Very low	131 Å²	131	137.2 Å²	137.2	70%	0.701	72%	0.717	S	S	*	*			cis	-161.7	158.9	-21.7	-109.9	8.1	0	0	0	111.4
258	N	25.6	Very low	28.2	Very low	113 Å²	113	140.7 Å²	140.7	60%	0.604	73%	0.727	S	S	*	*			trans	52.7	133.2	141.1	-75	26.5	0	0	0	126
259	E	27.3	Very low	28.2	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	72%	0.724	S	S	*	*				82.5	107.9	125.2	-67.1	171.4	137.9	0	0	124
260	F	25.4	Very low	28.4	Very low	199 Å²	199	140 Å²	140	87%	0.873	73%	0.727	S	S	*	*				69.9	141.2	124.1	-90	-96.6	0	0	0	124.9
261	A	28.6	Very low	28.3	Very low	80 Å²	80	135.6 Å²	135.6	66%	0.661	72%	0.718	S	S	*	*			trans	96.3	106.6	138.7	0	0	0	0	0	122.8
262	N	26.6	Very low	28.5	Very low	156 Å²	156	137.3 Å²	137.3	83%	0.834	72%	0.722	S	S	*	*				80.8	160.6	126.5	-85.2	11	0	0	0	124.5
263	C	30	Very low	28.3	Very low	103 Å²	103	134 Å²	134	70%	0.696	71%	0.713	S	S	*	*			trans	78.3	142.4	166.2	-60.9	0	0	0	0	118.6
264	Q	28.5	Very low	28.3	Very low	153 Å²	153	133.3 Å²	133.3	72%	0.715	71%	0.713	S	S	*	*			cis	-166	157.2	-33.3	-123.4	174	-80.5	0	0	110.6
265	D	26.8	Very low	28.1	Very low	115 Å²	115	136.3 Å²	136.3	62%	0.615	72%	0.715	S	S	*	*			trans	32	132	150.8	-46.6	-25.3	0	0	0	123.2
266	H	33.3	Very low	28.2	Very low	178 Å²	178	134.8 Å²	134.8	82%	0.824	71%	0.708	S	S	*	*				-172.4	178.4	110.1	-102.1	-46	0	0	0	114.9
267	D	28.3	Very low	28.4	Very low	116 Å²	116	137.9 Å²	137.9	62%	0.62	71%	0.712	S	S	*	*			trans	-120	-176.7	-142	-63.8	-87.4	0	0	0	117.8
268	F	31.1	Very low	28.7	Very low	195 Å²	195	137.4 Å²	137.4	86%	0.855	72%	0.716	S	S	*	*			trans	84.7	146	160.3	-59.3	-85.8	0	0	0	119.4
269	S	28.4	Very low	28.8	Very low	94 Å²	94	139.7 Å²	139.7	66%	0.657	73%	0.727	S	S	*	*			cis	-173.4	-177.6	-26	-162.3	0	0	0	0	112.1
270	M	31.7	Very low	28.8	Very low	149 Å²	149	140 Å²	140	73%	0.734	73%	0.728	S	S	*	*			trans	81.9	85.1	155.9	-65.9	-65.6	-174.9	0	0	122
271	N	28.2	Very low	28.8	Very low	120 Å²	120	136.3 Å²	136.3	64%	0.642	72%	0.717	S	S	*	*				71.3	142.6	106.6	-77.5	-2.2	0	0	0	126
272	H	31.1	Very low	28.7	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.755	72%	0.719	S	S	*	*			trans	73.5	145.8	144.4	-76.1	-40.7	0	0	0	120.7
273	S	26.5	Very low	28.6	Very low	84 Å²	84	140.6 Å²	140.6	59%	0.587	72%	0.718	S	S	*	*			cis	-166.6	140.4	-20.4	-135.3	0	0	0	0	113.1
274	L	26.6	Very low	28.5	Very low	145 Å²	145	144.6 Å²	144.6	76%	0.759	72%	0.724	S	S	*	*			trans	56.3	143.6	136.6	-93.3	169.5	0	0	0	123.9
275	K	28.2	Very low	28.3	Very low	171 Å²	171	142.9 Å²	142.9	74%	0.743	72%	0.72	S	S	*	*			trans	80	147.5	155.2	-66.3	-178.3	162.3	-170.5	0	119.2
276	D	28	Very low	28.3	Very low	114 Å²	114	147.2 Å²	147.2	61%	0.61	73%	0.734	S	S	*	*			cis	-157.6	176.6	-9.9	-111.1	-26.7	0	0	0	111.8
277	H	29.9	Very low	27.9	Very low	164 Å²	164	144 Å²	144	76%	0.759	73%	0.731	S	S	*	*			trans	79.9	102.9	162.8	-57.6	-61.9	0	0	0	121.8
278	P	32.6	Very low	27.7	Very low	120 Å²	120	149.3 Å²	149.3	78%	0.779	74%	0.742	S	S	*	*			trans	-95.3	156.9	142.6	37	-31	0	0	0	111.7
279	I	28.8	Very low	27.4	Very low	161 Å²	161	148.5 Å²	148.5	83%	0.826	75%	0.745	S	S	*	*			trans	-163.2	142.3	157.3	-109.1	150.8	0	0	0	112.5
280	H	26.4	Very low	27.3	Very low	160 Å²	160	151 Å²	151	74%	0.741	75%	0.746	S	S	*	*			trans	-10.2	149.2	158	-86.2	-107.7	0	0	0	118.7
281	N	25	Very low	27	Very low	122 Å²	122	151.9 Å²	151.9	65%	0.652	75%	0.746	S	S	*	*				-170.1	170.8	51.2	-128.6	-17.7	0	0	0	115.9
282	H	27.1	Very low	26.8	Very low	151 Å²	151	153.3 Å²	153.3	70%	0.699	76%	0.759	S	S	*	*			trans	57.8	77.3	159.2	-75	-62.2	0	0	0	121.2
283	E	24.3	Very low	26.5	Very low	175 Å²	175	152.8 Å²	152.8	82%	0.818	76%	0.762	S	S	*	*				2.3	115.8	107.1	179.2	179.2	-142.9	0	0	116.9
284	F	27.7	Very low	26.5	Very low	186 Å²	186	152.9 Å²	152.9	82%	0.816	76%	0.762	S	S	*	*			trans	-154.7	109.9	142	-139.8	-107	0	0	0	114.6
285	N	25.4	Very low	26.6	Very low	118 Å²	118	153.7 Å²	153.7	63%	0.631	77%	0.766	S	S	*	*			trans	51.7	121.6	150.7	-76	-63.1	0	0	0	123.5	S287	N285-S287 PolarHBondContact O-N 2.83Å
286	K	26.1	Very low	26.5	Very low	206 Å²	206	150 Å²	150	90%	0.896	76%	0.755	S	S	*	*			trans	-49	122.8	154.5	-58.5	159.9	179.5	167.5	0	111.5
287	S	24.7	Very low	26.7	Very low	111 Å²	111	148.7 Å²	148.7	78%	0.776	75%	0.748	S	S	*	*			trans	172.2	89	142.6	42.7	0	0	0	0	114.7	N285	N285-S287 PolarHBondContact O-N 2.83Å
288	R	24.7	Very low	27	Very low	227 Å²	227	149 Å²	149	86%	0.857	75%	0.747	S	S	*	*			trans	-149.5	55	158.5	-155	162.4	-70.3	-179.4	0.4	115.4	Q290	R288-Q290 HydrophobicContact CG-CB 4.46Å; R288-Q290 PolarHBondContact O-N 3.29Å; R288-Q290 VanDerWaalsContact O-N 3.11Å
289	I	25.1	Very low	27.3	Very low	177 Å²	177	151.9 Å²	151.9	91%	0.908	75%	0.749	S	S	*	*			trans	-75.5	86.6	150	-59.6	176.8	0	0	0	106.9
290	Q	25.2	Very low	27.3	Very low	147 Å²	147	149.7 Å²	149.7	69%	0.687	74%	0.739	S	S	*	*			trans	-143.6	120.8	167.3	-71.9	-157.8	24.1	0	0	111.9	R288	R288-Q290 HydrophobicContact CG-CB 4.46Å; R288-Q290 PolarHBondContact O-N 3.29Å; R288-Q290 VanDerWaalsContact O-N 3.11Å
291	K	24.7	Very low	27.6	Very low	167 Å²	167	151 Å²	151	73%	0.726	74%	0.742	S	S	*	*			trans	44.4	102.9	149.5	-58.9	170.5	-177.2	168.5	0	117.7	N293	K291-N293 VanDerWaalsContact C-N 3.27Å; K291-N293 HydrophobicContact CB-CB 4.24Å; K291-N293 HydrophobicContact CG-CB 4.4Å
292	V	25.2	Very low	28.3	Very low	150 Å²	150	149.5 Å²	149.5	91%	0.909	74%	0.741	S	S	*	*			trans	-99.6	58.4	136.1	-169.6	0	0	0	0	108.2
293	N	25.5	Very low	28.8	Very low	152 Å²	152	147.1 Å²	147.1	81%	0.813	74%	0.739	S	S	*	*			trans	-109.4	49.4	-179.1	-132.8	17.3	0	0	0	109.7	K291	K291-N293 VanDerWaalsContact C-N 3.27Å; K291-N293 HydrophobicContact CB-CB 4.24Å; K291-N293 HydrophobicContact CG-CB 4.4Å
294	S	25	Very low	29.4	Very low	86 Å²	86	141.7 Å²	141.7	60%	0.601	72%	0.724	S	S	*	*			trans	-166.7	74.6	-176.7	53.3	0	0	0	0	112.2	D296	S294-D296 PolarHBondContact O-N 2.79Å
295	L	29.1	Very low	30.1	Very low	162 Å²	162	137.5 Å²	137.5	85%	0.848	71%	0.706	S	S	*	*			trans	-79.5	102.4	154	-103.7	166.9	0	0	0	107.3	L297	L295-L297 VanDerWaalsContact C-N 3.34Å; L295-L297 HydrophobicContact CB-CD1 4.38Å; L295-L297 PolarHBondContact O-N 3.38Å
296	D	26.4	Very low	31.1	Very low	94 Å²	94	139.9 Å²	139.9	50%	0.503	71%	0.71	S	S	.	*			trans	-78.3	77	-163.8	-129.7	-30.5	0	0	0	112.6	S294 K298	S294-D296 PolarHBondContact O-N 2.79Å; D296-K298 PolarHBondContact O-N 2.95Å; D296-K298 WeakPolarHBondContact OD1-CD 3.33Å; D296-K298 WeakPolarHBondContact OD1-CE 3.23Å; D296-K298 VanDerWaalsContact OD1-CG 3.24Å; D296-K298 WeakPolarHBondContact OD1-CG 3.14Å; D296-K298 IonicContact OD1-NZ 2.99Å; D296-K298 PolarHBondContact OD1-NZ 2.76Å; D296-K298 IonicContact OD2-NZ 3.98Å; D296-K298 PolarHBondContact OD2-NZ 2.96Å
297	L	32.9	Very low	32.2	Very low	87 Å²	87	133.8 Å²	133.8	46%	0.455	69%	0.691	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.1	38.8	176.3	-96.3	82.9	0	0	0	113.6	L295 L300 K305	L295-L297 VanDerWaalsContact C-N 3.34Å; L295-L297 HydrophobicContact CB-CD1 4.38Å; L295-L297 PolarHBondContact O-N 3.38Å; L297-L300 HydrophobicContact CD2-CD1 4.1Å; L297-L300 HydrophobicContact CG-CD1 4.15Å; L297-K305 PolarHBondContact O-NZ 3.04Å
298	K	34.5	Very low	32.9	Very low	170 Å²	170	133.2 Å²	133.2	74%	0.739	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-14.3	172.3	-69.3	178.4	-168.7	126.7	0	113.4	D296	D296-K298 PolarHBondContact O-N 2.95Å; D296-K298 WeakPolarHBondContact OD1-CD 3.33Å; D296-K298 WeakPolarHBondContact OD1-CE 3.23Å; D296-K298 VanDerWaalsContact OD1-CG 3.24Å; D296-K298 WeakPolarHBondContact OD1-CG 3.14Å; D296-K298 IonicContact OD1-NZ 2.99Å; D296-K298 PolarHBondContact OD1-NZ 2.76Å; D296-K298 IonicContact OD2-NZ 3.98Å; D296-K298 PolarHBondContact OD2-NZ 2.96Å
299	H	39.1	Very low	34	Very low	181 Å²	181	126.1 Å²	126.1	84%	0.838	66%	0.657	S	S	*	*	S	Bend	trans	-104.5	-3.9	-174.7	-126.2	-93.8	0	0	0	116.1	K301	H299-K301 PolarHBondContact O-N 3.39Å
300	L	29.9	Very low	34.9	Very low	115 Å²	115	122.2 Å²	122.2	60%	0.602	64%	0.638	S	S	*	*			trans	-87.4	95.3	179.8	-92.2	162.4	0	0	0	112.2	L297	L297-L300 HydrophobicContact CD2-CD1 4.1Å; L297-L300 HydrophobicContact CG-CD1 4.15Å
301	K	32.3	Very low	35.8	Very low	188 Å²	188	119.1 Å²	119.1	82%	0.817	63%	0.625	S	S	*	*			trans	-71.5	170.6	161.4	-67.1	178.7	178	176.6	0	110.6	H299	H299-K301 PolarHBondContact O-N 3.39Å
302	S	38.9	Very low	36.5	Very low	90 Å²	90	116 Å²	116	63%	0.629	61%	0.614	S	S	*	*	S	Bend	trans	80.1	164	173	90.2	0	0	0	0	117.4	A304	S302-A304 VanDerWaalsContact C-N 3.32Å; S302-A304 PolarHBondContact O-N 3.37Å
303	P	38.9	Very low	37.2	Very low	100 Å²	100	116 Å²	116	65%	0.649	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-20	-165.8	-26.9	36.7	0	0	0	117.6	K305 K306 T307	P303-K305 PolarHBondContact O-N 3.19Å; P303-K306 PolarHBondContact O-N 3.04Å; P303-T307 PolarHBondContact O-N 2.86Å
304	A	36.6	Very low	38.1	Very low	62 Å²	62	114.6 Å²	114.6	51%	0.512	60%	0.595	S	S	.	*	H	α-helix	trans	-52.1	-34.9	-171.7	0	0	0	0	0	113.8	S302 K306 T307 L308	S302-A304 VanDerWaalsContact C-N 3.32Å; S302-A304 PolarHBondContact O-N 3.37Å; A304-K306 VanDerWaalsContact C-N 3.28Å; A304-K306 PolarHBondContact O-N 3.37Å; A304-T307 PolarHBondContact O-N 3.25Å; A304-L308 PolarHBondContact O-N 2.85Å
305	K	42.9	Very low	38.8	Very low	97 Å²	97	118 Å²	118	42%	0.422	60%	0.599	S	S	.	*	H	α-helix	trans	-63	-28.7	178.2	-161.8	171.3	-176.1	178.5	0	113.3	L297 P303 I309	L297-K305 PolarHBondContact O-NZ 3.04Å; P303-K305 PolarHBondContact O-N 3.19Å; K305-I309 VanDerWaalsContact O-CD1 3.29Å; K305-I309 WeakPolarHBondContact O-CD1 3.39Å; K305-I309 VanDerWaalsContact O-CG1 3.27Å; K305-I309 WeakPolarHBondContact O-CG1 3.42Å
306	K	45.5	Very low	39.1	Very low	168 Å²	168	117.5 Å²	117.5	73%	0.73	60%	0.595	S	S	*	*	H	α-helix	trans	-79.1	-43.1	172	-74.5	-173.9	175.6	-178.4	0	111.5	P303 A304 L308 I309 N310	P303-K306 PolarHBondContact O-N 3.04Å; A304-K306 VanDerWaalsContact C-N 3.28Å; A304-K306 PolarHBondContact O-N 3.37Å; K306-L308 PolarHBondContact O-N 3.31Å; K306-I309 PolarHBondContact O-N 3.34Å; K306-N310 PolarHBondContact O-N 2.89Å
307	T	49.9	Very low	39.3	Very low	79 Å²	79	116.2 Å²	116.2	49%	0.485	60%	0.604	S	S	.	*	H	α-helix	trans	-59.8	-47.6	179.8	-47.3	0	0	0	0	111.5	P303 A304 I309 N310 I311	P303-T307 PolarHBondContact O-N 2.86Å; A304-T307 PolarHBondContact O-N 3.25Å; T307-I309 PolarHBondContact O-N 3.18Å; T307-N310 PolarHBondContact O-N 2.95Å; T307-I311 HydrophobicContact CG2-CD1 3.96Å; T307-I311 WeakPolarHBondContact O-CG1 3.21Å; T307-I311 PolarHBondContact O-N 2.79Å
308	L	39	Very low	39.1	Very low	99 Å²	99	117 Å²	117	52%	0.518	62%	0.617	S	S	.	*	H	α-helix	trans	-62.7	-40.3	-179.9	-158.7	76.3	0	0	0	112.2	A304 K306 I311 M312	A304-L308 PolarHBondContact O-N 2.85Å; K306-L308 PolarHBondContact O-N 3.31Å; L308-I311 PolarHBondContact O-N 2.8Å; L308-M312 HydrophobicContact CD2-CE 4.33Å; L308-M312 HydrophobicContact CG-CE 4.16Å; L308-M312 WeakPolarHBondContact O-CG 3.31Å; L308-M312 PolarHBondContact O-N 2.96Å
309	I	46.5	Very low	38.8	Very low	78 Å²	78	118.3 Å²	118.3	40%	0.4	63%	0.625	S	S	.	*	H	α-helix	trans	-66	-39.3	176.6	-69.9	173.6	0	0	0	111.4	K305 K306 T307 M312 K313	K305-I309 VanDerWaalsContact O-CD1 3.29Å; K305-I309 WeakPolarHBondContact O-CD1 3.39Å; K305-I309 VanDerWaalsContact O-CG1 3.27Å; K305-I309 WeakPolarHBondContact O-CG1 3.42Å; K306-I309 PolarHBondContact O-N 3.34Å; T307-I309 PolarHBondContact O-N 3.18Å; I309-M312 HydrophobicContact CG1-CE 4.49Å; I309-K313 HydrophobicContact CG2-CD 4.28Å; I309-K313 WeakPolarHBondContact O-CB 3.39Å; I309-K313 WeakPolarHBondContact O-CG 3.22Å; I309-K313 PolarHBondContact O-N 3.35Å
310	N	44.8	Very low	38.2	Very low	95 Å²	95	118.7 Å²	118.7	51%	0.508	63%	0.625	S	S	.	*	H	α-helix	trans	-69.8	-38.2	175.8	-79.9	9.2	0	0	0	112.5	K306 T307 K313 N314	K306-N310 PolarHBondContact O-N 2.89Å; T307-N310 PolarHBondContact O-N 2.95Å; N310-K313 PolarHBondContact O-N 2.91Å; N310-N314 WeakPolarHBondContact O-CB 3.47Å; N310-N314 VanDerWaalsContact O-CG 3.29Å; N310-N314 PolarHBondContact O-N 2.92Å; N310-N314 PolarHBondContact O-OD1 3.37Å
311	I	44.3	Very low	38.2	Very low	81 Å²	81	124.2 Å²	124.2	42%	0.415	64%	0.639	S	S	.	*	H	α-helix	trans	-61.4	-45.5	174.5	-70.4	167.8	0	0	0	110.6	T307 L308 N314 K315	T307-I311 HydrophobicContact CG2-CD1 3.96Å; T307-I311 WeakPolarHBondContact O-CG1 3.21Å; T307-I311 PolarHBondContact O-N 2.79Å; L308-I311 PolarHBondContact O-N 2.8Å; I311-N314 PolarHBondContact O-N 3.43Å; I311-K315 PolarHBondContact O-N 3.23Å; I311-K315 VanDerWaalsContact O-N 3.12Å
312	M	39.1	Very low	38	Very low	102 Å²	102	123.7 Å²	123.7	50%	0.502	64%	0.639	S	S	.	*	H	α-helix	trans	-66.7	-37.5	177.6	-71.2	-172.7	-69	0	0	112.8	L308 I309	L308-M312 HydrophobicContact CD2-CE 4.33Å; L308-M312 HydrophobicContact CG-CE 4.16Å; L308-M312 WeakPolarHBondContact O-CG 3.31Å; L308-M312 PolarHBondContact O-N 2.96Å; I309-M312 HydrophobicContact CG1-CE 4.49Å
313	K	41.2	Very low	37.4	Very low	151 Å²	151	130.9 Å²	130.9	66%	0.657	65%	0.653	S	S	*	*	H	α-helix	trans	-66.5	-40.7	174.8	-77	-177.6	175.1	-171	0	112.6	I309 N310	I309-K313 HydrophobicContact CG2-CD 4.28Å; I309-K313 WeakPolarHBondContact O-CB 3.39Å; I309-K313 WeakPolarHBondContact O-CG 3.22Å; I309-K313 PolarHBondContact O-N 3.35Å; N310-K313 PolarHBondContact O-N 2.91Å
314	N	42.9	Very low	36.9	Very low	122 Å²	122	131 Å²	131	65%	0.652	66%	0.656	S	S	*	*	H	α-helix	trans	-75	-27.7	-177.4	-70.1	1.2	0	0	0	113.2	N310 I311 I316	N310-N314 WeakPolarHBondContact O-CB 3.47Å; N310-N314 VanDerWaalsContact O-CG 3.29Å; N310-N314 PolarHBondContact O-N 2.92Å; N310-N314 PolarHBondContact O-OD1 3.37Å; I311-N314 PolarHBondContact O-N 3.43Å; N314-I316 PolarHBondContact O-N 2.9Å
315	K	40.4	Very low	36.7	Very low	158 Å²	158	133.5 Å²	133.5	69%	0.687	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-5	176.5	-92.5	179.5	175.1	172.6	0	115	I311	I311-K315 PolarHBondContact O-N 3.23Å; I311-K315 VanDerWaalsContact O-N 3.12Å
316	I	35.3	Very low	35.9	Very low	151 Å²	151	141 Å²	141	77%	0.774	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	1	-174.4	-69	174.5	0	0	0	112.9	N314	N314-I316 PolarHBondContact O-N 2.9Å
317	G	29.6	Very low	35.1	Very low	66 Å²	66	144.5 Å²	144.5	68%	0.68	70%	0.704	S	S	*	*	S	Bend	trans	-154.5	58.8	-173.8	0	0	0	0	0	117.7
318	S	29.8	Very low	34.1	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	72%	0.719	S	S	*	*			trans	-158.5	50.4	172.6	65.5	0	0	0	0	117.3
319	E	28.3	Very low	33.8	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	73%	0.728	S	S	*	*			trans	-119.6	71.3	164.7	-75.1	-153.4	152.8	0	0	112.8
320	K	26.7	Very low	33.2	Very low	190 Å²	190	149.9 Å²	149.9	83%	0.826	74%	0.744	S	S	*	*			trans	-147.6	79.7	166.8	-73.9	-167.9	179	177.9	0	112
321	Y	29.2	Very low	32.7	Very low	231 Å²	231	155.7 Å²	155.7	91%	0.906	76%	0.76	S	S	*	*			trans	-135.9	134.4	163.3	-84.9	-71.4	0	0	0	113.6
322	H	27.6	Very low	32.3	Very low	176 Å²	176	161.8 Å²	161.8	82%	0.815	78%	0.784	S	S	*	*			trans	-58.1	153.9	-166	-62.7	-97.9	0	0	0	117.2
323	R	27.1	Very low	31.9	Very low	242 Å²	242	162.1 Å²	162.1	91%	0.913	80%	0.797	S	S	*	*			trans	-146.2	121.4	138.2	-121	-179.7	-178.5	-168.9	-0.2	114.2
324	S	29	Very low	31.6	Very low	103 Å²	103	160.2 Å²	160.2	72%	0.72	80%	0.799	S	S	*	*			trans	71.8	112.6	149.3	-53.2	0	0	0	0	122.9
325	S	31.7	Very low	31.4	Very low	113 Å²	113	162.7 Å²	162.7	79%	0.79	81%	0.812	S	S	*	*				70.8	87.3	128.5	-55.7	0	0	0	0	122.9
326	R	26.8	Very low	31.3	Very low	254 Å²	254	159.3 Å²	159.3	96%	0.958	81%	0.813	S	S	*	*				22.5	138	123.3	-55.7	-177.7	-176.3	-172.8	1.1	120.4
327	R	28.9	Very low	31.5	Very low	243 Å²	243	157.1 Å²	157.1	92%	0.917	81%	0.809	S	S	*	*			trans	-155.1	131.6	146.4	-140.6	-177.9	-164.3	-161.3	3.8	112.4
328	S	28.6	Very low	31.8	Very low	116 Å²	116	160.5 Å²	160.5	81%	0.811	81%	0.811	S	S	*	*			trans	61.1	149.7	169.9	-74.7	0	0	0	0	118.2
329	T	32	Very low	32	Very low	116 Å²	116	163.1 Å²	163.1	71%	0.712	81%	0.812	S	S	*	*			cis	-127	164.3	-5.1	46.4	0	0	0	0	110.9
330	D	33.5	Very low	32.4	Very low	137 Å²	137	165.3 Å²	165.3	73%	0.733	81%	0.814	S	S	*	*				163.8	152.8	121	-81.5	-6.5	0	0	0	115
331	Y	34	Very low	32.8	Very low	216 Å²	216	164.6 Å²	164.6	85%	0.847	81%	0.813	S	S	*	*			trans	-41.3	127.7	-171.6	-61.5	-98.5	0	0	0	120.3
332	K	36.7	Very low	33.1	Very low	209 Å²	209	159.3 Å²	159.3	91%	0.909	81%	0.805	S	S	*	*				-176.8	144.9	104.9	-104.3	178.3	176.2	178	0	113.5
333	S	30.2	Very low	33.3	Very low	110 Å²	110	157.9 Å²	157.9	77%	0.769	80%	0.803	S	S	*	*			trans	-80.2	164.8	170	-41.3	0	0	0	0	111.4
334	P	36.1	Very low	33.7	Very low	110 Å²	110	154.3 Å²	154.3	71%	0.714	80%	0.802	S	S	*	*				-153.7	162.5	89.9	40.6	-22.9	0	0	0	118.2
335	L	37.7	Very low	34.2	Very low	174 Å²	174	154.3 Å²	154.3	91%	0.911	80%	0.801	S	S	*	*			trans	68.2	153.9	149.9	-68.7	160.3	0	0	0	121.8
336	A	37.7	Very low	34.4	Very low	87 Å²	87	157.6 Å²	157.6	72%	0.719	80%	0.804	S	S	*	*			trans	-158.3	-168	178.1	0	0	0	0	0	106.8
337	P	40	Very low	35	Very low	106 Å²	106	152.4 Å²	152.4	69%	0.688	80%	0.796	S	S	*	*			cis	-130.5	-172.1	-13.8	42.5	-25.6	0	0	0	113.2
338	N	36.8	Very low	35.5	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	78%	0.783	S	S	*	*			trans	168.1	114.9	138.9	-85.8	-15.7	0	0	0	108.8
339	Q	34.2	Very low	36.1	Very low	160 Å²	160	146.9 Å²	146.9	75%	0.748	78%	0.775	S	S	*	*				71.7	111.6	76.4	-76	-162.4	5	0	0	115
340	Y	36.6	Very low	36.4	Very low	243 Å²	243	147.5 Å²	147.5	95%	0.953	77%	0.774	S	S	*	*			trans	-151.5	144.5	136.6	-90.3	-67.5	0	0	0	109.9
341	Q	34.5	Very low	36.8	Very low	174 Å²	174	148.2 Å²	148.2	81%	0.813	78%	0.778	S	S	*	*			trans	-102	-176	176.1	-63	167.8	-54	0	0	108.5
342	T	35.8	Very low	37.3	Very low	120 Å²	120	142.2 Å²	142.2	74%	0.736	77%	0.768	S	S	*	*			cis	-158.9	160	18.8	-28	0	0	0	0	112.4
343	N	31	Very low	37.6	Very low	146 Å²	146	139.2 Å²	139.2	78%	0.781	76%	0.761	S	S	*	*			trans	-47.6	153.9	173.1	-47.4	-31.6	0	0	0	118.9
344	L	36.8	Very low	38.4	Very low	168 Å²	168	142.2 Å²	142.2	88%	0.88	77%	0.765	S	S	*	*			trans	-163.6	145	145.3	-107.6	115.6	0	0	0	106
345	S	39	Very low	38.8	Very low	102 Å²	102	143.2 Å²	143.2	71%	0.713	76%	0.764	S	S	*	*			cis	-158.1	-166.4	-15.2	-94.4	0	0	0	0	108.9
346	Q	36	Very low	39.4	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	76%	0.757	S	S	*	*			trans	-123.9	-170.3	178	-69.5	175.8	-110.2	0	0	112.1
347	D	39.3	Very low	39.9	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	76%	0.76	S	S	*	*			trans	91.6	144.8	171.1	-62.1	-37.1	0	0	0	118.7
348	N	39.7	Very low	40.7	Very low	121 Å²	121	143.2 Å²	143.2	65%	0.647	76%	0.758	S	S	*	*			cis	-165	153.3	-35.4	-130.2	-42.4	0	0	0	112
349	N	39.6	Very low	41	Very low	122 Å²	122	143.4 Å²	143.4	65%	0.652	76%	0.759	S	S	*	*			trans	53.3	124.5	150.1	-69	-26.9	0	0	0	125.7
350	N	40	Very low	41.8	Very low	130 Å²	130	140.4 Å²	140.4	70%	0.695	76%	0.756	S	S	*	*				87.6	140.5	127.7	-63.5	-7.8	0	0	0	124.9
351	N	40.5	Very low	42.6	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	75%	0.75	S	S	*	*			trans	72.6	146.6	155.5	-58.8	-10.8	0	0	0	119.7
352	S	45.8	Very low	43.3	Very low	90 Å²	90	132 Å²	132	63%	0.629	75%	0.746	S	S	*	*			cis	-163.8	162.7	-19.1	61.3	0	0	0	0	113.7
353	D	42.9	Very low	43.2	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	75%	0.754	S	S	*	*			trans	73.5	146.7	152.5	-55.9	-48.8	0	0	0	125.2
354	M	45.9	Very low	43.6	Very low	173 Å²	173	134 Å²	134	85%	0.852	75%	0.751	S	S	*	*			trans	68	139.6	163.5	-70.6	-151.3	175.3	0	0	120.2
355	L	44.1	Very low	43.5	Very low	131 Å²	131	130.9 Å²	130.9	69%	0.686	74%	0.743	S	S	*	*			cis	-159.9	144.1	-14.5	-162.5	85.1	0	0	0	111.3
356	M	51.8	Low	43.3	Very low	157 Å²	157	130.4 Å²	130.4	77%	0.773	74%	0.74	S	S	*	*			trans	69.4	145.4	166.2	-71.2	-51.7	98.7	0	0	121.8
357	S	48.4	Very low	43.4	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	74%	0.74	S	S	*	*			trans	-140.3	-163.5	177.2	-51.5	0	0	0	0	106.8
358	P	55.1	Low	43	Very low	101 Å²	101	130.8 Å²	130.8	66%	0.656	75%	0.746	S	S	*	*			cis	-118.7	-171.1	-14.7	39.5	-18.8	0	0	0	110.5
359	D	43.3	Very low	42.7	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	76%	0.756	S	S	*	*				-147.6	111	52.3	-96.7	-43.5	0	0	0	115.9
360	S	51.1	Low	42.3	Very low	98 Å²	98	129.2 Å²	129.2	69%	0.685	75%	0.754	S	S	*	*				54.7	128.5	120	-52	0	0	0	0	121.8
361	P	53.4	Low	42.1	Very low	127 Å²	127	129.1 Å²	129.1	83%	0.825	76%	0.762	S	S	*	*			trans	-101.2	-84.2	-161	17.6	6	0	0	0	115.4
362	P	49	Very low	41.8	Very low	114 Å²	114	130.4 Å²	130.4	74%	0.74	76%	0.761	S	S	*	*			cis	-97	169	-19.6	40.4	-33.4	0	0	0	113.9
363	K	34.4	Very low	41	Very low	205 Å²	205	130.4 Å²	130.4	89%	0.891	76%	0.76	S	S	*	*			trans	-146.5	109.1	154.6	-81.4	-175	-178.2	172.6	0	109.4
364	S	39	Very low	40.6	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	76%	0.763	S	S	*	*			trans	-78.4	144	163.8	59.1	0	0	0	0	108.6
365	S	35.8	Very low	40.1	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	77%	0.765	S	S	*	*			cis	62.9	138.9	44.8	99.5	0	0	0	0	111.3
366	S	34.8	Very low	39.6	Very low	92 Å²	92	128.6 Å²	128.6	64%	0.643	76%	0.763	S	S	*	*			cis	-167.4	-175.7	3.7	22	0	0	0	0	110.4
367	L	36.7	Very low	38.7	Very low	163 Å²	163	128.7 Å²	128.7	85%	0.853	77%	0.766	S	S	*	*			trans	87.7	133.1	160	-49.5	-178.1	0	0	0	118.3
368	L	31.9	Very low	38.3	Very low	172 Å²	172	127.7 Å²	127.7	90%	0.901	76%	0.759	S	S	*	*			trans	-86.4	148.2	159.8	-47.5	79.6	0	0	0	108
369	S	33.4	Very low	37.4	Very low	123 Å²	123	128.3 Å²	128.3	86%	0.86	77%	0.766	S	S	*	*			trans	-170.5	162.4	132.2	-160.2	0	0	0	0	111.4
370	S	30.9	Very low	37.4	Very low	87 Å²	87	127.2 Å²	127.2	61%	0.608	77%	0.769	S	S	*	*			trans	-108.5	129.8	179.1	55	0	0	0	0	112.6
371	C	35.8	Very low	36.7	Very low	128 Å²	128	126.8 Å²	126.8	87%	0.865	77%	0.772	S	S	*	*			trans	-144.1	126.2	150.2	-76.5	0	0	0	0	105.7
372	F	33.6	Very low	36	Very low	179 Å²	179	126 Å²	126	79%	0.785	77%	0.769	S	S	*	*			cis	68.4	86.1	44.5	-76.5	-66.2	0	0	0	116.2
373	S	29.6	Very low	35.6	Very low	89 Å²	89	125.1 Å²	125.1	62%	0.622	77%	0.766	S	S	*	*			trans	75	154.4	131.3	-58.1	0	0	0	0	121.9
374	F	34.2	Very low	35.8	Very low	191 Å²	191	120.4 Å²	120.4	84%	0.838	76%	0.759	S	S	*	*			trans	71.2	143.5	176.8	-55.2	-75.6	0	0	0	114
375	S	36.4	Very low	36	Very low	126 Å²	126	120.7 Å²	120.7	88%	0.881	76%	0.76	S	S	*	*			cis	-119.6	153.5	30.8	-60	0	0	0	0	116.9
376	S	32.8	Very low	36.1	Very low	94 Å²	94	120.9 Å²	120.9	66%	0.657	76%	0.762	S	S	*	*			trans	-101.5	159.8	170.9	52.6	0	0	0	0	112
377	L	34.1	Very low	36.4	Very low	160 Å²	160	122 Å²	122	84%	0.838	77%	0.77	S	S	*	*			trans	-151.1	136.6	156	-140.9	73.7	0	0	0	112.9
378	S	39.6	Very low	36.4	Very low	88 Å²	88	119.9 Å²	119.9	62%	0.615	77%	0.768	S	S	*	*			trans	34.3	110.6	153.9	52.2	0	0	0	0	119.7
379	S	37	Very low	36.8	Very low	114 Å²	114	117.5 Å²	117.5	80%	0.797	77%	0.766	S	S	*	*				69.8	138.8	70.9	75.6	0	0	0	0	114.4
380	S	41.3	Very low	36.9	Very low	116 Å²	116	116.4 Å²	116.4	81%	0.811	77%	0.765	S	S	*	*			cis	-151.5	-179.3	26.9	55.5	0	0	0	0	115.5
381	A	37.6	Very low	37.3	Very low	90 Å²	90	119 Å²	119	74%	0.744	78%	0.777	S	S	*	*			trans	-40.9	162	168.5	0	0	0	0	0	116.5
382	S	39	Very low	37.6	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	78%	0.775	S	S	*	*			cis	-170	-176.5	-5.6	49.6	0	0	0	0	108.3
383	S	40.1	Very low	38	Very low	95 Å²	95	114.9 Å²	114.9	66%	0.664	77%	0.772	S	S	*	*			cis	-163.5	179.9	4.2	14.8	0	0	0	0	109.4
384	S	39	Very low	38.5	Very low	107 Å²	107	117 Å²	117	75%	0.748	78%	0.783	S	S	*	*			trans	26.4	121.8	152.4	60.5	0	0	0	0	119.1
385	S	43.2	Very low	38.6	Very low	108 Å²	108	117.2 Å²	117.2	76%	0.755	78%	0.784	S	S	*	*			cis	-173.3	179.3	47.2	53.4	0	0	0	0	112.3
386	S	38	Very low	38.5	Very low	107 Å²	107	116 Å²	116	75%	0.748	78%	0.776	S	S	*	*			trans	-24.6	135.8	170.7	50.8	0	0	0	0	116.8
387	S	39.9	Very low	38.6	Very low	115 Å²	115	121.3 Å²	121.3	80%	0.804	78%	0.783	S	S	*	*				-173.1	174.2	72.6	47.3	0	0	0	0	114.2
388	S	38.2	Very low	38.8	Very low	118 Å²	118	121.6 Å²	121.6	83%	0.825	78%	0.778	S	S	*	*			trans	-64.6	136.5	-173	51.9	0	0	0	0	116.8
389	S	39.8	Very low	38.5	Very low	122 Å²	122	121 Å²	121	85%	0.853	77%	0.771	S	S	*	*			trans	-158.8	156.4	139.9	51.4	0	0	0	0	110.7
390	A	34.8	Very low	38.5	Very low	101 Å²	101	124.1 Å²	124.1	84%	0.835	78%	0.776	S	S	*	*			trans	-95.1	131.1	-169.6	0	0	0	0	0	113
391	T	39	Very low	38.5	Very low	141 Å²	141	123.8 Å²	123.8	87%	0.865	76%	0.761	S	S	*	*			trans	-110.6	94	172	43.5	0	0	0	0	110.6
392	S	43	Very low	38.7	Very low	118 Å²	118	124.5 Å²	124.5	83%	0.825	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-71.6	132.8	173.8	45.3	0	0	0	0	111
393	S	42.5	Very low	38.8	Very low	102 Å²	102	128.8 Å²	128.8	71%	0.713	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-72.1	142.5	-176	44.1	0	0	0	0	112.7	K395	S393-K395 PolarHBondContact O-N 2.93Å
394	P	38.6	Very low	39	Very low	133 Å²	133	129.1 Å²	129.1	86%	0.864	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-72.3	116.3	-172	28	-34.6	0	0	0	111.7
395	K	37.7	Very low	39.3	Very low	197 Å²	197	127.7 Å²	127.7	86%	0.857	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-80.4	138.8	170.8	-71.2	179.3	179.2	174	0	110.4	S393 Y397	S393-K395 PolarHBondContact O-N 2.93Å; K395-Y397 PolarHBondContact O-N 2.94Å
396	S	34.3	Very low	39.2	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58	123.5	-174.6	55.3	0	0	0	0	113.5
397	Y	33.4	Very low	39.5	Very low	206 Å²	206	128.7 Å²	128.7	81%	0.808	72%	0.722	S	S	*	*			trans	-91.8	103.6	178.2	-164.7	-115.8	0	0	0	110.6	K395 P399	K395-Y397 PolarHBondContact O-N 2.94Å; Y397-P399 HydrophobicContact CD1-CG 3.58Å; Y397-P399 HydrophobicContact CD2-CG 4.12Å; Y397-P399 HydrophobicContact CE1-CG 3.31Å; Y397-P399 HydrophobicContact CE2-CG 3.88Å; Y397-P399 HydrophobicContact CG-CG 3.98Å; Y397-P399 VanDerWaalsContact CZ-CG 3.47Å
398	F	37.8	Very low	39.9	Very low	166 Å²	166	126.1 Å²	126.1	73%	0.728	70%	0.697	S	S	*	*			trans	-127.4	71.1	176.2	-78.4	-65.8	0	0	0	112.2	M400 H401	F398-M400 PolarHBondContact O-N 3.44Å; F398-H401 PolarHBondContact O-CE1 3.04Å; F398-H401 PolarHBondContact O-ND1 3.33Å
399	P	33.5	Very low	40.3	Very low	75 Å²	75	125.2 Å²	125.2	49%	0.487	69%	0.69	S	S	.	*			trans	-96	79.8	-172.7	19.9	-0.2	0	0	0	110.7	Y397	Y397-P399 HydrophobicContact CD1-CG 3.58Å; Y397-P399 HydrophobicContact CD2-CG 4.12Å; Y397-P399 HydrophobicContact CE1-CG 3.31Å; Y397-P399 HydrophobicContact CE2-CG 3.88Å; Y397-P399 HydrophobicContact CG-CG 3.98Å; Y397-P399 VanDerWaalsContact CZ-CG 3.47Å
400	M	36.8	Very low	40.6	Very low	180 Å²	180	129.6 Å²	129.6	89%	0.887	69%	0.688	S	S	*	*			trans	-150.5	18.9	-179.9	-104.2	-58.4	166.7	0	0	115.2	F398	F398-M400 PolarHBondContact O-N 3.44Å
401	H	42.3	Very low	41.2	Very low	109 Å²	109	126.9 Å²	126.9	51%	0.505	66%	0.663	S	S	.	*			trans	-102.4	-34.2	-175	35.5	-87.1	0	0	0	115.8	F398 K403 L404	F398-H401 PolarHBondContact O-CE1 3.04Å; F398-H401 PolarHBondContact O-ND1 3.33Å; H401-K403 PolarHBondContact O-N 3.3Å; H401-L404 PolarHBondContact O-N 3.33Å
402	D	40.7	Very low	41.7	Very low	104 Å²	104	121 Å²	121	56%	0.556	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-67.2	-32	-157.3	-56.1	-60.9	0	0	0	116.1	L404 L405	D402-L404 VanDerWaalsContact C-N 3.27Å; D402-L404 PolarHBondContact O-N 3.27Å; D402-L405 WeakPolarHBondContact O-CB 3.44Å; D402-L405 PolarHBondContact O-N 3.41Å
403	K	42.5	Very low	41.9	Very low	200 Å²	200	120.7 Å²	120.7	87%	0.87	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-68.5	-23.5	180	-71.4	-173.7	177	-179.8	0	113.6	H401 L405	H401-K403 PolarHBondContact O-N 3.3Å; K403-L405 VanDerWaalsContact C-N 3.35Å
404	L	42.8	Very low	42.4	Very low	103 Å²	103	117.9 Å²	117.9	54%	0.539	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-85.9	-4.7	172.7	-72.3	172.1	0	0	0	113.2	H401 D402	H401-L404 PolarHBondContact O-N 3.33Å; D402-L404 VanDerWaalsContact C-N 3.27Å; D402-L404 PolarHBondContact O-N 3.27Å
405	L	47.3	Very low	43	Very low	76 Å²	76	120.4 Å²	120.4	40%	0.398	60%	0.597	S	S	.	*	S	Bend	trans	-83.5	-13.4	179	-57.8	-176.5	0	0	0	113.5	D402 K403 K408	D402-L405 WeakPolarHBondContact O-CB 3.44Å; D402-L405 PolarHBondContact O-N 3.41Å; K403-L405 VanDerWaalsContact C-N 3.35Å; L405-K408 HydrophobicContact CD2-CD 3.94Å; L405-K408 WeakPolarHBondContact O-CB 3.23Å
406	N	39.2	Very low	43.7	Very low	147 Å²	147	123 Å²	123	79%	0.786	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-13.5	-171.2	-139	0.7	0	0	0	115.1	K408	N406-K408 PolarHBondContact O-N 2.9Å
407	L	45.7	Very low	44.8	Very low	89 Å²	89	121 Å²	121	47%	0.466	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.7	0.3	170.6	-66	85	0	0	0	112.5	S409 E433	L407-S409 PolarHBondContact O-N 3.42Å; L407-E433 HydrophobicContact CD2-CG 4.33Å
408	K	46.9	Very low	46.5	Very low	61 Å²	61	116.5 Å²	116.5	27%	0.265	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	9.8	-146.3	-148.8	164.7	176.4	-170.1	0	115.1	L405 N406 H459 L463	L405-K408 HydrophobicContact CD2-CD 3.94Å; L405-K408 WeakPolarHBondContact O-CB 3.23Å; N406-K408 PolarHBondContact O-N 2.9Å; K408-H459 WeakPolarHBondContact CE-CE1 3.45Å; K408-H459 WeakPolarHBondContact CE-NE2 3.39Å; K408-H459 PolarHBondContact NZ-CE1 3.07Å; K408-H459 PolarHBondContact NZ-NE2 2.98Å; K408-L463 HydrophobicContact CG-CD2 4.31Å; K408-L463 WeakPolarHBondContact O-CD2 3.39Å
409	S	47.4	Very low	48.6	Very low	99 Å²	99	111 Å²	111	69%	0.692	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	-33.4	-175.4	58.2	0	0	0	0	115	L407	L407-S409 PolarHBondContact O-N 3.42Å
410	R	45.6	Very low	51.3	Low	215 Å²	215	113.6 Å²	113.6	81%	0.811	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-29.5	-165.8	-126.1	174.9	-176.9	175.8	-0.4	115.7
411	S	47.5	Very low	54	Low	43 Å²	43	105.1 Å²	105.1	30%	0.301	52%	0.521	S	S	.	.	S	Bend	trans	-91.3	-38.9	-174.4	-171	0	0	0	0	113.9	S413 E433 Y434	S411-S413 VanDerWaalsContact C-N 3.28Å; S411-S413 PolarHBondContact O-N 3.37Å; S411-S413 VanDerWaalsContact O-N 3.1Å; S411-E433 PolarHBondContact OG-OE2 3.43Å; S411-Y434 PolarHBondContact OG-OH 2.96Å
412	F	50.6	Low	56.4	Low	19 Å²	19	100 Å²	100	8%	0.083	50%	0.497	C	S	.	.			trans	-79.1	9.2	-168.6	-82.9	-77.8	0	0	0	117	L414 F424 L428 Y434 L460 L463	F412-L414 HydrophobicContact CD1-CD1 4.19Å; F412-L414 PolarHBondContact O-N 2.86Å; F412-F424 HydrophobicContact CD1-CE2 4.49Å; F412-F424 AromaticContact CE1-CE2 4Å; F412-F424 HydrophobicContact CE1-CE2 4Å; F412-F424 HydrophobicContact CE1-CZ 4.44Å; F412-L428 HydrophobicContact CE1-CD2 4.03Å; F412-L428 HydrophobicContact CZ-CD2 3.84Å; F412-Y434 HydrophobicContact CE1-CE2 4.45Å; F412-Y434 AromaticContact CE2-CE1 3.75Å; F412-Y434 HydrophobicContact CE2-CE1 3.75Å; F412-Y434 HydrophobicContact CE2-CE2 4.2Å; F412-Y434 AromaticContact CE2-CZ 3.44Å; F412-Y434 VanDerWaalsContact CE2-CZ 3.44Å; F412-Y434 WeakPolarHBondContact CE2-OH 3.48Å; F412-Y434 HydrophobicContact CZ-CD2 4.4Å; F412-Y434 AromaticContact CZ-CE1 3.87Å; F412-Y434 HydrophobicContact CZ-CE1 3.87Å; F412-Y434 AromaticContact CZ-CE2 3.63Å; F412-Y434 HydrophobicContact CZ-CE2 3.63Å; F412-Y434 AromaticContact CZ-CZ 3.35Å; F412-Y434 WeakPolarHBondContact CZ-OH 3.34Å; F412-L460 HydrophobicContact CD2-CD2 4.12Å; F412-L460 HydrophobicContact CE2-CD1 4.1Å; F412-L460 HydrophobicContact CE2-CD2 3.66Å; F412-L460 HydrophobicContact CE2-CG 4.39Å; F412-L460 HydrophobicContact CZ-CB 4.45Å; F412-L460 HydrophobicContact CZ-CD1 3.88Å; F412-L460 HydrophobicContact CZ-CD2 4.1Å; F412-L460 HydrophobicContact CZ-CG 4.38Å; F412-L463 HydrophobicContact CB-CD2 4.5Å
413	S	46.5	Very low	58.9	Low	110 Å²	110	97.2 Å²	97.2	77%	0.769	48%	0.481	S	S	*	.			trans	-77.2	50.8	172.1	-157.8	0	0	0	0	112.1	S411 K415	S411-S413 VanDerWaalsContact C-N 3.28Å; S411-S413 PolarHBondContact O-N 3.37Å; S411-S413 VanDerWaalsContact O-N 3.1Å; S413-K415 PolarHBondContact O-N 3.15Å
414	L	52.2	Low	61.3	Low	44 Å²	44	87.8 Å²	87.8	23%	0.23	44%	0.44	C	S	.	.			trans	-74.6	69.6	-175.6	-72	162.1	0	0	0	111.8	F412 R416 F419 Y427	F412-L414 HydrophobicContact CD1-CD1 4.19Å; F412-L414 PolarHBondContact O-N 2.86Å; L414-R416 VanDerWaalsContact C-N 3.31Å; L414-R416 PolarHBondContact O-N 2.92Å; L414-F419 HydrophobicContact CB-CE2 4.41Å; L414-Y427 HydrophobicContact CD1-CD1 4.28Å; L414-Y427 HydrophobicContact CD1-CE1 3.59Å; L414-Y427 HydrophobicContact CD1-CE2 4.34Å; L414-Y427 HydrophobicContact CD2-CE2 4.37Å
415	K	51.4	Low	63.8	Low	186 Å²	186	82.9 Å²	82.9	81%	0.809	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.2	42.9	164.2	-64.1	-172.1	179.8	179.5	0	116.3	S413 S417	S413-K415 PolarHBondContact O-N 3.15Å; K415-S417 PolarHBondContact O-N 3.21Å
416	R	53	Low	66	Low	252 Å²	252	82.2 Å²	82.2	95%	0.951	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	6.9	170.1	-103.2	179.7	-178.4	164.5	1.6	117.6	L414	L414-R416 VanDerWaalsContact C-N 3.31Å; L414-R416 PolarHBondContact O-N 2.92Å
417	S	56.7	Low	68.5	Low	56 Å²	56	77.7 Å²	77.7	39%	0.392	38%	0.38	S	S	.	.			trans	-68.7	139.3	-171.7	-176	0	0	0	0	111.8	K415 F419	K415-S417 PolarHBondContact O-N 3.21Å; S417-F419 WeakPolarHBondContact O-CD2 3.48Å; S417-F419 PolarHBondContact O-N 3.47Å
418	P	70	Confident	70.8	Confident	112 Å²	112	73.5 Å²	73.5	73%	0.727	36%	0.357	S	S	*	.			trans	-78.2	55.5	-177.4	34	-37.3	0	0	0	112.6	K420	P418-K420 PolarHBondContact O-N 2.89Å
419	F	81.1	Confident	73	Confident	51 Å²	51	70.7 Å²	70.7	22%	0.224	35%	0.346	C	S	.	.			trans	-47.2	129.5	174.1	-71.8	-88.2	0	0	0	111.3	L414 S417 Q423 W461 H464 K465	L414-F419 HydrophobicContact CB-CE2 4.41Å; S417-F419 WeakPolarHBondContact O-CD2 3.48Å; S417-F419 PolarHBondContact O-N 3.47Å; F419-Q423 HydrophobicContact CD1-CB 3.96Å; F419-W461 WeakPolarHBondContact O-CH2 3.31Å; F419-H464 AromaticContact CD2-CE1 3.57Å; F419-H464 AromaticContact CD2-NE2 3.65Å; F419-K465 WeakPolarHBondContact O-CE 3.38Å; F419-K465 PolarHBondContact O-NZ 3.22Å
420	K	91	Very high	75.1	Confident	130 Å²	130	70.1 Å²	70.1	57%	0.565	34%	0.335	S	S	*	.			trans	-68.7	157.5	163.2	-64.1	178.1	-179.3	177.5	0	109.2	P418 S422 Q423 F424	P418-K420 PolarHBondContact O-N 2.89Å; K420-S422 PolarHBondContact O-N 3.19Å; K420-Q423 HydrophobicContact CB-CG 4.35Å; K420-Q423 PolarHBondContact O-N 3.44Å; K420-F424 PolarHBondContact O-N 3.45Å
421	L	93.7	Very high	77.1	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-60.5	-36.2	179.8	173.3	65.8	0	0	0	111.5	F424 L425 W461 M475 A478 L479 Y482	L421-F424 HydrophobicContact CD1-CD1 4.2Å; L421-F424 PolarHBondContact O-N 3.03Å; L421-L425 HydrophobicContact CD1-CD1 4.01Å; L421-L425 HydrophobicContact CD1-CD2 4.42Å; L421-L425 HydrophobicContact CD1-CG 3.97Å; L421-L425 HydrophobicContact CD2-CD1 4.5Å; L421-L425 HydrophobicContact CG-CD1 3.89Å; L421-L425 HydrophobicContact CG-CG 4.3Å; L421-L425 VanDerWaalsContact O-CG 3.28Å; L421-L425 WeakPolarHBondContact O-CG 3.46Å; L421-L425 PolarHBondContact O-N 2.97Å; L421-W461 HydrophobicContact CB-CH2 3.94Å; L421-W461 HydrophobicContact CB-CZ2 3.76Å; L421-W461 HydrophobicContact CD1-CD2 3.71Å; L421-W461 HydrophobicContact CD1-CE3 4.1Å; L421-W461 HydrophobicContact CD1-CG 3.91Å; L421-W461 HydrophobicContact CD1-CZ2 4.3Å; L421-M475 HydrophobicContact CD1-CG 3.84Å; L421-M475 HydrophobicContact CD1-SD 3.89Å; L421-M475 HydrophobicContact CD2-CG 3.57Å; L421-M475 HydrophobicContact CG-CG 4.38Å; L421-A478 HydrophobicContact CD2-CB 3.71Å; L421-L479 HydrophobicContact CD2-CD2 3.78Å; L421-L479 HydrophobicContact CD2-CG 4.04Å; L421-L479 HydrophobicContact CG-CD2 4.43Å; L421-Y482 HydrophobicContact CB-CE2 3.89Å; L421-Y482 HydrophobicContact CD2-CE2 4.39Å; L421-Y482 HydrophobicContact CG-CE2 4.32Å; L421-Y482 PolarHBondContact N-OH 2.92Å; L421-Y482 VanDerWaalsContact N-OH 3.14Å
422	S	93	Very high	79.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.007	34%	0.34	C	S	.	.	H	α-helix	trans	-58.9	-48.7	174.4	47.2	0	0	0	0	112.4	K420 F424 L425 Y426	K420-S422 PolarHBondContact O-N 3.19Å; S422-F424 VanDerWaalsContact C-N 3.34Å; S422-F424 PolarHBondContact O-N 3.05Å; S422-L425 PolarHBondContact O-N 3.46Å; S422-Y426 WeakPolarHBondContact O-CB 3.45Å; S422-Y426 PolarHBondContact O-N 2.96Å
423	Q	92.2	Very high	80.8	Confident	46 Å²	46	70.4 Å²	70.4	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-38.6	176.4	-61.9	169.5	-59	0	0	112.1	F419 K420 Y427 F504	F419-Q423 HydrophobicContact CD1-CB 3.96Å; K420-Q423 HydrophobicContact CB-CG 4.35Å; K420-Q423 PolarHBondContact O-N 3.44Å; Q423-Y427 WeakPolarHBondContact O-CB 3.29Å; Q423-Y427 PolarHBondContact O-N 3.5Å; Q423-F504 HydrophobicContact CB-CZ 4.48Å; Q423-F504 HydrophobicContact CG-CE2 4.23Å; Q423-F504 HydrophobicContact CG-CZ 3.89Å
424	F	94	Very high	82.9	Confident	3 Å²	3	65.5 Å²	65.5	1%	0.013	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-44	175.8	173.5	-96.2	0	0	0	112.4	F412 K420 L421 S422 Y427 L428 L460 W461 H464	F412-F424 HydrophobicContact CD1-CE2 4.49Å; F412-F424 AromaticContact CE1-CE2 4Å; F412-F424 HydrophobicContact CE1-CE2 4Å; F412-F424 HydrophobicContact CE1-CZ 4.44Å; K420-F424 PolarHBondContact O-N 3.45Å; L421-F424 HydrophobicContact CD1-CD1 4.2Å; L421-F424 PolarHBondContact O-N 3.03Å; S422-F424 VanDerWaalsContact C-N 3.34Å; S422-F424 PolarHBondContact O-N 3.05Å; F424-Y427 WeakPolarHBondContact O-CB 3.22Å; F424-Y427 PolarHBondContact O-N 3.45Å; F424-L428 HydrophobicContact CD1-CD1 4.21Å; F424-L428 HydrophobicContact CE1-CD1 3.55Å; F424-L428 HydrophobicContact CE1-CG 4.13Å; F424-L428 HydrophobicContact CE2-CD2 4.45Å; F424-L428 HydrophobicContact CZ-CD1 3.85Å; F424-L428 HydrophobicContact CZ-CD2 4.18Å; F424-L428 HydrophobicContact CZ-CG 4.16Å; F424-L428 WeakPolarHBondContact O-CG 3.34Å; F424-L428 PolarHBondContact O-N 2.95Å; F424-L460 HydrophobicContact CZ-CB 3.92Å; F424-W461 HydrophobicContact CB-CE3 3.81Å; F424-W461 HydrophobicContact CB-CZ3 3.59Å; F424-W461 HydrophobicContact CD1-CB 4.24Å; F424-W461 HydrophobicContact CD1-CD2 4.29Å; F424-W461 AromaticContact CD1-CE3 3.58Å; F424-W461 HydrophobicContact CD1-CE3 3.58Å; F424-W461 HydrophobicContact CD1-CZ3 4.27Å; F424-W461 AromaticContact CD2-CE3 3.93Å; F424-W461 HydrophobicContact CD2-CE3 3.93Å; F424-W461 HydrophobicContact CD2-CZ3 4.29Å; F424-W461 HydrophobicContact CE1-CB 3.71Å; F424-W461 HydrophobicContact CE1-CE3 4.09Å; F424-W461 HydrophobicContact CE1-CG 4.5Å; F424-W461 HydrophobicContact CE2-CE3 4.4Å; F424-W461 AromaticContact CG-CE3 3.48Å; F424-W461 HydrophobicContact CG-CE3 3.48Å; F424-W461 VanDerWaalsContact CG-CE3 3.48Å; F424-W461 AromaticContact CG-CZ3 3.81Å; F424-W461 HydrophobicContact CG-CZ3 3.81Å; F424-W461 HydrophobicContact CZ-CB 4.17Å; F424-W461 HydrophobicContact CZ-CE3 4.47Å; F424-H464 HydrophobicContact CD2-CB 4.46Å; F424-H464 HydrophobicContact CE2-CB 3.99Å
425	L	95.3	Very high	84.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-39.8	177	-67.8	169.3	0	0	0	111.8	L421 S422 L428 L429 I439 F449 L451 V457 L479 F500	L421-L425 HydrophobicContact CD1-CD1 4.01Å; L421-L425 HydrophobicContact CD1-CD2 4.42Å; L421-L425 HydrophobicContact CD1-CG 3.97Å; L421-L425 HydrophobicContact CD2-CD1 4.5Å; L421-L425 HydrophobicContact CG-CD1 3.89Å; L421-L425 HydrophobicContact CG-CG 4.3Å; L421-L425 VanDerWaalsContact O-CG 3.28Å; L421-L425 WeakPolarHBondContact O-CG 3.46Å; L421-L425 PolarHBondContact O-N 2.97Å; S422-L425 PolarHBondContact O-N 3.46Å; L425-L428 PolarHBondContact O-N 3.42Å; L425-L429 WeakPolarHBondContact O-CG 3.41Å; L425-L429 PolarHBondContact O-N 3.25Å; L425-I439 HydrophobicContact CB-CD1 4.24Å; L425-I439 HydrophobicContact CD2-CD1 3.81Å; L425-F449 HydrophobicContact CD1-CE2 4.45Å; L425-F449 HydrophobicContact CD1-CZ 4.4Å; L425-L451 HydrophobicContact CD2-CD2 4.06Å; L425-V457 HydrophobicContact CD2-CG1 3.61Å; L425-L479 HydrophobicContact CD1-CD2 3.74Å; L425-F500 HydrophobicContact CB-CZ 4.38Å
426	Y	93.1	Very high	86.4	Confident	61 Å²	61	60.6 Å²	60.6	24%	0.239	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-39.3	173.6	-170.8	-105.8	0	0	0	112.3	S422 L429 N430 W441 F500 F504 H505	S422-Y426 WeakPolarHBondContact O-CB 3.45Å; S422-Y426 PolarHBondContact O-N 2.96Å; Y426-L429 PolarHBondContact O-N 3.04Å; Y426-N430 WeakPolarHBondContact CE1-ND2 3.27Å; Y426-N430 PolarHBondContact O-N 3.35Å; Y426-W441 HydrophobicContact CD2-CH2 4.1Å; Y426-W441 HydrophobicContact CD2-CZ2 4.16Å; Y426-W441 HydrophobicContact CE2-CH2 4.04Å; Y426-W441 AromaticContact CE2-CZ2 3.98Å; Y426-W441 HydrophobicContact CE2-CZ2 3.98Å; Y426-F500 HydrophobicContact CD2-CE2 4.35Å; Y426-F500 HydrophobicContact CD2-CZ 4.46Å; Y426-F504 HydrophobicContact CD1-CE1 4.36Å; Y426-F504 HydrophobicContact CD2-CE1 4.36Å; Y426-F504 AromaticContact CG-CE1 3.98Å; Y426-F504 HydrophobicContact CG-CE1 3.98Å; Y426-H505 AromaticContact CE2-CE1 3.67Å; Y426-H505 AromaticContact CZ-CE1 3.79Å; Y426-H505 PolarHBondContact OH-CE1 3.2Å
427	Y	91.7	Very high	88.3	Confident	53 Å²	53	53.1 Å²	53.1	21%	0.208	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-45.3	172.1	173.3	-91.8	0	0	0	112.2	L414 Q423 F424 L429 N430 K431 Y434	L414-Y427 HydrophobicContact CD1-CD1 4.28Å; L414-Y427 HydrophobicContact CD1-CE1 3.59Å; L414-Y427 HydrophobicContact CD1-CE2 4.34Å; L414-Y427 HydrophobicContact CD2-CE2 4.37Å; Q423-Y427 WeakPolarHBondContact O-CB 3.29Å; Q423-Y427 PolarHBondContact O-N 3.5Å; F424-Y427 WeakPolarHBondContact O-CB 3.22Å; F424-Y427 PolarHBondContact O-N 3.45Å; Y427-L429 VanDerWaalsContact C-N 3.34Å; Y427-L429 PolarHBondContact O-N 2.94Å; Y427-N430 PolarHBondContact O-N 3.26Å; Y427-K431 HydrophobicContact CE1-CG 4.13Å; Y427-K431 HydrophobicContact CE2-CG 4.23Å; Y427-K431 WeakPolarHBondContact O-CG 3.27Å; Y427-K431 PolarHBondContact O-N 2.92Å; Y427-K431 WeakPolarHBondContact OH-CE 3.46Å; Y427-Y434 HydrophobicContact CE1-CE2 4.37Å
428	L	93.8	Very high	90.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-39.9	177.2	-64.7	-178	0	0	0	112.1	F412 F424 L425 N430 K431 Y434 I439 V457 L460	F412-L428 HydrophobicContact CE1-CD2 4.03Å; F412-L428 HydrophobicContact CZ-CD2 3.84Å; F424-L428 HydrophobicContact CD1-CD1 4.21Å; F424-L428 HydrophobicContact CE1-CD1 3.55Å; F424-L428 HydrophobicContact CE1-CG 4.13Å; F424-L428 HydrophobicContact CE2-CD2 4.45Å; F424-L428 HydrophobicContact CZ-CD1 3.85Å; F424-L428 HydrophobicContact CZ-CD2 4.18Å; F424-L428 HydrophobicContact CZ-CG 4.16Å; F424-L428 WeakPolarHBondContact O-CG 3.34Å; F424-L428 PolarHBondContact O-N 2.95Å; L425-L428 PolarHBondContact O-N 3.42Å; L428-N430 VanDerWaalsContact C-N 3.26Å; L428-N430 PolarHBondContact O-N 2.93Å; L428-K431 PolarHBondContact O-N 2.89Å; L428-Y434 HydrophobicContact CB-CD2 4.38Å; L428-Y434 HydrophobicContact CD2-CD2 3.33Å; L428-Y434 HydrophobicContact CD2-CE2 3.81Å; L428-Y434 HydrophobicContact CD2-CG 3.83Å; L428-Y434 HydrophobicContact CG-CD2 4.44Å; L428-I439 HydrophobicContact CB-CG2 3.65Å; L428-I439 HydrophobicContact CD1-CG2 4.34Å; L428-V457 HydrophobicContact CD1-CG1 4.05Å; L428-L460 HydrophobicContact CD2-CD1 4.47Å
429	L	93.7	Very high	91.3	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-30.4	178.5	-83.3	161.9	0	0	0	113.6	L425 Y426 Y427 K431 N435 I439 C440 W441 F449 F500	L425-L429 WeakPolarHBondContact O-CG 3.41Å; L425-L429 PolarHBondContact O-N 3.25Å; Y426-L429 PolarHBondContact O-N 3.04Å; Y427-L429 VanDerWaalsContact C-N 3.34Å; Y427-L429 PolarHBondContact O-N 2.94Å; L429-K431 VanDerWaalsContact C-N 3.35Å; L429-N435 PolarHBondContact O-ND2 3.48Å; L429-I439 HydrophobicContact CD1-CD1 4.07Å; L429-I439 HydrophobicContact CD1-CG1 4.44Å; L429-I439 HydrophobicContact CD2-CD1 4.33Å; L429-I439 HydrophobicContact CD2-CG1 3.83Å; L429-I439 HydrophobicContact CG-CD1 3.85Å; L429-I439 HydrophobicContact CG-CG1 3.9Å; L429-C440 VanDerWaalsContact CD2-C 3.42Å; L429-W441 HydrophobicContact CB-CZ2 3.82Å; L429-W441 HydrophobicContact CD1-CD2 4.43Å; L429-W441 HydrophobicContact CD1-CE3 4.46Å; L429-W441 HydrophobicContact CD1-CH2 3.88Å; L429-W441 HydrophobicContact CD1-CZ2 3.83Å; L429-W441 HydrophobicContact CD1-CZ3 4.19Å; L429-W441 HydrophobicContact CD2-CD2 3.94Å; L429-W441 HydrophobicContact CD2-CG 4.02Å; L429-W441 HydrophobicContact CD2-CZ2 4.46Å; L429-W441 HydrophobicContact CG-CZ2 4.24Å; L429-F449 HydrophobicContact CD1-CB 3.71Å; L429-F449 HydrophobicContact CD1-CD1 4.21Å; L429-F449 HydrophobicContact CD1-CD2 4.11Å; L429-F449 HydrophobicContact CD1-CG 3.77Å; L429-F449 HydrophobicContact CD2-CB 3.98Å; L429-F449 HydrophobicContact CG-CB 4.48Å; L429-F500 HydrophobicContact CD1-CE2 3.9Å
430	N	90.2	Very high	92	Very high	87 Å²	87	44.2 Å²	44.2	47%	0.465	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	5.8	178.8	-67.9	-13.6	0	0	0	113.6	Y426 Y427 L428	Y426-N430 WeakPolarHBondContact CE1-ND2 3.27Å; Y426-N430 PolarHBondContact O-N 3.35Å; Y427-N430 PolarHBondContact O-N 3.26Å; L428-N430 VanDerWaalsContact C-N 3.26Å; L428-N430 PolarHBondContact O-N 2.93Å
431	K	89.2	Confident	92.3	Very high	97 Å²	97	40.2 Å²	40.2	42%	0.422	21%	0.207	S	C	.	.			trans	-117.8	118	178.3	-72.5	-67.1	-174.7	179.3	0	111.3	Y427 L428 L429 E433 Y434 N435	Y427-K431 HydrophobicContact CE1-CG 4.13Å; Y427-K431 HydrophobicContact CE2-CG 4.23Å; Y427-K431 WeakPolarHBondContact O-CG 3.27Å; Y427-K431 PolarHBondContact O-N 2.92Å; Y427-K431 WeakPolarHBondContact OH-CE 3.46Å; L428-K431 PolarHBondContact O-N 2.89Å; L429-K431 VanDerWaalsContact C-N 3.35Å; K431-E433 PolarHBondContact O-N 3.38Å; K431-E433 VanDerWaalsContact O-N 3.11Å; K431-Y434 HydrophobicContact CB-CD2 3.75Å; K431-Y434 HydrophobicContact CB-CE2 4.04Å; K431-Y434 PolarHBondContact O-N 2.87Å; K431-N435 PolarHBondContact O-N 3.43Å; K431-N435 VanDerWaalsContact O-N 3.09Å
432	S	87.8	Confident	92.3	Very high	113 Å²	113	43.4 Å²	43.4	79%	0.79	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.5	176.3	-160.1	0	0	0	0	113.4	Y434	S432-Y434 PolarHBondContact O-N 2.98Å
433	E	87.4	Confident	92.3	Very high	73 Å²	73	46.2 Å²	46.2	34%	0.341	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.1	173.5	-158.5	-167	132.9	0	0	113.3	L407 S411 K431 H437	L407-E433 HydrophobicContact CD2-CG 4.33Å; S411-E433 PolarHBondContact OG-OE2 3.43Å; K431-E433 PolarHBondContact O-N 3.38Å; K431-E433 VanDerWaalsContact O-N 3.11Å; E433-H437 PolarHBondContact O-CE1 3.42Å
434	Y	90.1	Very high	92.3	Very high	6 Å²	6	51.3 Å²	51.3	2%	0.024	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-23.1	-174.9	-47.2	-50.8	0	0	0	113.9	S411 F412 Y427 L428 K431 S432 H437 L438 I439 L460	S411-Y434 PolarHBondContact OG-OH 2.96Å; F412-Y434 HydrophobicContact CE1-CE2 4.45Å; F412-Y434 AromaticContact CE2-CE1 3.75Å; F412-Y434 HydrophobicContact CE2-CE1 3.75Å; F412-Y434 HydrophobicContact CE2-CE2 4.2Å; F412-Y434 AromaticContact CE2-CZ 3.44Å; F412-Y434 VanDerWaalsContact CE2-CZ 3.44Å; F412-Y434 WeakPolarHBondContact CE2-OH 3.48Å; F412-Y434 HydrophobicContact CZ-CD2 4.4Å; F412-Y434 AromaticContact CZ-CE1 3.87Å; F412-Y434 HydrophobicContact CZ-CE1 3.87Å; F412-Y434 AromaticContact CZ-CE2 3.63Å; F412-Y434 HydrophobicContact CZ-CE2 3.63Å; F412-Y434 AromaticContact CZ-CZ 3.35Å; F412-Y434 WeakPolarHBondContact CZ-OH 3.34Å; Y427-Y434 HydrophobicContact CE1-CE2 4.37Å; L428-Y434 HydrophobicContact CB-CD2 4.38Å; L428-Y434 HydrophobicContact CD2-CD2 3.33Å; L428-Y434 HydrophobicContact CD2-CE2 3.81Å; L428-Y434 HydrophobicContact CD2-CG 3.83Å; L428-Y434 HydrophobicContact CG-CD2 4.44Å; K431-Y434 HydrophobicContact CB-CD2 3.75Å; K431-Y434 HydrophobicContact CB-CE2 4.04Å; K431-Y434 PolarHBondContact O-N 2.87Å; S432-Y434 PolarHBondContact O-N 2.98Å; Y434-H437 PolarHBondContact O-N 3.21Å; Y434-L438 HydrophobicContact CD1-CD1 3.9Å; Y434-L438 HydrophobicContact CG-CD1 4.38Å; Y434-L438 WeakPolarHBondContact O-CB 3.38Å; Y434-L438 PolarHBondContact O-N 2.92Å; Y434-I439 PolarHBondContact O-N 2.99Å; Y434-L460 HydrophobicContact CD1-CD1 4.36Å
435	N	87.8	Confident	92.1	Very high	41 Å²	41	55.3 Å²	55.3	22%	0.219	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	121.4	176.7	-178.8	2.5	0	0	0	109.5	L429 K431 I439 C440	L429-N435 PolarHBondContact O-ND2 3.48Å; K431-N435 PolarHBondContact O-N 3.43Å; K431-N435 VanDerWaalsContact O-N 3.09Å; N435-I439 WeakPolarHBondContact CA-O 3.49Å; N435-I439 WeakPolarHBondContact CB-O 3.39Å; N435-C440 WeakPolarHBondContact OD1-CA 3.31Å
436	P	89.9	Confident	91.9	Very high	86 Å²	86	60.1 Å²	60.1	56%	0.558	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	cis	-99.9	-9.6	16.8	37	-36.4	0	0	0	116.3	L438 C440 V452	P436-L438 PolarHBondContact O-N 3.46Å; P436-C440 HydrophobicContact CB-CB 3.82Å; P436-V452 WeakPolarHBondContact O-CG2 3.35Å
437	H	92.4	Very high	91.9	Very high	95 Å²	95	58.6 Å²	58.6	44%	0.44	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-20.6	-160	71.1	-94.5	0	0	0	115.5	E433 Y434	E433-H437 PolarHBondContact O-CE1 3.42Å; Y434-H437 PolarHBondContact O-N 3.21Å
438	L	94.2	Very high	92.1	Very high	12 Å²	12	57.6 Å²	57.6	6%	0.063	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-43.9	172	-53.9	-173.3	0	0	0	111.7	Y434 P436 V452 N453 A456 V457 L460	Y434-L438 HydrophobicContact CD1-CD1 3.9Å; Y434-L438 HydrophobicContact CG-CD1 4.38Å; Y434-L438 WeakPolarHBondContact O-CB 3.38Å; Y434-L438 PolarHBondContact O-N 2.92Å; P436-L438 PolarHBondContact O-N 3.46Å; L438-V452 PolarHBondContact O-N 2.99Å; L438-N453 HydrophobicContact CD2-CB 4.26Å; L438-N453 PolarHBondContact O-N 3.01Å; L438-A456 HydrophobicContact CD2-CB 3.77Å; L438-V457 HydrophobicContact CB-CG2 3.9Å; L438-V457 WeakPolarHBondContact O-CG2 3.4Å; L438-L460 HydrophobicContact CD1-CD1 3.48Å; L438-L460 VanDerWaalsContact CD1-CD1 3.48Å
439	I	96.6	Very high	92.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	133.1	-175.2	-175	172.2	0	0	0	109.1	L425 L428 L429 Y434 N435 F449 K450 L451 V457	L425-I439 HydrophobicContact CB-CD1 4.24Å; L425-I439 HydrophobicContact CD2-CD1 3.81Å; L428-I439 HydrophobicContact CB-CG2 3.65Å; L428-I439 HydrophobicContact CD1-CG2 4.34Å; L429-I439 HydrophobicContact CD1-CD1 4.07Å; L429-I439 HydrophobicContact CD1-CG1 4.44Å; L429-I439 HydrophobicContact CD2-CD1 4.33Å; L429-I439 HydrophobicContact CD2-CG1 3.83Å; L429-I439 HydrophobicContact CG-CD1 3.85Å; L429-I439 HydrophobicContact CG-CG1 3.9Å; Y434-I439 PolarHBondContact O-N 2.99Å; N435-I439 WeakPolarHBondContact CA-O 3.49Å; N435-I439 WeakPolarHBondContact CB-O 3.39Å; I439-F449 HydrophobicContact CD1-CD2 3.84Å; I439-F449 HydrophobicContact CD1-CE2 4.09Å; I439-F449 HydrophobicContact CG1-CD2 4.1Å; I439-K450 WeakPolarHBondContact CA-O 3.41Å; I439-L451 HydrophobicContact CB-CD2 4.43Å; I439-L451 HydrophobicContact CD1-CD2 3.6Å; I439-L451 HydrophobicContact CG1-CD2 3.91Å; I439-V457 HydrophobicContact CB-CG2 4.29Å
440	C	95.9	Very high	92.4	Very high	21 Å²	21	61.8 Å²	61.8	14%	0.142	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.8	-178.3	65.8	0	0	0	0	112.3	L429 N435 P436 F449 K450 V452	L429-C440 VanDerWaalsContact CD2-C 3.42Å; N435-C440 WeakPolarHBondContact OD1-CA 3.31Å; P436-C440 HydrophobicContact CB-CB 3.82Å; C440-F449 CarbonylContact O-C 3.52Å; C440-F449 WeakPolarHBondContact O-CA 3.24Å; C440-F449 WeakPolarHBondContact O-CB 3.46Å; C440-K450 PolarHBondContact N-O 2.93Å; C440-K450 PolarHBondContact O-N 3.25Å; C440-V452 HydrophobicContact CB-CG2 4.39Å; C440-V452 VanDerWaalsContact SG-CG2 3.58Å
441	W	95.8	Very high	92.7	Very high	45 Å²	45	57.7 Å²	57.7	17%	0.17	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.8	162.3	-64.9	108.5	0	0	0	108.7	Y426 L429 K444 F449 F500	Y426-W441 HydrophobicContact CD2-CH2 4.1Å; Y426-W441 HydrophobicContact CD2-CZ2 4.16Å; Y426-W441 HydrophobicContact CE2-CH2 4.04Å; Y426-W441 AromaticContact CE2-CZ2 3.98Å; Y426-W441 HydrophobicContact CE2-CZ2 3.98Å; L429-W441 HydrophobicContact CB-CZ2 3.82Å; L429-W441 HydrophobicContact CD1-CD2 4.43Å; L429-W441 HydrophobicContact CD1-CE3 4.46Å; L429-W441 HydrophobicContact CD1-CH2 3.88Å; L429-W441 HydrophobicContact CD1-CZ2 3.83Å; L429-W441 HydrophobicContact CD1-CZ3 4.19Å; L429-W441 HydrophobicContact CD2-CD2 3.94Å; L429-W441 HydrophobicContact CD2-CG 4.02Å; L429-W441 HydrophobicContact CD2-CZ2 4.46Å; L429-W441 HydrophobicContact CG-CZ2 4.24Å; W441-K444 HydrophobicContact CB-CB 4.42Å; W441-K444 HydrophobicContact CD2-CG 4.44Å; W441-K444 HydrophobicContact CG-CB 4.37Å; W441-K444 HydrophobicContact CG-CG 4.46Å; W441-F449 HydrophobicContact CE3-CB 4.05Å; W441-F449 HydrophobicContact CZ3-CB 4.3Å; W441-F500 HydrophobicContact CH2-CD2 4.13Å; W441-F500 HydrophobicContact CH2-CE2 4.3Å; W441-F500 HydrophobicContact CZ3-CD2 4.24Å
442	V	95	Very high	93.1	Very high	68 Å²	68	56.5 Å²	56.5	41%	0.412	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-44.2	167.3	177.6	0	0	0	0	108.9	M448 K450 V497	V442-M448 HydrophobicContact CB-CB 4.34Å; V442-M448 HydrophobicContact CG1-CE 4.21Å; V442-M448 PolarHBondContact N-O 2.93Å; V442-K450 HydrophobicContact CG2-CB 3.55Å; V442-V497 HydrophobicContact CG2-CG1 4.15Å
443	D	93	Very high	93.5	Very high	60 Å²	60	54.2 Å²	54.2	32%	0.321	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	116.1	170.8	-178.6	-15.6	0	0	0	107.8	S445 Q446 N447 M448	D443-S445 VanDerWaalsContact C-N 3.35Å; D443-S445 WeakPolarHBondContact OD1-CA 3.46Å; D443-S445 WeakPolarHBondContact OD1-CB 3.33Å; D443-S445 PolarHBondContact OD1-N 3.33Å; D443-S445 PolarHBondContact OD1-OG 3.35Å; D443-S445 PolarHBondContact OD2-OG 3.05Å; D443-Q446 HydrophobicContact CB-CB 4.16Å; D443-Q446 PolarHBondContact OD1-N 3.29Å; D443-Q446 WeakPolarHBondContact OD2-CG 3.47Å; D443-N447 PolarHBondContact O-N 3.45Å; D443-M448 HydrophobicContact CB-CB 4.32Å; D443-M448 PolarHBondContact N-O 2.84Å; D443-M448 VanDerWaalsContact N-O 3.13Å; D443-M448 PolarHBondContact O-N 3.39Å
444	K	90.6	Very high	93.9	Very high	153 Å²	153	52 Å²	52	67%	0.665	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-25.7	-179.9	-168.6	-175.5	175.3	-169.6	0	112.1	W441	W441-K444 HydrophobicContact CB-CB 4.42Å; W441-K444 HydrophobicContact CD2-CG 4.44Å; W441-K444 HydrophobicContact CG-CB 4.37Å; W441-K444 HydrophobicContact CG-CG 4.46Å
445	S	90.7	Very high	94.3	Very high	87 Å²	87	54.8 Å²	54.8	61%	0.608	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-42.5	176.8	75.8	0	0	0	0	111.4	D443 N447	D443-S445 VanDerWaalsContact C-N 3.35Å; D443-S445 WeakPolarHBondContact OD1-CA 3.46Å; D443-S445 WeakPolarHBondContact OD1-CB 3.33Å; D443-S445 PolarHBondContact OD1-N 3.33Å; D443-S445 PolarHBondContact OD1-OG 3.35Å; D443-S445 PolarHBondContact OD2-OG 3.05Å; S445-N447 PolarHBondContact O-N 3.04Å
446	Q	91.5	Very high	94.7	Very high	102 Å²	102	54 Å²	54	48%	0.477	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	7.1	177	-64.6	-60.4	-54.4	0	0	113.5	D443 M448 Q499	D443-Q446 HydrophobicContact CB-CB 4.16Å; D443-Q446 PolarHBondContact OD1-N 3.29Å; D443-Q446 WeakPolarHBondContact OD2-CG 3.47Å; Q446-M448 HydrophobicContact CB-CG 4.18Å; Q446-M448 HydrophobicContact CB-SD 4.21Å; Q446-M448 PolarHBondContact O-N 3.42Å; Q446-M448 VanDerWaalsContact O-N 3.12Å; Q446-Q499 WeakPolarHBondContact O-CG 3.45Å; Q446-Q499 PolarHBondContact O-NE2 2.88Å
447	N	93.6	Very high	95	Very high	28 Å²	28	49.9 Å²	49.9	15%	0.15	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	30.8	-174.3	-65.5	-56.2	0	0	0	114.1	D443 S445 Q499 F500	D443-N447 PolarHBondContact O-N 3.45Å; S445-N447 PolarHBondContact O-N 3.04Å; N447-Q499 WeakPolarHBondContact O-CA 3.33Å; N447-F500 HydrophobicContact CB-CB 4.14Å; N447-F500 WeakPolarHBondContact CB-O 3.34Å; N447-F500 PolarHBondContact O-N 2.83Å
448	M	95.3	Very high	95.2	Very high	32 Å²	32	45.4 Å²	45.4	16%	0.158	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.7	-178.6	-82.2	177.7	44.5	0	0	111.9	V442 D443 Q446 V491 V497 Y498 Q499	V442-M448 HydrophobicContact CB-CB 4.34Å; V442-M448 HydrophobicContact CG1-CE 4.21Å; V442-M448 PolarHBondContact N-O 2.93Å; D443-M448 HydrophobicContact CB-CB 4.32Å; D443-M448 PolarHBondContact N-O 2.84Å; D443-M448 VanDerWaalsContact N-O 3.13Å; D443-M448 PolarHBondContact O-N 3.39Å; Q446-M448 HydrophobicContact CB-CG 4.18Å; Q446-M448 HydrophobicContact CB-SD 4.21Å; Q446-M448 PolarHBondContact O-N 3.42Å; Q446-M448 VanDerWaalsContact O-N 3.12Å; M448-V491 HydrophobicContact CE-CG1 4.48Å; M448-V491 HydrophobicContact CE-CG2 4.16Å; M448-V491 HydrophobicContact CG-CG2 4.36Å; M448-V491 HydrophobicContact SD-CG2 4.28Å; M448-V497 HydrophobicContact CE-CG1 4.23Å; M448-Y498 CarbonylContact C-O 3.51Å; M448-Y498 WeakPolarHBondContact CA-O 3.39Å; M448-Q499 HydrophobicContact CG-CB 3.9Å; M448-Q499 HydrophobicContact CG-CG 4.17Å
449	F	96.7	Very high	95.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.9	-179.3	72.3	-87.7	0	0	0	112.9	L425 L429 I439 C440 W441 L451 L488 V497 Y498 F500	L425-F449 HydrophobicContact CD1-CE2 4.45Å; L425-F449 HydrophobicContact CD1-CZ 4.4Å; L429-F449 HydrophobicContact CD1-CB 3.71Å; L429-F449 HydrophobicContact CD1-CD1 4.21Å; L429-F449 HydrophobicContact CD1-CD2 4.11Å; L429-F449 HydrophobicContact CD1-CG 3.77Å; L429-F449 HydrophobicContact CD2-CB 3.98Å; L429-F449 HydrophobicContact CG-CB 4.48Å; I439-F449 HydrophobicContact CD1-CD2 3.84Å; I439-F449 HydrophobicContact CD1-CE2 4.09Å; I439-F449 HydrophobicContact CG1-CD2 4.1Å; C440-F449 CarbonylContact O-C 3.52Å; C440-F449 WeakPolarHBondContact O-CA 3.24Å; C440-F449 WeakPolarHBondContact O-CB 3.46Å; W441-F449 HydrophobicContact CE3-CB 4.05Å; W441-F449 HydrophobicContact CZ3-CB 4.3Å; F449-L451 HydrophobicContact CD2-CD2 4.49Å; F449-L451 HydrophobicContact CE2-CD2 4.18Å; F449-L488 HydrophobicContact CE1-CD2 3.8Å; F449-L488 HydrophobicContact CZ-CD1 4.42Å; F449-L488 HydrophobicContact CZ-CD2 4.13Å; F449-V497 WeakPolarHBondContact O-CA 3.22Å; F449-V497 WeakPolarHBondContact O-CG1 3.38Å; F449-Y498 AromaticContact CE2-CD2 3.98Å; F449-Y498 HydrophobicContact CE2-CD2 3.98Å; F449-Y498 HydrophobicContact CE2-CG 4.44Å; F449-Y498 HydrophobicContact CZ-CD2 4.18Å; F449-Y498 HydrophobicContact CZ-CG 4.2Å; F449-Y498 PolarHBondContact N-O 3.12Å; F449-Y498 PolarHBondContact O-N 3.16Å; F449-F500 AromaticContact CD1-CD2 3.55Å; F449-F500 HydrophobicContact CD1-CD2 3.55Å; F449-F500 AromaticContact CD1-CE2 3.45Å; F449-F500 HydrophobicContact CD1-CE2 3.45Å; F449-F500 VanDerWaalsContact CD1-CE2 3.45Å; F449-F500 HydrophobicContact CD1-CZ 4.49Å; F449-F500 AromaticContact CE1-CD2 3.43Å; F449-F500 HydrophobicContact CE1-CD2 3.43Å; F449-F500 VanDerWaalsContact CE1-CD2 3.43Å; F449-F500 AromaticContact CE1-CE2 3.21Å; F449-F500 HydrophobicContact CE1-CE2 3.21Å; F449-F500 HydrophobicContact CE1-CG 4.24Å; F449-F500 AromaticContact CE1-CZ 3.87Å; F449-F500 HydrophobicContact CE1-CZ 3.87Å; F449-F500 HydrophobicContact CG-CE2 4.34Å; F449-F500 AromaticContact CZ-CE2 3.94Å; F449-F500 HydrophobicContact CZ-CE2 3.94Å; F449-F500 HydrophobicContact CZ-CZ 4.24Å
450	K	96.8	Very high	95.2	Very high	91 Å²	91	49.5 Å²	49.5	40%	0.396	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.2	-179.7	-178.9	175.3	179.9	-176.1	0	110.7	I439 C440 V442 V452 L496 V497	I439-K450 WeakPolarHBondContact CA-O 3.41Å; C440-K450 PolarHBondContact N-O 2.93Å; C440-K450 PolarHBondContact O-N 3.25Å; V442-K450 HydrophobicContact CG2-CB 3.55Å; K450-V452 PolarHBondContact O-N 3.41Å; K450-L496 WeakPolarHBondContact CA-O 3.42Å; K450-V497 HydrophobicContact CB-CG2 3.99Å; K450-V497 HydrophobicContact CD-CG2 4.14Å; K450-V497 HydrophobicContact CG-CG2 3.91Å
451	L	97.4	Very high	95.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	107.4	164.2	-50.7	178.4	0	0	0	107.9	L425 I439 F449 V457 Y472 M475 L479 L496 Y498	L425-L451 HydrophobicContact CD2-CD2 4.06Å; I439-L451 HydrophobicContact CB-CD2 4.43Å; I439-L451 HydrophobicContact CD1-CD2 3.6Å; I439-L451 HydrophobicContact CG1-CD2 3.91Å; F449-L451 HydrophobicContact CD2-CD2 4.49Å; F449-L451 HydrophobicContact CE2-CD2 4.18Å; L451-V457 HydrophobicContact CD2-CG1 4.21Å; L451-V457 HydrophobicContact CD2-CG2 4.46Å; L451-Y472 HydrophobicContact CD1-CD2 4.19Å; L451-Y472 HydrophobicContact CD1-CE2 3.84Å; L451-M475 HydrophobicContact CD1-CE 4.04Å; L451-L479 HydrophobicContact CD1-CD1 4.42Å; L451-L496 HydrophobicContact CB-CB 4.2Å; L451-L496 PolarHBondContact N-O 3Å; L451-L496 WeakPolarHBondContact O-CD1 3.39Å; L451-Y498 HydrophobicContact CD1-CE2 4.1Å; L451-Y498 HydrophobicContact CG-CE2 4.28Å
452	V	96.6	Very high	95.1	Very high	73 Å²	73	47.6 Å²	47.6	44%	0.442	26%	0.261	S	S	.	.	S	Bend	trans	-76.5	-45.1	178.7	177.7	0	0	0	0	110.1	P436 L438 C440 K450	P436-V452 WeakPolarHBondContact O-CG2 3.35Å; L438-V452 PolarHBondContact O-N 2.99Å; C440-V452 HydrophobicContact CB-CG2 4.39Å; C440-V452 VanDerWaalsContact SG-CG2 3.58Å; K450-V452 PolarHBondContact O-N 3.41Å
453	N	96.2	Very high	95	Very high	65 Å²	65	47.2 Å²	47.2	35%	0.348	26%	0.256	S	S	.	.	S	Bend	trans	-121.9	83.9	171.5	-170.7	-24	0	0	0	110.2	L438 A455 A456 V457	L438-N453 HydrophobicContact CD2-CB 4.26Å; L438-N453 PolarHBondContact O-N 3.01Å; N453-A455 PolarHBondContact O-N 3.5Å; N453-A455 PolarHBondContact OD1-N 2.97Å; N453-A456 HydrophobicContact CB-CB 4.05Å; N453-A456 VanDerWaalsContact CG-CB 3.46Å; N453-A456 PolarHBondContact O-N 2.89Å; N453-A456 WeakPolarHBondContact OD1-CB 3.31Å; N453-A456 PolarHBondContact OD1-N 2.88Å; N453-V457 WeakPolarHBondContact O-CG2 3.41Å; N453-V457 PolarHBondContact O-N 3.47Å
454	S	96.7	Very high	94.8	Very high	25 Å²	25	45.6 Å²	45.6	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-28.8	-177.6	58.4	0	0	0	0	114	A458	S454-A458 VanDerWaalsContact O-CB 3.29Å; S454-A458 WeakPolarHBondContact O-CB 3.48Å; S454-A458 PolarHBondContact O-N 3.41Å
455	A	96.8	Very high	94.8	Very high	65 Å²	65	41.1 Å²	41.1	54%	0.537	23%	0.227	S	C	.	.	H	α-helix	trans	-70.4	-45.4	175.8	0	0	0	0	0	111.6	N453 A458 H459	N453-A455 PolarHBondContact O-N 3.5Å; N453-A455 PolarHBondContact OD1-N 2.97Å; A455-A458 PolarHBondContact O-N 2.95Å; A455-H459 PolarHBondContact O-N 2.96Å
456	A	96.1	Very high	94.8	Very high	25 Å²	25	44.6 Å²	44.6	21%	0.207	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-42	176.2	0	0	0	0	0	112.2	L438 N453 A458 H459 L460	L438-A456 HydrophobicContact CD2-CB 3.77Å; N453-A456 HydrophobicContact CB-CB 4.05Å; N453-A456 VanDerWaalsContact CG-CB 3.46Å; N453-A456 PolarHBondContact O-N 2.89Å; N453-A456 WeakPolarHBondContact OD1-CB 3.31Å; N453-A456 PolarHBondContact OD1-N 2.88Å; A456-A458 VanDerWaalsContact C-N 3.34Å; A456-A458 PolarHBondContact O-N 3.2Å; A456-H459 WeakPolarHBondContact O-CB 3.47Å; A456-H459 PolarHBondContact O-N 2.89Å; A456-L460 WeakPolarHBondContact O-CG 3.48Å; A456-L460 PolarHBondContact O-N 2.73Å
457	V	96.7	Very high	94.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-42.8	174.2	175	0	0	0	0	111.2	L425 L428 L438 I439 L451 N453 H459 L460 W461 M475	L425-V457 HydrophobicContact CD2-CG1 3.61Å; L428-V457 HydrophobicContact CD1-CG1 4.05Å; L438-V457 HydrophobicContact CB-CG2 3.9Å; L438-V457 WeakPolarHBondContact O-CG2 3.4Å; I439-V457 HydrophobicContact CB-CG2 4.29Å; L451-V457 HydrophobicContact CD2-CG1 4.21Å; L451-V457 HydrophobicContact CD2-CG2 4.46Å; N453-V457 WeakPolarHBondContact O-CG2 3.41Å; N453-V457 PolarHBondContact O-N 3.47Å; V457-H459 VanDerWaalsContact C-N 3.35Å; V457-H459 PolarHBondContact O-N 3.26Å; V457-L460 PolarHBondContact O-N 2.98Å; V457-W461 PolarHBondContact O-N 3.23Å; V457-M475 HydrophobicContact CG1-CE 4.16Å; V457-M475 HydrophobicContact CG1-SD 4.31Å
458	A	96.9	Very high	94.7	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-36.8	175.3	0	0	0	0	0	112.7	S454 A455 A456 W461 G462 M470 N471 M475	S454-A458 VanDerWaalsContact O-CB 3.29Å; S454-A458 WeakPolarHBondContact O-CB 3.48Å; S454-A458 PolarHBondContact O-N 3.41Å; A455-A458 PolarHBondContact O-N 2.95Å; A456-A458 VanDerWaalsContact C-N 3.34Å; A456-A458 PolarHBondContact O-N 3.2Å; A458-W461 PolarHBondContact O-N 2.85Å; A458-G462 PolarHBondContact O-N 3.46Å; A458-M470 WeakPolarHBondContact O-CG 3.48Å; A458-N471 VanDerWaalsContact CB-C 3.43Å; A458-M475 HydrophobicContact CB-CB 4.45Å; A458-M475 HydrophobicContact CB-CE 4.22Å; A458-M475 HydrophobicContact CB-SD 4.04Å
459	H	95.6	Very high	94.7	Very high	78 Å²	78	55.5 Å²	55.5	36%	0.361	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-42.6	172.8	-172.7	-37.5	0	0	0	111.8	K408 A455 A456 V457 G462 L463	K408-H459 WeakPolarHBondContact CE-CE1 3.45Å; K408-H459 WeakPolarHBondContact CE-NE2 3.39Å; K408-H459 PolarHBondContact NZ-CE1 3.07Å; K408-H459 PolarHBondContact NZ-NE2 2.98Å; A455-H459 PolarHBondContact O-N 2.96Å; A456-H459 WeakPolarHBondContact O-CB 3.47Å; A456-H459 PolarHBondContact O-N 2.89Å; V457-H459 VanDerWaalsContact C-N 3.35Å; V457-H459 PolarHBondContact O-N 3.26Å; H459-G462 PolarHBondContact O-N 3.38Å; H459-L463 WeakPolarHBondContact O-CB 3.28Å; H459-L463 PolarHBondContact O-N 3.35Å
460	L	94.5	Very high	94.6	Very high	20 Å²	20	57 Å²	57	11%	0.105	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-40.2	177	-68.8	-179.3	0	0	0	111.6	F412 F424 L428 Y434 L438 A456 V457 G462 L463 H464	F412-L460 HydrophobicContact CD2-CD2 4.12Å; F412-L460 HydrophobicContact CE2-CD1 4.1Å; F412-L460 HydrophobicContact CE2-CD2 3.66Å; F412-L460 HydrophobicContact CE2-CG 4.39Å; F412-L460 HydrophobicContact CZ-CB 4.45Å; F412-L460 HydrophobicContact CZ-CD1 3.88Å; F412-L460 HydrophobicContact CZ-CD2 4.1Å; F412-L460 HydrophobicContact CZ-CG 4.38Å; F424-L460 HydrophobicContact CZ-CB 3.92Å; L428-L460 HydrophobicContact CD2-CD1 4.47Å; Y434-L460 HydrophobicContact CD1-CD1 4.36Å; L438-L460 HydrophobicContact CD1-CD1 3.48Å; L438-L460 VanDerWaalsContact CD1-CD1 3.48Å; A456-L460 WeakPolarHBondContact O-CG 3.48Å; A456-L460 PolarHBondContact O-N 2.73Å; V457-L460 PolarHBondContact O-N 2.98Å; L460-G462 VanDerWaalsContact C-N 3.34Å; L460-L463 PolarHBondContact O-N 2.76Å; L460-H464 WeakPolarHBondContact O-CB 3.46Å; L460-H464 PolarHBondContact O-N 3.12Å
461	W	95.2	Very high	94.6	Very high	25 Å²	25	56.5 Å²	56.5	10%	0.095	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-41.7	172	177.1	-123.4	0	0	0	112.1	F419 L421 F424 V457 A458 H464 K465 M475	F419-W461 WeakPolarHBondContact O-CH2 3.31Å; L421-W461 HydrophobicContact CB-CH2 3.94Å; L421-W461 HydrophobicContact CB-CZ2 3.76Å; L421-W461 HydrophobicContact CD1-CD2 3.71Å; L421-W461 HydrophobicContact CD1-CE3 4.1Å; L421-W461 HydrophobicContact CD1-CG 3.91Å; L421-W461 HydrophobicContact CD1-CZ2 4.3Å; F424-W461 HydrophobicContact CB-CE3 3.81Å; F424-W461 HydrophobicContact CB-CZ3 3.59Å; F424-W461 HydrophobicContact CD1-CB 4.24Å; F424-W461 HydrophobicContact CD1-CD2 4.29Å; F424-W461 AromaticContact CD1-CE3 3.58Å; F424-W461 HydrophobicContact CD1-CE3 3.58Å; F424-W461 HydrophobicContact CD1-CZ3 4.27Å; F424-W461 AromaticContact CD2-CE3 3.93Å; F424-W461 HydrophobicContact CD2-CE3 3.93Å; F424-W461 HydrophobicContact CD2-CZ3 4.29Å; F424-W461 HydrophobicContact CE1-CB 3.71Å; F424-W461 HydrophobicContact CE1-CE3 4.09Å; F424-W461 HydrophobicContact CE1-CG 4.5Å; F424-W461 HydrophobicContact CE2-CE3 4.4Å; F424-W461 AromaticContact CG-CE3 3.48Å; F424-W461 HydrophobicContact CG-CE3 3.48Å; F424-W461 VanDerWaalsContact CG-CE3 3.48Å; F424-W461 AromaticContact CG-CZ3 3.81Å; F424-W461 HydrophobicContact CG-CZ3 3.81Å; F424-W461 HydrophobicContact CZ-CB 4.17Å; F424-W461 HydrophobicContact CZ-CE3 4.47Å; V457-W461 PolarHBondContact O-N 3.23Å; A458-W461 PolarHBondContact O-N 2.85Å; W461-H464 AromaticContact CE3-CD2 3.99Å; W461-H464 AromaticContact CZ3-CD2 3.82Å; W461-H464 PolarHBondContact O-N 3.31Å; W461-K465 HydrophobicContact CD2-CG 4.13Å; W461-K465 HydrophobicContact CE3-CG 4.11Å; W461-K465 HydrophobicContact CH2-CD 4.19Å; W461-K465 HydrophobicContact CH2-CG 3.94Å; W461-K465 HydrophobicContact CZ2-CG 3.9Å; W461-K465 HydrophobicContact CZ3-CD 4.32Å; W461-K465 VanDerWaalsContact CZ3-CE 3.45Å; W461-K465 HydrophobicContact CZ3-CG 4.03Å; W461-K465 PolarHBondContact O-N 3.02Å; W461-M475 HydrophobicContact CB-SD 4.1Å; W461-M475 HydrophobicContact CG-CG 4.5Å; W461-M475 HydrophobicContact CG-SD 4.27Å
462	G	95.1	Very high	94.6	Very high	2 Å²	2	58.6 Å²	58.6	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-46.5	173.5	0	0	0	0	0	113.1	A458 H459 L460 K465 H466 K467	A458-G462 PolarHBondContact O-N 3.46Å; H459-G462 PolarHBondContact O-N 3.38Å; L460-G462 VanDerWaalsContact C-N 3.34Å; G462-K465 CarbonylContact O-C 3.58Å; G462-K465 PolarHBondContact O-N 3.13Å; G462-H466 WeakPolarHBondContact O-CA 3.42Å; G462-H466 PolarHBondContact O-N 3.15Å; G462-K467 CarbonylContact C-O 3.54Å; G462-K467 WeakPolarHBondContact CA-O 3.27Å; G462-K467 PolarHBondContact O-N 3.18Å
463	L	92.8	Very high	94.6	Very high	60 Å²	60	59.5 Å²	59.5	31%	0.314	31%	0.312	S	S	.	.	H	α-helix	trans	-59.4	-49.4	175.9	-178.4	63.4	0	0	0	110.8	K408 F412 H459 L460 K465 H466	K408-L463 HydrophobicContact CG-CD2 4.31Å; K408-L463 WeakPolarHBondContact O-CD2 3.39Å; F412-L463 HydrophobicContact CB-CD2 4.5Å; H459-L463 WeakPolarHBondContact O-CB 3.28Å; H459-L463 PolarHBondContact O-N 3.35Å; L460-L463 PolarHBondContact O-N 2.76Å; L463-K465 VanDerWaalsContact C-N 3.29Å; L463-K465 PolarHBondContact O-N 3.45Å; L463-H466 PolarHBondContact O-N 3.13Å
464	H	90	Very high	94.6	Very high	25 Å²	25	60 Å²	60	12%	0.116	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-28.6	178.6	175.8	70	0	0	0	113.8	F419 F424 L460 W461	F419-H464 AromaticContact CD2-CE1 3.57Å; F419-H464 AromaticContact CD2-NE2 3.65Å; F424-H464 HydrophobicContact CD2-CB 4.46Å; F424-H464 HydrophobicContact CE2-CB 3.99Å; L460-H464 WeakPolarHBondContact O-CB 3.46Å; L460-H464 PolarHBondContact O-N 3.12Å; W461-H464 AromaticContact CE3-CD2 3.99Å; W461-H464 AromaticContact CZ3-CD2 3.82Å; W461-H464 PolarHBondContact O-N 3.31Å
465	K	90.5	Very high	94.5	Very high	60 Å²	60	59 Å²	59	26%	0.261	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	9	176.5	-64.9	-52	-172.4	-155.8	0	114.9	F419 W461 G462 L463 K467	F419-K465 WeakPolarHBondContact O-CE 3.38Å; F419-K465 PolarHBondContact O-NZ 3.22Å; W461-K465 HydrophobicContact CD2-CG 4.13Å; W461-K465 HydrophobicContact CE3-CG 4.11Å; W461-K465 HydrophobicContact CH2-CD 4.19Å; W461-K465 HydrophobicContact CH2-CG 3.94Å; W461-K465 HydrophobicContact CZ2-CG 3.9Å; W461-K465 HydrophobicContact CZ3-CD 4.32Å; W461-K465 VanDerWaalsContact CZ3-CE 3.45Å; W461-K465 HydrophobicContact CZ3-CG 4.03Å; W461-K465 PolarHBondContact O-N 3.02Å; G462-K465 CarbonylContact O-C 3.58Å; G462-K465 PolarHBondContact O-N 3.13Å; L463-K465 VanDerWaalsContact C-N 3.29Å; L463-K465 PolarHBondContact O-N 3.45Å; K465-K467 HydrophobicContact CB-CG 4.28Å; K465-K467 PolarHBondContact O-N 2.89Å
466	H	90.7	Very high	94.5	Very high	160 Å²	160	55.9 Å²	55.9	74%	0.741	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	41.2	-173.8	-51.4	-62.3	0	0	0	113.1	G462 L463	G462-H466 WeakPolarHBondContact O-CA 3.42Å; G462-H466 PolarHBondContact O-N 3.15Å; L463-H466 PolarHBondContact O-N 3.13Å
467	K	92.3	Very high	94.5	Very high	128 Å²	128	61.4 Å²	61.4	56%	0.557	30%	0.301	S	S	*	.			trans	-117.4	86.9	174.2	-60.6	-55.4	176.1	-172.5	0	109	G462 K465 N469 M470	G462-K467 CarbonylContact C-O 3.54Å; G462-K467 WeakPolarHBondContact CA-O 3.27Å; G462-K467 PolarHBondContact O-N 3.18Å; K465-K467 HydrophobicContact CB-CG 4.28Å; K465-K467 PolarHBondContact O-N 2.89Å; K467-N469 PolarHBondContact O-N 2.93Å; K467-M470 HydrophobicContact CB-CB 4.44Å; K467-M470 HydrophobicContact CB-CE 4.13Å; K467-M470 HydrophobicContact CG-CE 4.46Å; K467-M470 VanDerWaalsContact O-CB 3.27Å; K467-M470 WeakPolarHBondContact O-CB 3.49Å; K467-M470 PolarHBondContact O-N 3.21Å; K467-M470 VanDerWaalsContact O-N 3.13Å
468	P	90.6	Very high	94.4	Very high	114 Å²	114	62.8 Å²	62.8	74%	0.74	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-31	-176.7	24.2	-33.7	0	0	0	112.8	M470	P468-M470 PolarHBondContact O-N 3.13Å; P468-M470 VanDerWaalsContact O-N 3.14Å
469	N	93.8	Very high	94.4	Very high	149 Å²	149	62.8 Å²	62.8	80%	0.797	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	15.1	179.1	-56.8	8.6	0	0	0	113.2	K467 N471	K467-N469 PolarHBondContact O-N 2.93Å; N469-N471 PolarHBondContact O-N 2.82Å
470	M	95	Very high	94.4	Very high	32 Å²	32	64.1 Å²	64.1	16%	0.158	31%	0.314	C	S	.	.			trans	-71.3	124	178.1	-173.1	63.3	67.5	0	0	110.5	A458 K467 P468 T474 M475	A458-M470 WeakPolarHBondContact O-CG 3.48Å; K467-M470 HydrophobicContact CB-CB 4.44Å; K467-M470 HydrophobicContact CB-CE 4.13Å; K467-M470 HydrophobicContact CG-CE 4.46Å; K467-M470 VanDerWaalsContact O-CB 3.27Å; K467-M470 WeakPolarHBondContact O-CB 3.49Å; K467-M470 PolarHBondContact O-N 3.21Å; K467-M470 VanDerWaalsContact O-N 3.13Å; P468-M470 PolarHBondContact O-N 3.13Å; P468-M470 VanDerWaalsContact O-N 3.14Å; M470-T474 HydrophobicContact CE-CG2 4.5Å; M470-T474 HydrophobicContact SD-CG2 3.89Å; M470-M475 HydrophobicContact SD-CB 4.07Å
471	N	97.1	Very high	94.5	Very high	79 Å²	79	70.8 Å²	70.8	42%	0.422	34%	0.339	S	S	.	.			trans	-128.7	172.1	174.7	67.1	32.9	0	0	0	110.2	A458 N469 E473 T474 M475	A458-N471 VanDerWaalsContact CB-C 3.43Å; N469-N471 PolarHBondContact O-N 2.82Å; N471-E473 VanDerWaalsContact C-N 3.3Å; N471-E473 PolarHBondContact O-N 2.97Å; N471-E473 PolarHBondContact OD1-N 2.85Å; N471-E473 VanDerWaalsContact OD1-N 3.1Å; N471-T474 PolarHBondContact O-N 3.44Å; N471-T474 PolarHBondContact OD1-N 3.39Å; N471-T474 PolarHBondContact OD1-OG1 3.38Å; N471-M475 WeakPolarHBondContact O-CB 3.46Å; N471-M475 PolarHBondContact O-N 3.13Å
472	Y	97.7	Very high	94.4	Very high	45 Å²	45	70.8 Å²	70.8	18%	0.176	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-31.7	-178	171.3	-99.2	0	0	0	113.2	L451 M475 G476 L479 L496 Y498	L451-Y472 HydrophobicContact CD1-CD2 4.19Å; L451-Y472 HydrophobicContact CD1-CE2 3.84Å; Y472-M475 HydrophobicContact CD2-CE 3.94Å; Y472-G476 WeakPolarHBondContact O-CA 3.4Å; Y472-G476 PolarHBondContact O-N 2.94Å; Y472-L479 HydrophobicContact CE2-CD1 4.39Å; Y472-L496 HydrophobicContact CE1-CD2 3.98Å; Y472-L496 HydrophobicContact CE2-CD2 3.74Å; Y472-L496 VanDerWaalsContact CZ-CD2 3.43Å; Y472-L496 WeakPolarHBondContact OH-CD2 3.35Å; Y472-Y498 PolarHBondContact OH-OH 3.43Å
473	E	96.4	Very high	94.4	Very high	92 Å²	92	74 Å²	74	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-71.9	-32.1	178.4	-77	-51.5	124	0	0	113.5	N471 R477 R480	N471-E473 VanDerWaalsContact C-N 3.3Å; N471-E473 PolarHBondContact O-N 2.97Å; N471-E473 PolarHBondContact OD1-N 2.85Å; N471-E473 VanDerWaalsContact OD1-N 3.1Å; E473-R477 WeakPolarHBondContact O-CG 3.23Å; E473-R477 PolarHBondContact O-NE 2.82Å; E473-R480 IonicContact OE1-NH2 2.97Å; E473-R480 IonicContact OE2-CZ 3.9Å; E473-R480 IonicContact OE2-NH1 2.69Å; E473-R480 IonicContact OE2-NH2 3.9Å; E473-R480 PolarHBondContact OE2-NH2 3.05Å
474	T	95.6	Very high	94.4	Very high	77 Å²	77	75.8 Å²	75.8	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-73.6	-50.4	172.1	-58.3	0	0	0	0	110.7	M470 N471 G476 R477	M470-T474 HydrophobicContact CE-CG2 4.5Å; M470-T474 HydrophobicContact SD-CG2 3.89Å; N471-T474 PolarHBondContact O-N 3.44Å; N471-T474 PolarHBondContact OD1-N 3.39Å; N471-T474 PolarHBondContact OD1-OG1 3.38Å; T474-G476 VanDerWaalsContact C-N 3.26Å; T474-G476 PolarHBondContact O-N 2.76Å; T474-R477 WeakPolarHBondContact O-CB 3.08Å; T474-R477 PolarHBondContact O-N 3.13Å; T474-R477 VanDerWaalsContact O-N 3.1Å
475	M	95.9	Very high	94.4	Very high	2 Å²	2	80.1 Å²	80.1	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-60	-37.8	176.8	-174.8	-177	78.5	0	0	111.7	L421 L451 V457 A458 W461 M470 N471 Y472 R477 A478 L479	L421-M475 HydrophobicContact CD1-CG 3.84Å; L421-M475 HydrophobicContact CD1-SD 3.89Å; L421-M475 HydrophobicContact CD2-CG 3.57Å; L421-M475 HydrophobicContact CG-CG 4.38Å; L451-M475 HydrophobicContact CD1-CE 4.04Å; V457-M475 HydrophobicContact CG1-CE 4.16Å; V457-M475 HydrophobicContact CG1-SD 4.31Å; A458-M475 HydrophobicContact CB-CB 4.45Å; A458-M475 HydrophobicContact CB-CE 4.22Å; A458-M475 HydrophobicContact CB-SD 4.04Å; W461-M475 HydrophobicContact CB-SD 4.1Å; W461-M475 HydrophobicContact CG-CG 4.5Å; W461-M475 HydrophobicContact CG-SD 4.27Å; M470-M475 HydrophobicContact SD-CB 4.07Å; N471-M475 WeakPolarHBondContact O-CB 3.46Å; N471-M475 PolarHBondContact O-N 3.13Å; Y472-M475 HydrophobicContact CD2-CE 3.94Å; M475-R477 PolarHBondContact O-N 3.39Å; M475-A478 WeakPolarHBondContact O-CB 3.24Å; M475-A478 PolarHBondContact O-N 2.84Å; M475-A478 VanDerWaalsContact O-N 3.08Å; M475-L479 PolarHBondContact O-N 3.49Å
476	G	96.5	Very high	94.5	Very high	1 Å²	1	82.8 Å²	82.8	1%	0.01	41%	0.412	C	S	.	.	H	α-helix	trans	-64.3	-17.7	177.2	0	0	0	0	0	114.4	Y472 T474 R480	Y472-G476 WeakPolarHBondContact O-CA 3.4Å; Y472-G476 PolarHBondContact O-N 2.94Å; T474-G476 VanDerWaalsContact C-N 3.26Å; T474-G476 PolarHBondContact O-N 2.76Å; G476-R480 WeakPolarHBondContact O-CD 3.35Å; G476-R480 WeakPolarHBondContact O-CG 3.13Å; G476-R480 PolarHBondContact O-N 3.42Å
477	R	96.3	Very high	94.6	Very high	140 Å²	140	76.6 Å²	76.6	53%	0.528	38%	0.384	S	S	.	.	H	α-helix	trans	-66	-44.9	168.8	-54.7	-53	176.1	110	-4	111	E473 T474 M475 L479 R480 Y481	E473-R477 WeakPolarHBondContact O-CG 3.23Å; E473-R477 PolarHBondContact O-NE 2.82Å; T474-R477 WeakPolarHBondContact O-CB 3.08Å; T474-R477 PolarHBondContact O-N 3.13Å; T474-R477 VanDerWaalsContact O-N 3.1Å; M475-R477 PolarHBondContact O-N 3.39Å; R477-L479 VanDerWaalsContact C-N 3.34Å; R477-L479 PolarHBondContact O-N 3.21Å; R477-R480 PolarHBondContact O-N 3.5Å; R477-R480 VanDerWaalsContact O-N 3.15Å; R477-Y481 HydrophobicContact CB-CE2 4.28Å; R477-Y481 WeakPolarHBondContact O-CD2 3.38Å; R477-Y481 PolarHBondContact O-N 3.22Å
478	A	94.5	Very high	94.7	Very high	30 Å²	30	70.6 Å²	70.6	25%	0.248	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-39.9	175.9	0	0	0	0	0	111.9	L421 M475 R480 Y481 Y482	L421-A478 HydrophobicContact CD2-CB 3.71Å; M475-A478 WeakPolarHBondContact O-CB 3.24Å; M475-A478 PolarHBondContact O-N 2.84Å; M475-A478 VanDerWaalsContact O-N 3.08Å; A478-R480 VanDerWaalsContact C-N 3.32Å; A478-R480 PolarHBondContact O-N 3.32Å; A478-Y481 PolarHBondContact O-N 2.67Å; A478-Y482 VanDerWaalsContact O-CG 3.31Å; A478-Y482 PolarHBondContact O-N 2.92Å; A478-Y482 VanDerWaalsContact O-N 3.07Å
479	L	96.2	Very high	94.9	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-40.3	172.7	-61.5	179.7	0	0	0	112.4	L421 L425 L451 Y472 M475 R477 Y482 Y483 L488 Y498	L421-L479 HydrophobicContact CD2-CD2 3.78Å; L421-L479 HydrophobicContact CD2-CG 4.04Å; L421-L479 HydrophobicContact CG-CD2 4.43Å; L425-L479 HydrophobicContact CD1-CD2 3.74Å; L451-L479 HydrophobicContact CD1-CD1 4.42Å; Y472-L479 HydrophobicContact CE2-CD1 4.39Å; M475-L479 PolarHBondContact O-N 3.49Å; R477-L479 VanDerWaalsContact C-N 3.34Å; R477-L479 PolarHBondContact O-N 3.21Å; L479-Y482 HydrophobicContact CD2-CD2 4.47Å; L479-Y482 PolarHBondContact O-N 3.41Å; L479-Y483 VanDerWaalsContact O-CD1 3.3Å; L479-Y483 WeakPolarHBondContact O-CD1 3.48Å; L479-Y483 WeakPolarHBondContact O-CE1 3.28Å; L479-L488 HydrophobicContact CD2-CD1 3.57Å; L479-Y498 HydrophobicContact CD1-CE1 4.38Å; L479-Y498 HydrophobicContact CD1-CE2 4.03Å
480	R	95.9	Very high	95	Very high	105 Å²	105	70.5 Å²	70.5	40%	0.396	34%	0.335	S	S	.	.	H	α-helix	trans	-66.7	-38.3	176.8	-68.2	164.2	-160.1	164.2	11.3	112.2	E473 G476 R477 A478 Y482 Y483	E473-R480 IonicContact OE1-NH2 2.97Å; E473-R480 IonicContact OE2-CZ 3.9Å; E473-R480 IonicContact OE2-NH1 2.69Å; E473-R480 IonicContact OE2-NH2 3.9Å; E473-R480 PolarHBondContact OE2-NH2 3.05Å; G476-R480 WeakPolarHBondContact O-CD 3.35Å; G476-R480 WeakPolarHBondContact O-CG 3.13Å; G476-R480 PolarHBondContact O-N 3.42Å; R477-R480 PolarHBondContact O-N 3.5Å; R477-R480 VanDerWaalsContact O-N 3.15Å; A478-R480 VanDerWaalsContact C-N 3.32Å; A478-R480 PolarHBondContact O-N 3.32Å; R480-Y482 VanDerWaalsContact C-N 3.32Å; R480-Y482 PolarHBondContact O-N 3.44Å; R480-Y483 HydrophobicContact CB-CE2 4.19Å; R480-Y483 HydrophobicContact CG-CE2 4.04Å; R480-Y483 WeakPolarHBondContact O-CD2 3.45Å; R480-Y483 PolarHBondContact O-N 3.5Å
481	Y	95.5	Very high	95.1	Very high	161 Å²	161	70.1 Å²	70.1	63%	0.631	33%	0.334	S	S	*	.	H	α-helix	trans	-67.3	-30.9	174.6	-63.8	-50.7	0	0	0	113.1	R477 A478 Y483 A484 Q485	R477-Y481 HydrophobicContact CB-CE2 4.28Å; R477-Y481 WeakPolarHBondContact O-CD2 3.38Å; R477-Y481 PolarHBondContact O-N 3.22Å; A478-Y481 PolarHBondContact O-N 2.67Å; Y481-Y483 PolarHBondContact O-N 2.94Å; Y481-A484 PolarHBondContact O-N 3.37Å; Y481-Q485 PolarHBondContact O-N 2.99Å
482	Y	95.1	Very high	94.9	Very high	24 Å²	24	75.7 Å²	75.7	9%	0.094	36%	0.355	C	S	.	.	H	α-helix	trans	-67.1	-12.2	176.5	-67.8	-21.1	0	0	0	114.8	L421 A478 L479 R480 N486 I487 L488	L421-Y482 HydrophobicContact CB-CE2 3.89Å; L421-Y482 HydrophobicContact CD2-CE2 4.39Å; L421-Y482 HydrophobicContact CG-CE2 4.32Å; L421-Y482 PolarHBondContact N-OH 2.92Å; L421-Y482 VanDerWaalsContact N-OH 3.14Å; A478-Y482 VanDerWaalsContact O-CG 3.31Å; A478-Y482 PolarHBondContact O-N 2.92Å; A478-Y482 VanDerWaalsContact O-N 3.07Å; L479-Y482 HydrophobicContact CD2-CD2 4.47Å; L479-Y482 PolarHBondContact O-N 3.41Å; R480-Y482 VanDerWaalsContact C-N 3.32Å; R480-Y482 PolarHBondContact O-N 3.44Å; Y482-N486 PolarHBondContact O-N 2.91Å; Y482-I487 HydrophobicContact CD1-CB 4.48Å; Y482-I487 HydrophobicContact CD1-CD1 3.92Å; Y482-I487 HydrophobicContact CE1-CD1 4.21Å; Y482-I487 HydrophobicContact CG-CB 4.31Å; Y482-I487 HydrophobicContact CG-CG2 4.36Å; Y482-I487 PolarHBondContact O-N 3.24Å; Y482-L488 HydrophobicContact CD2-CD1 3.87Å; Y482-L488 HydrophobicContact CD2-CG 4.26Å; Y482-L488 PolarHBondContact O-N 3Å; Y482-L488 VanDerWaalsContact O-N 3.1Å
483	Y	94.7	Very high	94.8	Very high	71 Å²	71	77.8 Å²	77.8	28%	0.278	39%	0.39	S	S	.	.	H	α-helix	trans	-70	-49.4	171.4	-50.2	-23.2	0	0	0	111.5	L479 R480 Y481 Q485 N486 L488 K490 Y498	L479-Y483 VanDerWaalsContact O-CD1 3.3Å; L479-Y483 WeakPolarHBondContact O-CD1 3.48Å; L479-Y483 WeakPolarHBondContact O-CE1 3.28Å; R480-Y483 HydrophobicContact CB-CE2 4.19Å; R480-Y483 HydrophobicContact CG-CE2 4.04Å; R480-Y483 WeakPolarHBondContact O-CD2 3.45Å; R480-Y483 PolarHBondContact O-N 3.5Å; Y481-Y483 PolarHBondContact O-N 2.94Å; Y483-Q485 PolarHBondContact O-N 3.42Å; Y483-N486 PolarHBondContact O-N 3.42Å; Y483-L488 WeakPolarHBondContact CA-O 3.16Å; Y483-L488 HydrophobicContact CD1-CB 4.49Å; Y483-L488 WeakPolarHBondContact CD1-O 3.43Å; Y483-K490 HydrophobicContact CE1-CB 3.87Å; Y483-K490 HydrophobicContact CE2-CB 4.22Å; Y483-Y498 HydrophobicContact CE1-CD1 4.39Å; Y483-Y498 HydrophobicContact CE1-CE1 4.44Å
484	A	91.6	Very high	94.8	Very high	96 Å²	96	77.6 Å²	77.6	79%	0.793	39%	0.389	S	S	*	.	H	α-helix	trans	-71.3	-20.1	179.5	0	0	0	0	0	113	Y481 N486	Y481-A484 PolarHBondContact O-N 3.37Å; A484-N486 VanDerWaalsContact C-N 3.34Å
485	Q	91.4	Very high	94.8	Very high	117 Å²	117	84.5 Å²	84.5	55%	0.547	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	2.8	175.5	-64.5	-178.6	-10.1	0	0	113.4	Y481 Y483 I487	Y481-Q485 PolarHBondContact O-N 2.99Å; Y483-Q485 PolarHBondContact O-N 3.42Å; Q485-I487 HydrophobicContact CB-CD1 3.96Å; Q485-I487 HydrophobicContact CB-CG1 4.05Å; Q485-I487 PolarHBondContact O-N 3.01Å; Q485-I487 VanDerWaalsContact O-N 3.15Å
486	N	92.2	Very high	94.9	Very high	115 Å²	115	86.7 Å²	86.7	62%	0.615	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	31.4	-174.9	-63.9	-36.4	0	0	0	114.2	Y482 Y483 A484 L501	Y482-N486 PolarHBondContact O-N 2.91Å; Y483-N486 PolarHBondContact O-N 3.42Å; A484-N486 VanDerWaalsContact C-N 3.34Å; N486-L501 HydrophobicContact CB-CD1 4.21Å; N486-L501 WeakPolarHBondContact O-CB 3.36Å; N486-L501 WeakPolarHBondContact O-CD1 3.37Å
487	I	92.1	Very high	94.9	Very high	31 Å²	31	86.8 Å²	86.8	16%	0.159	42%	0.419	C	S	.	.	S	Bend	trans	-93	-39.4	175.8	-62.5	172.6	0	0	0	110.5	Y482 Q485 L501 F504	Y482-I487 HydrophobicContact CD1-CB 4.48Å; Y482-I487 HydrophobicContact CD1-CD1 3.92Å; Y482-I487 HydrophobicContact CE1-CD1 4.21Å; Y482-I487 HydrophobicContact CG-CB 4.31Å; Y482-I487 HydrophobicContact CG-CG2 4.36Å; Y482-I487 PolarHBondContact O-N 3.24Å; Q485-I487 HydrophobicContact CB-CD1 3.96Å; Q485-I487 HydrophobicContact CB-CG1 4.05Å; Q485-I487 PolarHBondContact O-N 3.01Å; Q485-I487 VanDerWaalsContact O-N 3.15Å; I487-L501 PolarHBondContact O-N 3.37Å; I487-F504 HydrophobicContact CG2-CD2 4.08Å
488	L	94.7	Very high	95	Very high	1 Å²	1	80.5 Å²	80.5	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149.4	177.4	-68.4	-177	0	0	0	110.8	F449 L479 Y482 Y483 Q499 F500	F449-L488 HydrophobicContact CE1-CD2 3.8Å; F449-L488 HydrophobicContact CZ-CD1 4.42Å; F449-L488 HydrophobicContact CZ-CD2 4.13Å; L479-L488 HydrophobicContact CD2-CD1 3.57Å; Y482-L488 HydrophobicContact CD2-CD1 3.87Å; Y482-L488 HydrophobicContact CD2-CG 4.26Å; Y482-L488 PolarHBondContact O-N 3Å; Y482-L488 VanDerWaalsContact O-N 3.1Å; Y483-L488 WeakPolarHBondContact CA-O 3.16Å; Y483-L488 HydrophobicContact CD1-CB 4.49Å; Y483-L488 WeakPolarHBondContact CD1-O 3.43Å; L488-Q499 CarbonylContact C-O 3.52Å; L488-Q499 VanDerWaalsContact CA-O 3.29Å; L488-Q499 WeakPolarHBondContact CA-O 3.38Å; L488-F500 HydrophobicContact CD2-CB 4.4Å; L488-F500 HydrophobicContact CD2-CD1 3.47Å; L488-F500 VanDerWaalsContact CD2-CD1 3.47Å; L488-F500 HydrophobicContact CD2-CD2 4.31Å; L488-F500 HydrophobicContact CD2-CE1 3.75Å; L488-F500 HydrophobicContact CD2-CG 3.78Å; L488-F500 HydrophobicContact CD2-CZ 4.27Å
489	R	95.1	Very high	95	Very high	139 Å²	139	80.3 Å²	80.3	53%	0.525	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.1	164.9	-175.6	-176.4	-68.4	157.5	-7.9	109.4	Y498 Q499 L501	R489-Y498 CarbonylContact O-C 3.58Å; R489-Y498 WeakPolarHBondContact O-CA 3.47Å; R489-Q499 HydrophobicContact CB-CB 4.29Å; R489-Q499 PolarHBondContact N-O 3.38Å; R489-Q499 VanDerWaalsContact NH1-OE1 3.14Å; R489-Q499 PolarHBondContact O-N 3.16Å; R489-L501 HydrophobicContact CB-CD1 4.41Å; R489-L501 HydrophobicContact CB-CD2 4.23Å; R489-L501 HydrophobicContact CB-CG 4.41Å
490	K	95.7	Very high	95	Very high	122 Å²	122	80.4 Å²	80.4	53%	0.53	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	128.1	169.5	-173.5	-170.3	171.8	-167.7	0	109.5	Y483 Y498	Y483-K490 HydrophobicContact CE1-CB 3.87Å; Y483-K490 HydrophobicContact CE2-CB 4.22Å; K490-Y498 HydrophobicContact CG-CE1 4.36Å
491	V	96	Very high	94.7	Very high	24 Å²	24	76.7 Å²	76.7	15%	0.145	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-72.8	128.8	172.9	-177.9	0	0	0	0	109	M448 Q494 V497	M448-V491 HydrophobicContact CE-CG1 4.48Å; M448-V491 HydrophobicContact CE-CG2 4.16Å; M448-V491 HydrophobicContact CG-CG2 4.36Å; M448-V491 HydrophobicContact SD-CG2 4.28Å; V491-Q494 HydrophobicContact CB-CB 4.42Å; V491-Q494 HydrophobicContact CG1-CB 4.06Å; V491-Q494 HydrophobicContact CG1-CG 3.94Å; V491-V497 HydrophobicContact CB-CB 4.28Å; V491-V497 HydrophobicContact CB-CG1 4.14Å; V491-V497 HydrophobicContact CG2-CB 4.44Å; V491-V497 HydrophobicContact CG2-CG1 3.84Å; V491-V497 PolarHBondContact N-O 3.41Å
492	K	95	Very high	93.5	Very high	197 Å²	197	75.5 Å²	75.5	86%	0.857	38%	0.377	S	S	*	.	S	Bend	trans	-71.6	150.7	176.4	-68.8	-178	179.7	177.7	0	109.8	Q494	K492-Q494 PolarHBondContact O-N 2.98Å
493	G	95.3	Very high	91.9	Very high	89 Å²	89	78.6 Å²	78.6	92%	0.918	40%	0.396	S	S	*	.	S	Bend	trans	72.6	-37.4	-176.2	0	0	0	0	0	115.5
494	Q	95.5	Very high	90.2	Very high	88 Å²	88	76 Å²	76	41%	0.411	39%	0.386	S	S	.	.			trans	-88.3	131.7	-173.3	-57.6	-169.9	19	0	0	113.2	V491 K492 V497	V491-Q494 HydrophobicContact CB-CB 4.42Å; V491-Q494 HydrophobicContact CG1-CB 4.06Å; V491-Q494 HydrophobicContact CG1-CG 3.94Å; K492-Q494 PolarHBondContact O-N 2.98Å; Q494-V497 HydrophobicContact CB-CB 3.82Å; Q494-V497 HydrophobicContact CB-CG2 3.77Å
495	R	96.4	Very high	88.4	Confident	221 Å²	221	74.6 Å²	74.6	83%	0.834	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	132.4	176.6	-69.2	179.7	68.8	-176.7	1	110.8	V497	R495-V497 PolarHBondContact O-N 3.45Å
496	L	96.9	Very high	86.4	Confident	48 Å²	48	75.5 Å²	75.5	25%	0.251	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	17.4	178.2	-54.5	175.7	0	0	0	115.3	K450 L451 Y472	K450-L496 WeakPolarHBondContact CA-O 3.42Å; L451-L496 HydrophobicContact CB-CB 4.2Å; L451-L496 PolarHBondContact N-O 3Å; L451-L496 WeakPolarHBondContact O-CD1 3.39Å; Y472-L496 HydrophobicContact CE1-CD2 3.98Å; Y472-L496 HydrophobicContact CE2-CD2 3.74Å; Y472-L496 VanDerWaalsContact CZ-CD2 3.43Å; Y472-L496 WeakPolarHBondContact OH-CD2 3.35Å
497	V	97.2	Very high	84.4	Confident	4 Å²	4	74.7 Å²	74.7	2%	0.024	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.7	178	-172.4	0	0	0	0	111.1	V442 M448 F449 K450 V491 Q494 R495	V442-V497 HydrophobicContact CG2-CG1 4.15Å; M448-V497 HydrophobicContact CE-CG1 4.23Å; F449-V497 WeakPolarHBondContact O-CA 3.22Å; F449-V497 WeakPolarHBondContact O-CG1 3.38Å; K450-V497 HydrophobicContact CB-CG2 3.99Å; K450-V497 HydrophobicContact CD-CG2 4.14Å; K450-V497 HydrophobicContact CG-CG2 3.91Å; V491-V497 HydrophobicContact CB-CB 4.28Å; V491-V497 HydrophobicContact CB-CG1 4.14Å; V491-V497 HydrophobicContact CG2-CB 4.44Å; V491-V497 HydrophobicContact CG2-CG1 3.84Å; V491-V497 PolarHBondContact N-O 3.41Å; Q494-V497 HydrophobicContact CB-CB 3.82Å; Q494-V497 HydrophobicContact CB-CG2 3.77Å; R495-V497 PolarHBondContact O-N 3.45Å
498	Y	97.3	Very high	82.4	Confident	8 Å²	8	76.9 Å²	76.9	3%	0.031	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	160.8	-176.1	-56.2	-79.9	0	0	0	109.8	M448 F449 L451 Y472 L479 Y483 R489 K490	M448-Y498 CarbonylContact C-O 3.51Å; M448-Y498 WeakPolarHBondContact CA-O 3.39Å; F449-Y498 AromaticContact CE2-CD2 3.98Å; F449-Y498 HydrophobicContact CE2-CD2 3.98Å; F449-Y498 HydrophobicContact CE2-CG 4.44Å; F449-Y498 HydrophobicContact CZ-CD2 4.18Å; F449-Y498 HydrophobicContact CZ-CG 4.2Å; F449-Y498 PolarHBondContact N-O 3.12Å; F449-Y498 PolarHBondContact O-N 3.16Å; L451-Y498 HydrophobicContact CD1-CE2 4.1Å; L451-Y498 HydrophobicContact CG-CE2 4.28Å; Y472-Y498 PolarHBondContact OH-OH 3.43Å; L479-Y498 HydrophobicContact CD1-CE1 4.38Å; L479-Y498 HydrophobicContact CD1-CE2 4.03Å; Y483-Y498 HydrophobicContact CE1-CD1 4.39Å; Y483-Y498 HydrophobicContact CE1-CE1 4.44Å; R489-Y498 CarbonylContact O-C 3.58Å; R489-Y498 WeakPolarHBondContact O-CA 3.47Å; K490-Y498 HydrophobicContact CG-CE1 4.36Å
499	Q	95.6	Very high	79.7	Confident	26 Å²	26	83.7 Å²	83.7	12%	0.121	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129	176.5	174	172	51.8	0	0	108.3	Q446 N447 M448 L488 R489	Q446-Q499 WeakPolarHBondContact O-CG 3.45Å; Q446-Q499 PolarHBondContact O-NE2 2.88Å; N447-Q499 WeakPolarHBondContact O-CA 3.33Å; M448-Q499 HydrophobicContact CG-CB 3.9Å; M448-Q499 HydrophobicContact CG-CG 4.17Å; L488-Q499 CarbonylContact C-O 3.52Å; L488-Q499 VanDerWaalsContact CA-O 3.29Å; L488-Q499 WeakPolarHBondContact CA-O 3.38Å; R489-Q499 HydrophobicContact CB-CB 4.29Å; R489-Q499 PolarHBondContact N-O 3.38Å; R489-Q499 VanDerWaalsContact NH1-OE1 3.14Å; R489-Q499 PolarHBondContact O-N 3.16Å
500	F	95	Very high	76.6	Confident	2 Å²	2	82.5 Å²	82.5	1%	0.009	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.4	163.7	-71.3	-88.9	0	0	0	109.2	L425 Y426 L429 W441 N447 F449 L488 F504	L425-F500 HydrophobicContact CB-CZ 4.38Å; Y426-F500 HydrophobicContact CD2-CE2 4.35Å; Y426-F500 HydrophobicContact CD2-CZ 4.46Å; L429-F500 HydrophobicContact CD1-CE2 3.9Å; W441-F500 HydrophobicContact CH2-CD2 4.13Å; W441-F500 HydrophobicContact CH2-CE2 4.3Å; W441-F500 HydrophobicContact CZ3-CD2 4.24Å; N447-F500 HydrophobicContact CB-CB 4.14Å; N447-F500 WeakPolarHBondContact CB-O 3.34Å; N447-F500 PolarHBondContact O-N 2.83Å; F449-F500 AromaticContact CD1-CD2 3.55Å; F449-F500 HydrophobicContact CD1-CD2 3.55Å; F449-F500 AromaticContact CD1-CE2 3.45Å; F449-F500 HydrophobicContact CD1-CE2 3.45Å; F449-F500 VanDerWaalsContact CD1-CE2 3.45Å; F449-F500 HydrophobicContact CD1-CZ 4.49Å; F449-F500 AromaticContact CE1-CD2 3.43Å; F449-F500 HydrophobicContact CE1-CD2 3.43Å; F449-F500 VanDerWaalsContact CE1-CD2 3.43Å; F449-F500 AromaticContact CE1-CE2 3.21Å; F449-F500 HydrophobicContact CE1-CE2 3.21Å; F449-F500 HydrophobicContact CE1-CG 4.24Å; F449-F500 AromaticContact CE1-CZ 3.87Å; F449-F500 HydrophobicContact CE1-CZ 3.87Å; F449-F500 HydrophobicContact CG-CE2 4.34Å; F449-F500 AromaticContact CZ-CE2 3.94Å; F449-F500 HydrophobicContact CZ-CE2 3.94Å; F449-F500 HydrophobicContact CZ-CZ 4.24Å; L488-F500 HydrophobicContact CD2-CB 4.4Å; L488-F500 HydrophobicContact CD2-CD1 3.47Å; L488-F500 VanDerWaalsContact CD2-CD1 3.47Å; L488-F500 HydrophobicContact CD2-CD2 4.31Å; L488-F500 HydrophobicContact CD2-CE1 3.75Å; L488-F500 HydrophobicContact CD2-CG 3.78Å; L488-F500 HydrophobicContact CD2-CZ 4.27Å; F500-F504 HydrophobicContact CD1-CB 4.45Å; F500-F504 AromaticContact CD1-CD1 3.72Å; F500-F504 HydrophobicContact CD1-CD1 3.72Å; F500-F504 HydrophobicContact CD1-CE1 4.14Å; F500-F504 AromaticContact CD1-CG 3.99Å; F500-F504 HydrophobicContact CD1-CG 3.99Å; F500-F504 AromaticContact CE1-CD1 3.99Å; F500-F504 HydrophobicContact CE1-CD1 3.99Å; F500-F504 AromaticContact CE1-CE1 3.91Å; F500-F504 HydrophobicContact CE1-CE1 3.91Å; F500-F504 HydrophobicContact CE1-CG 4.47Å; F500-F504 HydrophobicContact CE1-CZ 4.32Å; F500-F504 HydrophobicContact CG-CD1 4.5Å
501	L	91.6	Very high	73.8	Confident	27 Å²	27	81.3 Å²	81.3	14%	0.141	42%	0.419	C	S	.	.			trans	-92.3	144.5	173.8	-63.5	169	0	0	0	109.1	N486 I487 R489 D503 F504	N486-L501 HydrophobicContact CB-CD1 4.21Å; N486-L501 WeakPolarHBondContact O-CB 3.36Å; N486-L501 WeakPolarHBondContact O-CD1 3.37Å; I487-L501 PolarHBondContact O-N 3.37Å; R489-L501 HydrophobicContact CB-CD1 4.41Å; R489-L501 HydrophobicContact CB-CD2 4.23Å; R489-L501 HydrophobicContact CB-CG 4.41Å; L501-D503 VanDerWaalsContact C-N 3.25Å; L501-D503 PolarHBondContact O-N 3.34Å; L501-D503 VanDerWaalsContact O-N 3.08Å; L501-F504 WeakPolarHBondContact O-CB 3.49Å; L501-F504 PolarHBondContact O-N 3.25Å
502	E	69	Low	71.1	Confident	136 Å²	136	84.9 Å²	84.9	64%	0.636	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-29.4	-158.4	-61.9	179.6	162.8	0	0	114.8	F504 H505	E502-F504 PolarHBondContact O-N 3.33Å; E502-F504 VanDerWaalsContact O-N 3.08Å; E502-H505 PolarHBondContact O-N 3.03Å
503	D	60.9	Low	68.6	Low	89 Å²	89	79.8 Å²	79.8	48%	0.476	43%	0.426	S	S	.	.	H	α-helix	trans	-62.6	-15.7	177.8	-57.3	-48.9	0	0	0	113.4	L501 H505 K506 T507	L501-D503 VanDerWaalsContact C-N 3.25Å; L501-D503 PolarHBondContact O-N 3.34Å; L501-D503 VanDerWaalsContact O-N 3.08Å; D503-H505 VanDerWaalsContact C-N 3.26Å; D503-H505 PolarHBondContact O-N 3.11Å; D503-K506 PolarHBondContact O-N 3.43Å; D503-K506 WeakPolarHBondContact OD1-CD 3.2Å; D503-K506 WeakPolarHBondContact OD1-CE 3.47Å; D503-K506 IonicContact OD1-NZ 3.57Å; D503-K506 PolarHBondContact OD1-NZ 3.07Å; D503-T507 WeakPolarHBondContact O-CG2 3.33Å; D503-T507 PolarHBondContact O-N 2.75Å; D503-T507 PolarHBondContact O-OG1 3.2Å; D503-T507 VanDerWaalsContact O-OG1 3.13Å
504	F	60.6	Low	66.1	Low	16 Å²	16	79.5 Å²	79.5	7%	0.07	41%	0.407	C	S	.	.	H	α-helix	trans	-61.3	-33.8	170.3	-168.6	-107.8	0	0	0	112.4	Q423 Y426 I487 F500 L501 E502 T507 Q508	Q423-F504 HydrophobicContact CB-CZ 4.48Å; Q423-F504 HydrophobicContact CG-CE2 4.23Å; Q423-F504 HydrophobicContact CG-CZ 3.89Å; Y426-F504 HydrophobicContact CD1-CE1 4.36Å; Y426-F504 HydrophobicContact CD2-CE1 4.36Å; Y426-F504 AromaticContact CG-CE1 3.98Å; Y426-F504 HydrophobicContact CG-CE1 3.98Å; I487-F504 HydrophobicContact CG2-CD2 4.08Å; F500-F504 HydrophobicContact CD1-CB 4.45Å; F500-F504 AromaticContact CD1-CD1 3.72Å; F500-F504 HydrophobicContact CD1-CD1 3.72Å; F500-F504 HydrophobicContact CD1-CE1 4.14Å; F500-F504 AromaticContact CD1-CG 3.99Å; F500-F504 HydrophobicContact CD1-CG 3.99Å; F500-F504 AromaticContact CE1-CD1 3.99Å; F500-F504 HydrophobicContact CE1-CD1 3.99Å; F500-F504 AromaticContact CE1-CE1 3.91Å; F500-F504 HydrophobicContact CE1-CE1 3.91Å; F500-F504 HydrophobicContact CE1-CG 4.47Å; F500-F504 HydrophobicContact CE1-CZ 4.32Å; F500-F504 HydrophobicContact CG-CD1 4.5Å; L501-F504 WeakPolarHBondContact O-CB 3.49Å; L501-F504 PolarHBondContact O-N 3.25Å; E502-F504 PolarHBondContact O-N 3.33Å; E502-F504 VanDerWaalsContact O-N 3.08Å; F504-T507 PolarHBondContact O-OG1 3.03Å; F504-Q508 HydrophobicContact CE1-CG 4.35Å; F504-Q508 HydrophobicContact CZ-CG 4.24Å; F504-Q508 WeakPolarHBondContact O-CG 3.29Å
505	H	53.7	Low	63.6	Low	66 Å²	66	81.6 Å²	81.6	31%	0.306	42%	0.42	S	S	.	.	H	α-helix	trans	-75.2	-43.5	179	-68.2	-96.3	0	0	0	111.7	Y426 E502 D503 T507 Q508 H509	Y426-H505 AromaticContact CE2-CE1 3.67Å; Y426-H505 AromaticContact CZ-CE1 3.79Å; Y426-H505 PolarHBondContact OH-CE1 3.2Å; E502-H505 PolarHBondContact O-N 3.03Å; D503-H505 VanDerWaalsContact C-N 3.26Å; D503-H505 PolarHBondContact O-N 3.11Å; H505-T507 PolarHBondContact O-N 2.99Å; H505-T507 VanDerWaalsContact O-N 3.07Å; H505-Q508 PolarHBondContact O-N 3.35Å; H505-Q508 VanDerWaalsContact O-N 3.15Å; H505-H509 PolarHBondContact O-N 3.49Å
506	K	49.3	Very low	61.1	Low	136 Å²	136	75.7 Å²	75.7	59%	0.591	40%	0.404	S	S	*	.	H	α-helix	trans	-58.3	-22.2	178.8	-55.9	175.8	-165.9	161.4	0	113.6	D503	D503-K506 PolarHBondContact O-N 3.43Å; D503-K506 WeakPolarHBondContact OD1-CD 3.2Å; D503-K506 WeakPolarHBondContact OD1-CE 3.47Å; D503-K506 IonicContact OD1-NZ 3.57Å; D503-K506 PolarHBondContact OD1-NZ 3.07Å
507	T	50.1	Low	58.5	Low	98 Å²	98	79.9 Å²	79.9	60%	0.601	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-5.8	-177.6	56.6	0	0	0	0	114.8	D503 F504 H505	D503-T507 WeakPolarHBondContact O-CG2 3.33Å; D503-T507 PolarHBondContact O-N 2.75Å; D503-T507 PolarHBondContact O-OG1 3.2Å; D503-T507 VanDerWaalsContact O-OG1 3.13Å; F504-T507 PolarHBondContact O-OG1 3.03Å; H505-T507 PolarHBondContact O-N 2.99Å; H505-T507 VanDerWaalsContact O-N 3.07Å
508	Q	50.1	Low	55.8	Low	78 Å²	78	87.6 Å²	87.6	36%	0.364	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-23.4	176.2	-60.7	-50.4	-79	0	0	113.2	F504 H505	F504-Q508 HydrophobicContact CE1-CG 4.35Å; F504-Q508 HydrophobicContact CZ-CG 4.24Å; F504-Q508 WeakPolarHBondContact O-CG 3.29Å; H505-Q508 PolarHBondContact O-N 3.35Å; H505-Q508 VanDerWaalsContact O-N 3.15Å
509	H	37	Very low	53.3	Low	143 Å²	143	93.1 Å²	93.1	66%	0.662	48%	0.479	S	S	*	.			trans	-132.9	116.5	168.3	-64.9	-97.2	0	0	0	109	H505 T511	H505-H509 PolarHBondContact O-N 3.49Å; H509-T511 PolarHBondContact O-N 2.95Å
510	P	30.3	Very low	50.7	Low	115 Å²	115	99.2 Å²	99.2	75%	0.747	51%	0.505	S	S	*	.			trans	-65.4	113.8	156.4	28.8	-30.2	0	0	0	106.6	T512	P510-T512 PolarHBondContact O-N 2.94Å
511	T	36.4	Very low	48.5	Very low	97 Å²	97	106.9 Å²	106.9	60%	0.595	54%	0.54	S	S	*	.			trans	-61.4	110.5	177	16.7	0	0	0	0	109	H509 T513 T514	H509-T511 PolarHBondContact O-N 2.95Å; T511-T513 PolarHBondContact O-N 3.31Å; T511-T514 PolarHBondContact O-N 3.2Å
512	T	39.3	Very low	46.5	Very low	98 Å²	98	112.1 Å²	112.1	60%	0.601	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-23.5	-173.8	-35.2	0	0	0	0	112.7	P510 T514 L515 L516	P510-T512 PolarHBondContact O-N 2.94Å; T512-T514 PolarHBondContact O-N 3.12Å; T512-L515 PolarHBondContact O-N 3.26Å; T512-L515 VanDerWaalsContact O-N 3.16Å; T512-L516 PolarHBondContact O-N 3.39Å
513	T	42.3	Very low	45.4	Very low	90 Å²	90	112.7 Å²	112.7	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-36.8	-49.8	164.9	-38.8	0	0	0	0	113.2	T511 L515 L516 Q517	T511-T513 PolarHBondContact O-N 3.31Å; T513-L515 PolarHBondContact O-N 2.89Å; T513-L516 PolarHBondContact O-N 3.02Å; T513-Q517 WeakPolarHBondContact O-CB 3.01Å; T513-Q517 PolarHBondContact O-N 3.3Å
514	T	44.7	Very low	44.6	Very low	84 Å²	84	116.3 Å²	116.3	52%	0.515	60%	0.602	S	S	.	*	H	α-helix	trans	-71.8	-33.6	-173.3	-45.4	0	0	0	0	112.9	T511 T512 Y518	T511-T514 PolarHBondContact O-N 3.2Å; T512-T514 PolarHBondContact O-N 3.12Å; T514-Y518 PolarHBondContact O-N 2.8Å; T514-Y518 VanDerWaalsContact O-N 3.14Å
515	L	43	Very low	43.8	Very low	131 Å²	131	121.3 Å²	121.3	69%	0.686	63%	0.629	S	S	*	*	H	α-helix	trans	-76.7	-32.4	174.8	-78.1	178.1	0	0	0	112.2	T512 T513 Y518 H519	T512-L515 PolarHBondContact O-N 3.26Å; T512-L515 VanDerWaalsContact O-N 3.16Å; T513-L515 PolarHBondContact O-N 2.89Å; L515-Y518 PolarHBondContact O-N 2.86Å; L515-H519 WeakPolarHBondContact O-CB 3.24Å; L515-H519 PolarHBondContact O-N 2.69Å
516	L	42.9	Very low	43.3	Very low	98 Å²	98	124.2 Å²	124.2	51%	0.513	65%	0.646	S	S	.	*	H	α-helix	trans	-67.4	-40.3	171	-69.7	172	0	0	0	111.1	T512 T513 Y518 H519 F520	T512-L516 PolarHBondContact O-N 3.39Å; T513-L516 PolarHBondContact O-N 3.02Å; L516-Y518 VanDerWaalsContact C-N 3.33Å; L516-Y518 PolarHBondContact O-N 3.39Å; L516-H519 PolarHBondContact O-N 2.99Å; L516-F520 WeakPolarHBondContact O-CD2 3.27Å; L516-F520 PolarHBondContact O-N 3.18Å
517	Q	42.3	Very low	42.9	Very low	136 Å²	136	123.6 Å²	123.6	64%	0.636	65%	0.649	S	S	*	*	H	α-helix	trans	-55.8	-47.2	172.6	-153.5	78.5	16.2	0	0	111.3	T513 H521	T513-Q517 WeakPolarHBondContact O-CB 3.01Å; T513-Q517 PolarHBondContact O-N 3.3Å; Q517-H521 WeakPolarHBondContact O-CB 3.11Å; Q517-H521 PolarHBondContact O-N 2.87Å
518	Y	41.2	Very low	42.5	Very low	165 Å²	165	125.1 Å²	125.1	65%	0.647	65%	0.652	S	S	*	*	H	α-helix	trans	-67.9	-33.7	177	-100.5	-92.9	0	0	0	113.9	T514 L515 L516	T514-Y518 PolarHBondContact O-N 2.8Å; T514-Y518 VanDerWaalsContact O-N 3.14Å; L515-Y518 PolarHBondContact O-N 2.86Å; L516-Y518 VanDerWaalsContact C-N 3.33Å; L516-Y518 PolarHBondContact O-N 3.39Å
519	H	43.4	Very low	42	Very low	125 Å²	125	128 Å²	128	58%	0.579	67%	0.67	S	S	*	*	H	α-helix	trans	-79.3	-28.4	-179.2	-160.1	-51.2	0	0	0	112.8	L515 L516 H523	L515-H519 WeakPolarHBondContact O-CB 3.24Å; L515-H519 PolarHBondContact O-N 2.69Å; L516-H519 PolarHBondContact O-N 2.99Å; H519-H523 AromaticContact CE1-CD2 3.87Å
520	F	42.6	Very low	42.4	Very low	154 Å²	154	127 Å²	127	68%	0.675	67%	0.67	S	S	*	*	H	α-helix	trans	-74.2	-38.8	170.8	-90.9	-85.2	0	0	0	111.9	L516 L522 H523	L516-F520 WeakPolarHBondContact O-CD2 3.27Å; L516-F520 PolarHBondContact O-N 3.18Å; F520-L522 PolarHBondContact O-N 3.11Å; F520-L522 VanDerWaalsContact O-N 3.12Å; F520-H523 PolarHBondContact O-N 3.4Å; F520-H523 VanDerWaalsContact O-N 3.16Å
521	H	47.3	Very low	43.2	Very low	162 Å²	162	127.9 Å²	127.9	75%	0.75	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	10.8	-177.1	-143.5	49.5	0	0	0	115.1	Q517	Q517-H521 WeakPolarHBondContact O-CB 3.11Å; Q517-H521 PolarHBondContact O-N 2.87Å
522	L	49.8	Very low	43.8	Very low	138 Å²	138	130.2 Å²	130.2	72%	0.723	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	11.9	169.6	-67	177.9	0	0	0	112.4	F520	F520-L522 PolarHBondContact O-N 3.11Å; F520-L522 VanDerWaalsContact O-N 3.12Å
523	H	46.6	Very low	44.1	Very low	148 Å²	148	132.9 Å²	132.9	69%	0.685	68%	0.676	S	S	*	*			trans	-134.5	23.8	-178.7	-97.8	-82.2	0	0	0	112.6	H519 F520	H519-H523 AromaticContact CE1-CD2 3.87Å; F520-H523 PolarHBondContact O-N 3.4Å; F520-H523 VanDerWaalsContact O-N 3.16Å
524	S	43.8	Very low	44.3	Very low	164 Å²	164	136.8 Å²	136.8	100%	1.147	69%	0.687	S	S	*	*			trans	-144.7	0	168	-61.5	0	0	0	0	108.8

Retrieved 524 of 524 residues in 441.8 ms (Link to these results)

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