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2-oxoglutarate and iron-dependent oxygenase JMJD4 homolog

Catalyzes the 2-oxoglutarate and iron-dependent C4-lysyl hydroxylation of eRF1 thereby promoting the translational termination efficiency of eRF1 (By similarity). May be involved in regulation of chromatin structure, promoting expansion of heterochromatin¹.

AlphaFold DB , UniProt , Accession Q9VJ97, Species DROME (Drosophila melanogaster, Fruit fly), Gene JMJD4, Length 425 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	51.7	Low	241 Å²	241	129.5 Å²	129.5	100%	1.187	70%	0.698	S	S	*	*				0	124.9	0	-66.5	-172.9	-134.8	0	0	105.5	S3	M1-S3 PolarHBondContact O-N 3.44Å
2	A	33.8	Very low	55.2	Low	96 Å²	96	118.7 Å²	118.7	79%	0.793	64%	0.64	S	S	*	*			trans	-56.8	116.4	176	0	0	0	0	0	107.2	E4	A2-E4 PolarHBondContact O-N 3.42Å
3	S	33.2	Very low	58.2	Low	108 Å²	108	116.9 Å²	116.9	76%	0.755	63%	0.625	S	S	*	*			trans	-64.3	95	158	50.2	0	0	0	0	104.4	M1 E5	M1-S3 PolarHBondContact O-N 3.44Å; S3-E5 VanDerWaalsContact C-N 3.35Å; S3-E5 PolarHBondContact O-N 2.86Å
4	E	39	Very low	60.9	Low	173 Å²	173	108.6 Å²	108.6	81%	0.808	58%	0.58	S	S	*	*			trans	-51.6	112.1	159.6	-73.1	178	165.4	0	0	104.9	A2 R6	A2-E4 PolarHBondContact O-N 3.42Å; E4-R6 VanDerWaalsContact C-N 3.34Å; E4-R6 PolarHBondContact O-N 3.16Å
5	E	29.4	Very low	63.2	Low	186 Å²	186	105.5 Å²	105.5	87%	0.869	56%	0.561	S	S	*	*			trans	-51.6	106.4	168.8	-73	175	151.6	0	0	105.2	S3 D7	S3-E5 VanDerWaalsContact C-N 3.35Å; S3-E5 PolarHBondContact O-N 2.86Å; E5-D7 PolarHBondContact O-N 2.9Å
6	R	46.7	Very low	65.2	Low	188 Å²	188	103.6 Å²	103.6	71%	0.709	56%	0.556	S	S	*	*			trans	-58.3	127	173.4	-64.6	-176.2	-149.9	175	6.9	105.5	E4 G8	E4-R6 VanDerWaalsContact C-N 3.34Å; E4-R6 PolarHBondContact O-N 3.16Å; R6-G8 PolarHBondContact O-N 2.96Å
7	D	48	Very low	66.8	Low	148 Å²	148	100.4 Å²	100.4	79%	0.791	54%	0.537	S	S	*	.	S	Bend	trans	-63.2	87.6	-177.6	-146.2	8.7	0	0	0	108.4	E5	E5-D7 PolarHBondContact O-N 2.9Å
8	G	55.1	Low	67.8	Low	41 Å²	41	103.8 Å²	103.8	42%	0.423	55%	0.549	S	S	.	.			trans	57.3	107.2	168.4	0	0	0	0	0	117.6	R6 V10 S377	R6-G8 PolarHBondContact O-N 2.96Å; G8-V10 VanDerWaalsContact C-N 3.29Å; G8-V10 PolarHBondContact O-N 2.91Å; G8-S377 VanDerWaalsContact O-O 3.1Å
9	D	69.5	Low	68.2	Low	98 Å²	98	103.7 Å²	103.7	52%	0.524	55%	0.553	S	S	.	*			trans	-64.2	88.1	160.1	-65.7	-18.8	0	0	0	109.3	L11 L373 T379	D9-L11 PolarHBondContact O-N 3.07Å; D9-L373 HydrophobicContact CB-CD2 4.43Å; D9-L373 WeakPolarHBondContact OD1-CD2 3.33Å; D9-T379 HydrophobicContact CB-CG2 4.12Å
10	V	88.3	Confident	68.4	Low	69 Å²	69	103.9 Å²	103.9	42%	0.418	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.9	117	177.9	178.6	0	0	0	0	108.3	G8 L12 S377 Y378 T379	G8-V10 VanDerWaalsContact C-N 3.29Å; G8-V10 PolarHBondContact O-N 2.91Å; V10-L12 PolarHBondContact O-N 2.88Å; V10-S377 PolarHBondContact N-O 3.42Å; V10-Y378 HydrophobicContact CB-CD1 3.69Å; V10-Y378 HydrophobicContact CB-CE1 3.79Å; V10-Y378 HydrophobicContact CG1-CD1 4.04Å; V10-Y378 HydrophobicContact CG1-CE1 4.01Å; V10-Y378 HydrophobicContact CG2-CE1 4.35Å; V10-Y378 WeakPolarHBondContact O-CA 3.39Å; V10-T379 PolarHBondContact O-N 3.01Å
11	L	91.5	Very high	68.4	Low	76 Å²	76	104.8 Å²	104.8	40%	0.398	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.3	119.3	176.8	-174.7	64	0	0	0	110.4	D9 Q13 N381	D9-L11 PolarHBondContact O-N 3.07Å; L11-Q13 VanDerWaalsContact C-N 3.29Å; L11-Q13 VanDerWaalsContact CD2-OE1 3.26Å; L11-Q13 PolarHBondContact O-N 2.96Å; L11-N381 HydrophobicContact CD1-CB 3.97Å; L11-N381 HydrophobicContact CD2-CB 4.37Å; L11-N381 HydrophobicContact CG-CB 4.36Å
12	L	93.7	Very high	69.8	Low	0 Å²	0	100.2 Å²	100.2	0%	0	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	88.1	165.6	-55.3	-175.2	0	0	0	108.2	V10 L14 Y38 K178 A181 L374 Y378 T379 M380	V10-L12 PolarHBondContact O-N 2.88Å; L12-L14 PolarHBondContact O-N 3.1Å; L12-Y38 HydrophobicContact CB-CD1 4.05Å; L12-Y38 HydrophobicContact CB-CE1 3.97Å; L12-Y38 HydrophobicContact CB-CE2 4.43Å; L12-Y38 HydrophobicContact CB-CG 4.33Å; L12-Y38 HydrophobicContact CD1-CE2 4.22Å; L12-Y38 HydrophobicContact CD2-CD2 3.94Å; L12-Y38 HydrophobicContact CD2-CE2 4.1Å; L12-Y38 HydrophobicContact CD2-CG 4.34Å; L12-Y38 HydrophobicContact CG-CE2 4.48Å; L12-K178 HydrophobicContact CD2-CB 3.96Å; L12-K178 WeakPolarHBondContact CD2-O 3.31Å; L12-A181 HydrophobicContact CD1-CB 3.95Å; L12-A181 HydrophobicContact CD2-CB 4.38Å; L12-L374 HydrophobicContact CD1-CD1 3.74Å; L12-Y378 HydrophobicContact CD2-CD1 3.67Å; L12-Y378 HydrophobicContact CD2-CE1 4.45Å; L12-Y378 HydrophobicContact CD2-CG 4.11Å; L12-Y378 HydrophobicContact CG-CD1 4.43Å; L12-T379 WeakPolarHBondContact CB-O 3.31Å; L12-T379 PolarHBondContact N-O 2.81Å; L12-M380 HydrophobicContact CD1-CG 4.5Å
13	Q	93.6	Very high	71.3	Confident	96 Å²	96	102 Å²	102	45%	0.449	54%	0.54	S	S	.	.			trans	-75.6	103.8	-179.5	-172.2	70.3	39.4	0	0	109.5	L11 N381	L11-Q13 VanDerWaalsContact C-N 3.29Å; L11-Q13 VanDerWaalsContact CD2-OE1 3.26Å; L11-Q13 PolarHBondContact O-N 2.96Å; Q13-N381 PolarHBondContact NE2-ND2 2.83Å
14	L	96.1	Very high	72.8	Confident	0 Å²	0	100 Å²	100	0%	0	53%	0.525	C	S	.	.			trans	-110.2	133.6	170.3	-171.9	67.8	0	0	0	110	L12 Y38 F42 W43 N381 Y383 H384 Y387	L12-L14 PolarHBondContact O-N 3.1Å; L14-Y38 HydrophobicContact CB-CE1 4.27Å; L14-Y38 HydrophobicContact CD1-CE1 4.39Å; L14-F42 HydrophobicContact CD1-CB 3.69Å; L14-F42 HydrophobicContact CD1-CD1 3.44Å; L14-F42 VanDerWaalsContact CD1-CD1 3.44Å; L14-F42 HydrophobicContact CD1-CD2 3.89Å; L14-F42 HydrophobicContact CD1-CE1 3.96Å; L14-F42 HydrophobicContact CD1-CE2 4.36Å; L14-F42 HydrophobicContact CD1-CG 3.39Å; L14-F42 HydrophobicContact CD1-CZ 4.38Å; L14-F42 HydrophobicContact CD2-CD1 4.3Å; L14-F42 HydrophobicContact CD2-CD2 4.32Å; L14-F42 HydrophobicContact CD2-CE1 3.97Å; L14-F42 HydrophobicContact CD2-CE2 4Å; L14-F42 HydrophobicContact CD2-CG 4.46Å; L14-F42 HydrophobicContact CD2-CZ 3.8Å; L14-W43 HydrophobicContact CD1-CZ2 4.26Å; L14-N381 PolarHBondContact N-ND2 3Å; L14-N381 PolarHBondContact O-ND2 2.83Å; L14-N381 PolarHBondContact O-OD1 3.33Å; L14-Y383 HydrophobicContact CB-CD1 4.1Å; L14-Y383 HydrophobicContact CD2-CD1 3.92Å; L14-Y383 HydrophobicContact CD2-CE1 3.89Å; L14-Y383 HydrophobicContact CG-CD1 3.73Å; L14-Y383 HydrophobicContact CG-CE1 3.82Å; L14-Y383 WeakPolarHBondContact O-CB 3.42Å; L14-Y383 WeakPolarHBondContact O-CD1 3.5Å; L14-H384 HydrophobicContact CB-CB 3.96Å; L14-H384 HydrophobicContact CD2-CB 4.14Å; L14-Y387 HydrophobicContact CD2-CG 4.48Å
15	H	95.8	Very high	74.8	Confident	62 Å²	62	100.1 Å²	100.1	29%	0.287	53%	0.526	S	S	.	.			trans	-130.2	168.5	170.7	51.9	87.6	0	0	0	109.4	E18 N39 W43 Y383	H15-E18 IonicContact CE1-OE1 2.78Å; H15-E18 PolarHBondContact CE1-OE1 3.29Å; H15-E18 VanDerWaalsContact CE1-OE1 3.26Å; H15-E18 IonicContact ND1-OE1 3.4Å; H15-N39 VanDerWaalsContact CD2-CG 3.48Å; H15-N39 PolarHBondContact CD2-OD1 3.13Å; H15-N39 VanDerWaalsContact CE1-CG 3.44Å; H15-N39 PolarHBondContact CE1-ND2 3.34Å; H15-N39 PolarHBondContact N-OD1 2.8Å; H15-N39 PolarHBondContact ND1-ND2 3.06Å; H15-N39 VanDerWaalsContact NE2-CG 3.26Å; H15-N39 PolarHBondContact NE2-ND2 3.07Å; H15-N39 PolarHBondContact O-OD1 2.9Å; H15-N39 VanDerWaalsContact O-OD1 3.12Å; H15-W43 PolarHBondContact O-NE1 3.18Å; H15-Y383 VanDerWaalsContact C-CE1 3.46Å
16	P	95.6	Very high	77.6	Confident	75 Å²	75	94 Å²	94	49%	0.487	50%	0.498	S	S	.	.			trans	-50.8	145.8	175.3	-26.9	33.2	0	0	0	112.6	E18 Y383	P16-E18 PolarHBondContact O-N 3.26Å; P16-Y383 WeakPolarHBondContact CA-OH 3.24Å; P16-Y383 HydrophobicContact CB-CE2 4.39Å; P16-Y383 HydrophobicContact CG-CD2 4.13Å; P16-Y383 HydrophobicContact CG-CE2 3.52Å
17	E	92.1	Very high	79.7	Confident	50 Å²	50	86.9 Å²	86.9	23%	0.234	48%	0.477	C	S	.	.			trans	-58.4	121	173	-170.2	175.7	-148.8	0	0	109.3	W43	E17-W43 HydrophobicContact CB-CD2 3.71Å; E17-W43 HydrophobicContact CB-CE3 3.96Å; E17-W43 HydrophobicContact CB-CG 4.01Å; E17-W43 HydrophobicContact CB-CZ2 4.45Å; E17-W43 HydrophobicContact CB-CZ3 4.44Å; E17-W43 HydrophobicContact CG-CB 4.16Å; E17-W43 HydrophobicContact CG-CD2 4.15Å; E17-W43 HydrophobicContact CG-CE3 4.35Å; E17-W43 HydrophobicContact CG-CG 4.06Å
18	E	83.9	Confident	81.8	Confident	161 Å²	161	89.2 Å²	89.2	75%	0.752	48%	0.483	S	S	*	.	S	Bend	trans	-77.5	-29	-175.5	-62.9	-173.8	175.2	0	0	112.5	H15 P16	H15-E18 IonicContact CE1-OE1 2.78Å; H15-E18 PolarHBondContact CE1-OE1 3.29Å; H15-E18 VanDerWaalsContact CE1-OE1 3.26Å; H15-E18 IonicContact ND1-OE1 3.4Å; P16-E18 PolarHBondContact O-N 3.26Å
19	V	76.4	Confident	83.7	Confident	103 Å²	103	94.6 Å²	94.6	62%	0.624	50%	0.497	S	S	*	.			trans	-133.6	103.4	-178.2	-176.2	0	0	0	0	109.3	E21	V19-E21 HydrophobicContact CG1-CG 4.46Å; V19-E21 PolarHBondContact O-N 2.82Å
20	V	72.5	Confident	85.1	Confident	106 Å²	106	90.8 Å²	90.8	64%	0.642	48%	0.477	S	S	*	.			trans	-80.1	97.9	173.3	-174.3	0	0	0	0	108.4
21	E	67.8	Low	85.5	Confident	123 Å²	123	91.4 Å²	91.4	58%	0.575	48%	0.475	S	S	*	.			trans	-71.2	131.6	167.8	-72.8	177.1	160	0	0	109.6	V19 D23 K48	V19-E21 HydrophobicContact CG1-CG 4.46Å; V19-E21 PolarHBondContact O-N 2.82Å; E21-D23 VanDerWaalsContact C-N 3.33Å; E21-D23 PolarHBondContact O-N 2.81Å; E21-K48 IonicContact OE2-NZ 2.98Å; E21-K48 PolarHBondContact OE2-NZ 2.95Å
22	T	64.2	Low	85.8	Confident	145 Å²	145	92.9 Å²	92.9	89%	0.89	48%	0.475	S	S	*	.	S	Bend	trans	-77.3	-15.1	-169.6	48.9	0	0	0	0	114.7
23	D	64.9	Low	85.9	Confident	133 Å²	133	93.4 Å²	93.4	71%	0.711	48%	0.479	S	S	*	.	S	Bend	trans	-154.1	113	178.2	-143.9	-12	0	0	0	109.9	E21 Q25	E21-D23 VanDerWaalsContact C-N 3.33Å; E21-D23 PolarHBondContact O-N 2.81Å; D23-Q25 VanDerWaalsContact C-N 3.35Å; D23-Q25 PolarHBondContact O-N 2.93Å
24	P	65.5	Low	86	Confident	68 Å²	68	92.6 Å²	92.6	44%	0.442	48%	0.484	S	S	.	.			trans	-68.9	94.8	177	26.3	-30.2	0	0	0	109.1	L26 I50	P24-L26 PolarHBondContact O-N 3.25Å; P24-I50 HydrophobicContact CB-CD1 4.49Å
25	Q	80.4	Confident	85.7	Confident	175 Å²	175	96.1 Å²	96.1	82%	0.818	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-67.8	125.6	169.8	-169	171.8	-0.1	0	0	108.4	D23	D23-Q25 VanDerWaalsContact C-N 3.35Å; D23-Q25 PolarHBondContact O-N 2.93Å
26	L	88.9	Confident	85.6	Confident	56 Å²	56	93.9 Å²	93.9	29%	0.293	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-54.9	128.4	172	-74.7	172	0	0	0	109.4	P24 P235 R264 W282	P24-L26 PolarHBondContact O-N 3.25Å; L26-P235 HydrophobicContact CD1-CB 3.81Å; L26-P235 HydrophobicContact CD1-CG 3.55Å; L26-P235 HydrophobicContact CD2-CB 4.03Å; L26-P235 HydrophobicContact CD2-CG 3.92Å; L26-P235 HydrophobicContact CG-CG 4.37Å; L26-R264 VanDerWaalsContact CB-CZ 3.46Å; L26-R264 VanDerWaalsContact CB-NH2 3.26Å; L26-R264 PolarHBondContact O-NH2 2.93Å; L26-W282 HydrophobicContact CD2-CH2 3.82Å; L26-W282 HydrophobicContact CD2-CZ2 3.88Å
27	P	90.2	Very high	85.6	Confident	40 Å²	40	93.6 Å²	93.6	26%	0.26	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-66	159.5	-174.3	30	-37.1	0	0	0	111.5	E29 I50 R264 Y266	P27-E29 VanDerWaalsContact C-N 3.31Å; P27-E29 WeakPolarHBondContact CB-O 3.37Å; P27-I50 HydrophobicContact CG-CG2 4.19Å; P27-R264 PolarHBondContact O-NH2 2.86Å; P27-Y266 VanDerWaalsContact O-CE1 3.3Å; P27-Y266 WeakPolarHBondContact O-CE1 3.28Å; P27-Y266 PolarHBondContact O-OH 2.71Å
28	E	92.6	Very high	85.8	Confident	197 Å²	197	91.6 Å²	91.6	92%	0.921	50%	0.495	S	S	*	.	S	Bend	trans	-70.4	-32.1	174	-67.1	-171.5	167.5	0	0	111.6
29	E	95	Very high	86.5	Confident	153 Å²	153	84.3 Å²	84.3	72%	0.715	46%	0.461	S	S	*	.	S	Bend	trans	-139.7	156.5	176.9	62.5	179.2	-171.5	0	0	111.5	P27 E31	P27-E29 VanDerWaalsContact C-N 3.31Å; P27-E29 WeakPolarHBondContact CB-O 3.37Å; E29-E31 PolarHBondContact O-N 3.27Å
30	I	97.3	Very high	87.4	Confident	19 Å²	19	82 Å²	82	10%	0.097	45%	0.446	C	S	.	.			trans	-78.4	117.7	174.3	-63.3	-178.3	0	0	0	108.7	P51 I53 I233 Y266 I268	I30-P51 HydrophobicContact CD1-CB 4.02Å; I30-P51 HydrophobicContact CD1-CG 3.62Å; I30-P51 HydrophobicContact CG1-CG 3.89Å; I30-P51 HydrophobicContact CG2-CB 4.32Å; I30-P51 HydrophobicContact CG2-CG 4.46Å; I30-I53 HydrophobicContact CG2-CD1 4.05Å; I30-I53 HydrophobicContact CG2-CG1 4Å; I30-I233 HydrophobicContact CD1-CG2 3.72Å; I30-Y266 HydrophobicContact CD1-CD1 4.44Å; I30-Y266 HydrophobicContact CD1-CD2 4.04Å; I30-Y266 HydrophobicContact CD1-CG 3.75Å; I30-Y266 HydrophobicContact CG1-CD1 3.92Å; I30-Y266 HydrophobicContact CG1-CD2 4.24Å; I30-Y266 HydrophobicContact CG1-CG 3.73Å; I30-I268 HydrophobicContact CD1-CD1 3.62Å; I30-I268 HydrophobicContact CD1-CG1 3.81Å; I30-I268 HydrophobicContact CG2-CD1 4.28Å
31	E	97	Very high	88.6	Confident	82 Å²	82	77 Å²	77	38%	0.383	42%	0.415	S	S	.	.			trans	-64.1	142.6	-176	-163.8	179.8	169.8	0	0	112	E29 C33 R44 Y45 V52 I53	E29-E31 PolarHBondContact O-N 3.27Å; E31-C33 VanDerWaalsContact CG-SG 3.59Å; E31-C33 PolarHBondContact OE1-SG 3.27Å; E31-C33 VanDerWaalsContact OE1-SG 3.41Å; E31-R44 IonicContact OE1-NH2 3.91Å; E31-R44 IonicContact OE2-NH2 3.91Å; E31-R44 PolarHBondContact OE2-NH2 2.73Å; E31-Y45 PolarHBondContact OE1-OH 3.47Å; E31-Y45 PolarHBondContact OE2-OH 3.04Å; E31-V52 HydrophobicContact CB-CG2 4.44Å; E31-V52 WeakPolarHBondContact O-CG2 3.46Å; E31-I53 PolarHBondContact O-N 2.82Å
32	R	98	Very high	90	Very high	106 Å²	106	71.1 Å²	71.1	40%	0.4	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.1	168.2	-71.2	-177.6	-168.2	-129.5	-1.8	109.5	I53 N269 E274	R32-I53 CarbonylContact C-O 3.56Å; R32-I53 WeakPolarHBondContact CA-O 3.43Å; R32-I53 HydrophobicContact CB-CB 4.49Å; R32-I53 HydrophobicContact CG-CB 3.83Å; R32-I53 HydrophobicContact CG-CD1 3.66Å; R32-I53 HydrophobicContact CG-CG1 4.36Å; R32-I53 HydrophobicContact CG-CG2 4.01Å; R32-N269 PolarHBondContact NH1-O 2.82Å; R32-N269 PolarHBondContact NH2-O 3.25Å; R32-E274 IonicContact CZ-OE1 3.56Å; R32-E274 IonicContact CZ-OE2 3.29Å; R32-E274 IonicContact NH1-OE1 2.89Å; R32-E274 PolarHBondContact NH1-OE1 3.33Å; R32-E274 IonicContact NH1-OE2 2.91Å; R32-E274 PolarHBondContact NH1-OE2 3Å
33	C	96.7	Very high	91.5	Very high	12 Å²	12	65.1 Å²	65.1	8%	0.081	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	155	-178.2	-58.7	0	0	0	0	111.2	E31 Y45 V52 I53 I54 A55	E31-C33 VanDerWaalsContact CG-SG 3.59Å; E31-C33 PolarHBondContact OE1-SG 3.27Å; E31-C33 VanDerWaalsContact OE1-SG 3.41Å; C33-Y45 PolarHBondContact SG-OH 2.76Å; C33-Y45 VanDerWaalsContact SG-OH 3.4Å; C33-V52 HydrophobicContact CB-CG2 4.32Å; C33-I53 PolarHBondContact N-O 2.96Å; C33-I54 WeakPolarHBondContact O-CA 3.49Å; C33-A55 PolarHBondContact O-N 2.81Å
34	S	94.3	Very high	92.9	Very high	79 Å²	79	63.5 Å²	63.5	55%	0.552	33%	0.332	S	S	*	.	S	Bend	trans	-141.8	144.8	166.2	71.4	0	0	0	0	109	L36	S34-L36 PolarHBondContact O-N 3.05Å
35	G	91	Very high	94.4	Very high	74 Å²	74	60.6 Å²	60.6	76%	0.763	31%	0.313	S	S	*	.	S	Bend	trans	67.2	19	178.4	0	0	0	0	0	115.6
36	L	93.9	Very high	95.2	Very high	14 Å²	14	52.3 Å²	52.3	7%	0.073	27%	0.274	C	S	.	.			trans	-56.4	140.2	176.5	-164.4	63.6	0	0	0	110.5	S34 D40 F41 Y45 K178 Y179	S34-L36 PolarHBondContact O-N 3.05Å; L36-D40 HydrophobicContact CD1-CB 3.57Å; L36-D40 HydrophobicContact CG-CB 4.01Å; L36-F41 HydrophobicContact CD2-CB 3.67Å; L36-F41 HydrophobicContact CD2-CD2 4.05Å; L36-F41 HydrophobicContact CD2-CG 4.36Å; L36-F41 HydrophobicContact CG-CB 4.29Å; L36-Y45 HydrophobicContact CD2-CD2 4.06Å; L36-Y45 HydrophobicContact CD2-CE2 3.67Å; L36-K178 VanDerWaalsContact O-CE 3.28Å; L36-K178 WeakPolarHBondContact O-CE 3.36Å; L36-K178 PolarHBondContact O-NZ 2.89Å; L36-Y179 HydrophobicContact CB-CE1 3.94Å; L36-Y179 HydrophobicContact CG-CE1 4.47Å; L36-Y179 PolarHBondContact N-OH 3.02Å; L36-Y179 VanDerWaalsContact O-CE1 3.28Å; L36-Y179 WeakPolarHBondContact O-CE1 3.34Å; L36-Y179 PolarHBondContact O-OH 2.96Å
37	D	95.3	Very high	95.5	Very high	69 Å²	69	53.3 Å²	53.3	37%	0.369	28%	0.277	S	S	.	.			trans	-77.6	167.1	168.4	70.9	67.9	0	0	0	111.1	N39 D40 F41	D37-N39 WeakPolarHBondContact OD1-CA 3.23Å; D37-N39 WeakPolarHBondContact OD1-CB 3.35Å; D37-N39 PolarHBondContact OD1-N 2.75Å; D37-D40 PolarHBondContact OD1-N 2.8Å; D37-F41 PolarHBondContact O-N 3.48Å
38	Y	97	Very high	95.8	Very high	9 Å²	9	53.3 Å²	53.3	4%	0.035	27%	0.273	C	S	.	.	H	α-helix	trans	-68.6	-37.2	-177.2	178.8	-96.9	0	0	0	112.1	L12 L14 F41 F42 K178 H384	L12-Y38 HydrophobicContact CB-CD1 4.05Å; L12-Y38 HydrophobicContact CB-CE1 3.97Å; L12-Y38 HydrophobicContact CB-CE2 4.43Å; L12-Y38 HydrophobicContact CB-CG 4.33Å; L12-Y38 HydrophobicContact CD1-CE2 4.22Å; L12-Y38 HydrophobicContact CD2-CD2 3.94Å; L12-Y38 HydrophobicContact CD2-CE2 4.1Å; L12-Y38 HydrophobicContact CD2-CG 4.34Å; L12-Y38 HydrophobicContact CG-CE2 4.48Å; L14-Y38 HydrophobicContact CB-CE1 4.27Å; L14-Y38 HydrophobicContact CD1-CE1 4.39Å; Y38-F41 PolarHBondContact O-N 3.02Å; Y38-F42 HydrophobicContact CE1-CB 4.5Å; Y38-F42 HydrophobicContact CE1-CD2 4.11Å; Y38-F42 WeakPolarHBondContact O-CB 3.49Å; Y38-F42 PolarHBondContact O-N 3.41Å; Y38-K178 VanDerWaalsContact CD2-O 3.28Å; Y38-K178 WeakPolarHBondContact CD2-O 3.19Å; Y38-K178 WeakPolarHBondContact CE2-O 3.4Å; Y38-H384 AromaticContact CE1-CD2 3.67Å; Y38-H384 AromaticContact CE1-NE2 3.87Å; Y38-H384 AromaticContact CZ-NE2 3.76Å; Y38-H384 PolarHBondContact OH-NE2 3.11Å
39	N	97.1	Very high	96	Very high	8 Å²	8	45.4 Å²	45.4	4%	0.043	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-44	-176.3	-172.8	80.5	0	0	0	111.3	H15 D37 F42 W43	H15-N39 VanDerWaalsContact CD2-CG 3.48Å; H15-N39 PolarHBondContact CD2-OD1 3.13Å; H15-N39 VanDerWaalsContact CE1-CG 3.44Å; H15-N39 PolarHBondContact CE1-ND2 3.34Å; H15-N39 PolarHBondContact N-OD1 2.8Å; H15-N39 PolarHBondContact ND1-ND2 3.06Å; H15-N39 VanDerWaalsContact NE2-CG 3.26Å; H15-N39 PolarHBondContact NE2-ND2 3.07Å; H15-N39 PolarHBondContact O-OD1 2.9Å; H15-N39 VanDerWaalsContact O-OD1 3.12Å; D37-N39 WeakPolarHBondContact OD1-CA 3.23Å; D37-N39 WeakPolarHBondContact OD1-CB 3.35Å; D37-N39 PolarHBondContact OD1-N 2.75Å; N39-F42 WeakPolarHBondContact O-CB 3.32Å; N39-F42 PolarHBondContact O-N 3.08Å; N39-W43 VanDerWaalsContact O-CD1 3.3Å; N39-W43 PolarHBondContact O-N 3.4Å; N39-W43 PolarHBondContact OD1-NE1 3.19Å
40	D	95.7	Very high	96	Very high	55 Å²	55	39.2 Å²	39.2	29%	0.294	21%	0.209	S	C	.	.	H	α-helix	trans	-60.4	-45.2	173.7	-87.9	4.9	0	0	0	111.4	L36 D37 F42 R44	L36-D40 HydrophobicContact CD1-CB 3.57Å; L36-D40 HydrophobicContact CG-CB 4.01Å; D37-D40 PolarHBondContact OD1-N 2.8Å; D40-F42 VanDerWaalsContact C-N 3.3Å; D40-F42 PolarHBondContact O-N 2.47Å; D40-R44 WeakPolarHBondContact O-CB 3.49Å; D40-R44 WeakPolarHBondContact O-CG 3.24Å; D40-R44 PolarHBondContact O-N 2.52Å; D40-R44 IonicContact OD2-NH1 3.88Å
41	F	97.3	Very high	96.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.1	-46.7	175.4	177.9	-106.4	0	0	0	111.8	L36 D37 Y38 Y45 M46 V52 I54 Y179 F180 F277	L36-F41 HydrophobicContact CD2-CB 3.67Å; L36-F41 HydrophobicContact CD2-CD2 4.05Å; L36-F41 HydrophobicContact CD2-CG 4.36Å; L36-F41 HydrophobicContact CG-CB 4.29Å; D37-F41 PolarHBondContact O-N 3.48Å; Y38-F41 PolarHBondContact O-N 3.02Å; F41-Y45 HydrophobicContact CD2-CD2 4.14Å; F41-Y45 PolarHBondContact O-N 3.21Å; F41-M46 HydrophobicContact CD1-CB 4.4Å; F41-M46 HydrophobicContact CD1-CE 3.58Å; F41-M46 HydrophobicContact CE1-CB 3.98Å; F41-M46 HydrophobicContact CE1-CE 3.36Å; F41-M46 HydrophobicContact CE1-CG 4.4Å; F41-M46 HydrophobicContact CZ-CB 4.34Å; F41-M46 PolarHBondContact O-N 3.25Å; F41-V52 HydrophobicContact CD2-CG1 4.16Å; F41-V52 HydrophobicContact CE2-CG1 3.73Å; F41-I54 HydrophobicContact CD2-CD1 4.06Å; F41-I54 HydrophobicContact CE2-CD1 4.04Å; F41-Y179 HydrophobicContact CB-CD1 3.56Å; F41-Y179 HydrophobicContact CB-CE1 4.14Å; F41-Y179 HydrophobicContact CB-CG 4.48Å; F41-Y179 HydrophobicContact CD1-CD1 4.02Å; F41-Y179 HydrophobicContact CD1-CG 4.21Å; F41-Y179 HydrophobicContact CD2-CD1 4.28Å; F41-Y179 HydrophobicContact CD2-CG 4.5Å; F41-Y179 VanDerWaalsContact CE1-O 3.25Å; F41-Y179 WeakPolarHBondContact CE1-O 3.4Å; F41-Y179 AromaticContact CG-CD1 3.67Å; F41-Y179 HydrophobicContact CG-CD1 3.67Å; F41-Y179 HydrophobicContact CG-CG 4.12Å; F41-F180 HydrophobicContact CE1-CD1 4.19Å; F41-F180 HydrophobicContact CE1-CE1 4.14Å; F41-F180 HydrophobicContact CE2-CE1 4.22Å; F41-F180 HydrophobicContact CZ-CD1 4.05Å; F41-F180 AromaticContact CZ-CE1 3.59Å; F41-F180 HydrophobicContact CZ-CE1 3.59Å; F41-F277 HydrophobicContact CE2-CB 4.24Å; F41-F277 HydrophobicContact CE2-CD1 4.1Å; F41-F277 HydrophobicContact CE2-CG 4.06Å; F41-F277 HydrophobicContact CZ-CB 4.33Å; F41-F277 HydrophobicContact CZ-CD1 4.06Å; F41-F277 AromaticContact CZ-CD2 3.91Å; F41-F277 HydrophobicContact CZ-CD2 3.91Å; F41-F277 HydrophobicContact CZ-CE1 4.34Å; F41-F277 HydrophobicContact CZ-CE2 4.2Å; F41-F277 AromaticContact CZ-CG 3.83Å; F41-F277 HydrophobicContact CZ-CG 3.83Å; F41-F277 HydrophobicContact CZ-CZ 4.42Å
42	F	97.8	Very high	96.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-59.8	-55.3	-176.9	-169.7	-81.3	0	0	0	111.3	L14 Y38 N39 D40 M46 H47 C303 Y387	L14-F42 HydrophobicContact CD1-CB 3.69Å; L14-F42 HydrophobicContact CD1-CD1 3.44Å; L14-F42 VanDerWaalsContact CD1-CD1 3.44Å; L14-F42 HydrophobicContact CD1-CD2 3.89Å; L14-F42 HydrophobicContact CD1-CE1 3.96Å; L14-F42 HydrophobicContact CD1-CE2 4.36Å; L14-F42 HydrophobicContact CD1-CG 3.39Å; L14-F42 HydrophobicContact CD1-CZ 4.38Å; L14-F42 HydrophobicContact CD2-CD1 4.3Å; L14-F42 HydrophobicContact CD2-CD2 4.32Å; L14-F42 HydrophobicContact CD2-CE1 3.97Å; L14-F42 HydrophobicContact CD2-CE2 4Å; L14-F42 HydrophobicContact CD2-CG 4.46Å; L14-F42 HydrophobicContact CD2-CZ 3.8Å; Y38-F42 HydrophobicContact CE1-CB 4.5Å; Y38-F42 HydrophobicContact CE1-CD2 4.11Å; Y38-F42 WeakPolarHBondContact O-CB 3.49Å; Y38-F42 PolarHBondContact O-N 3.41Å; N39-F42 WeakPolarHBondContact O-CB 3.32Å; N39-F42 PolarHBondContact O-N 3.08Å; D40-F42 VanDerWaalsContact C-N 3.3Å; D40-F42 PolarHBondContact O-N 2.47Å; F42-M46 HydrophobicContact CB-CE 4.45Å; F42-M46 HydrophobicContact CD2-CE 3.69Å; F42-M46 HydrophobicContact CD2-SD 3.71Å; F42-M46 HydrophobicContact CE2-CE 4.39Å; F42-M46 HydrophobicContact CE2-SD 3.89Å; F42-M46 HydrophobicContact CG-CE 4.39Å; F42-M46 HydrophobicContact CG-SD 4.47Å; F42-M46 WeakPolarHBondContact O-CB 3.15Å; F42-M46 PolarHBondContact O-N 3.07Å; F42-H47 HydrophobicContact CD1-CB 4.47Å; F42-H47 HydrophobicContact CE1-CB 4.49Å; F42-H47 WeakPolarHBondContact O-CB 3.36Å; F42-H47 PolarHBondContact O-N 3.47Å; F42-C303 WeakPolarHBondContact CZ-SG 2.99Å; F42-Y387 HydrophobicContact CE1-CE1 4.3Å; F42-Y387 HydrophobicContact CE1-CE2 4.35Å; F42-Y387 AromaticContact CZ-CD1 3.89Å; F42-Y387 HydrophobicContact CZ-CD1 3.89Å; F42-Y387 AromaticContact CZ-CE1 3.58Å; F42-Y387 HydrophobicContact CZ-CE1 3.58Å; F42-Y387 HydrophobicContact CZ-CE2 4.38Å; F42-Y387 HydrophobicContact CZ-CG 4.44Å; F42-Y387 AromaticContact CZ-CZ 3.85Å
43	W	95.8	Very high	96.2	Very high	18 Å²	18	29.6 Å²	29.6	7%	0.068	17%	0.168	C	C	.	.	I	π-helix	trans	-79.5	-39.1	-174.3	-65.1	116.4	0	0	0	113.8	L14 H15 E17 N39 H47 K48 Y383 Y387	L14-W43 HydrophobicContact CD1-CZ2 4.26Å; H15-W43 PolarHBondContact O-NE1 3.18Å; E17-W43 HydrophobicContact CB-CD2 3.71Å; E17-W43 HydrophobicContact CB-CE3 3.96Å; E17-W43 HydrophobicContact CB-CG 4.01Å; E17-W43 HydrophobicContact CB-CZ2 4.45Å; E17-W43 HydrophobicContact CB-CZ3 4.44Å; E17-W43 HydrophobicContact CG-CB 4.16Å; E17-W43 HydrophobicContact CG-CD2 4.15Å; E17-W43 HydrophobicContact CG-CE3 4.35Å; E17-W43 HydrophobicContact CG-CG 4.06Å; N39-W43 VanDerWaalsContact O-CD1 3.3Å; N39-W43 PolarHBondContact O-N 3.4Å; N39-W43 PolarHBondContact OD1-NE1 3.19Å; W43-H47 HydrophobicContact CE3-CB 3.99Å; W43-H47 AromaticContact CE3-CG 3.76Å; W43-H47 HydrophobicContact CZ3-CB 4.39Å; W43-H47 AromaticContact CZ3-CD2 3.61Å; W43-H47 AromaticContact CZ3-CG 3.77Å; W43-H47 AromaticContact CZ3-NE2 3.79Å; W43-K48 WeakPolarHBondContact O-CG 3.38Å; W43-Y383 HydrophobicContact CZ2-CE1 4.11Å; W43-Y387 HydrophobicContact CH2-CD2 4.19Å; W43-Y387 AromaticContact CH2-CE2 3.88Å; W43-Y387 HydrophobicContact CH2-CE2 3.88Å; W43-Y387 HydrophobicContact CZ3-CE2 4.38Å
44	R	94.1	Very high	96.3	Very high	99 Å²	99	29 Å²	29	37%	0.374	16%	0.164	S	C	.	.	I	π-helix	trans	-78.6	-27.9	-174.1	-63.2	172.8	57.5	-170.1	-6.9	113.4	E31 D40	E31-R44 IonicContact OE1-NH2 3.91Å; E31-R44 IonicContact OE2-NH2 3.91Å; E31-R44 PolarHBondContact OE2-NH2 2.73Å; D40-R44 WeakPolarHBondContact O-CB 3.49Å; D40-R44 WeakPolarHBondContact O-CG 3.24Å; D40-R44 PolarHBondContact O-N 2.52Å; D40-R44 IonicContact OD2-NH1 3.88Å
45	Y	96.1	Very high	96.4	Very high	8 Å²	8	26.4 Å²	26.4	3%	0.031	15%	0.147	C	C	.	.	I	π-helix	trans	-127	-56.3	-172	-50.9	-81.4	0	0	0	112.9	E31 C33 L36 F41 N49 I50 V52	E31-Y45 PolarHBondContact OE1-OH 3.47Å; E31-Y45 PolarHBondContact OE2-OH 3.04Å; C33-Y45 PolarHBondContact SG-OH 2.76Å; C33-Y45 VanDerWaalsContact SG-OH 3.4Å; L36-Y45 HydrophobicContact CD2-CD2 4.06Å; L36-Y45 HydrophobicContact CD2-CE2 3.67Å; F41-Y45 HydrophobicContact CD2-CD2 4.14Å; F41-Y45 PolarHBondContact O-N 3.21Å; Y45-N49 WeakPolarHBondContact O-CA 3.26Å; Y45-N49 PolarHBondContact O-N 2.87Å; Y45-I50 WeakPolarHBondContact CB-O 3.23Å; Y45-I50 HydrophobicContact CD1-CG2 4.25Å; Y45-I50 PolarHBondContact O-N 3.32Å; Y45-V52 HydrophobicContact CD1-CB 3.54Å; Y45-V52 HydrophobicContact CD1-CG1 3.95Å; Y45-V52 HydrophobicContact CD1-CG2 3.99Å; Y45-V52 HydrophobicContact CD2-CG1 4.25Å; Y45-V52 HydrophobicContact CE1-CB 3.77Å; Y45-V52 HydrophobicContact CE1-CG1 4.48Å; Y45-V52 HydrophobicContact CE1-CG2 3.69Å; Y45-V52 HydrophobicContact CE2-CG2 4.38Å; Y45-V52 HydrophobicContact CG-CB 3.94Å; Y45-V52 HydrophobicContact CG-CG1 3.79Å; Y45-V52 HydrophobicContact CG-CG2 4.43Å
46	M	97.6	Very high	96.6	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	13%	0.134	C	C	.	.	I	π-helix	trans	-63.8	-51.7	-174.8	-169.5	-158.6	-54.2	0	0	111.7	F41 F42 N49 Y179 F219 F277 W299 N301 C303	F41-M46 HydrophobicContact CD1-CB 4.4Å; F41-M46 HydrophobicContact CD1-CE 3.58Å; F41-M46 HydrophobicContact CE1-CB 3.98Å; F41-M46 HydrophobicContact CE1-CE 3.36Å; F41-M46 HydrophobicContact CE1-CG 4.4Å; F41-M46 HydrophobicContact CZ-CB 4.34Å; F41-M46 PolarHBondContact O-N 3.25Å; F42-M46 HydrophobicContact CB-CE 4.45Å; F42-M46 HydrophobicContact CD2-CE 3.69Å; F42-M46 HydrophobicContact CD2-SD 3.71Å; F42-M46 HydrophobicContact CE2-CE 4.39Å; F42-M46 HydrophobicContact CE2-SD 3.89Å; F42-M46 HydrophobicContact CG-CE 4.39Å; F42-M46 HydrophobicContact CG-SD 4.47Å; F42-M46 WeakPolarHBondContact O-CB 3.15Å; F42-M46 PolarHBondContact O-N 3.07Å; M46-N49 PolarHBondContact O-N 3.23Å; M46-Y179 WeakPolarHBondContact CE-O 3.31Å; M46-F219 HydrophobicContact CG-CD2 4.34Å; M46-F219 HydrophobicContact CG-CE2 3.61Å; M46-F219 HydrophobicContact CG-CZ 4Å; M46-F219 WeakPolarHBondContact O-CZ 3.2Å; M46-F219 HydrophobicContact SD-CE2 4.44Å; M46-F277 HydrophobicContact CB-CZ 4.33Å; M46-F277 HydrophobicContact CG-CZ 4.28Å; M46-W299 HydrophobicContact CE-CH2 3.86Å; M46-W299 HydrophobicContact CG-CH2 4.07Å; M46-W299 HydrophobicContact SD-CH2 3.71Å; M46-W299 HydrophobicContact SD-CZ3 4.37Å; M46-N301 PolarHBondContact SD-ND2 3.24Å; M46-N301 VanDerWaalsContact SD-ND2 3.41Å; M46-C303 HydrophobicContact CG-CB 4.27Å; M46-C303 HydrophobicContact SD-CB 4.36Å; M46-C303 VanDerWaalsContact SD-SG 3.63Å
47	H	96.1	Very high	96.7	Very high	77 Å²	77	27.4 Å²	27.4	36%	0.356	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-39.3	-179.4	-170.3	-91.6	0	0	0	112.3	F42 W43 N49 Y387	F42-H47 HydrophobicContact CD1-CB 4.47Å; F42-H47 HydrophobicContact CE1-CB 4.49Å; F42-H47 WeakPolarHBondContact O-CB 3.36Å; F42-H47 PolarHBondContact O-N 3.47Å; W43-H47 HydrophobicContact CE3-CB 3.99Å; W43-H47 AromaticContact CE3-CG 3.76Å; W43-H47 HydrophobicContact CZ3-CB 4.39Å; W43-H47 AromaticContact CZ3-CD2 3.61Å; W43-H47 AromaticContact CZ3-CG 3.77Å; W43-H47 AromaticContact CZ3-NE2 3.79Å; H47-N49 PolarHBondContact O-N 3.2Å; H47-Y387 PolarHBondContact CD2-OH 3.01Å; H47-Y387 PolarHBondContact NE2-OH 3.37Å
48	K	95.1	Very high	96.7	Very high	40 Å²	40	24.1 Å²	24.1	17%	0.174	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.9	177.3	-72.7	178.5	-178.3	178.6	0	113.6	E21 W43 I50	E21-K48 IonicContact OE2-NZ 2.98Å; E21-K48 PolarHBondContact OE2-NZ 2.95Å; W43-K48 WeakPolarHBondContact O-CG 3.38Å; K48-I50 HydrophobicContact CB-CD1 3.81Å; K48-I50 HydrophobicContact CB-CG1 3.99Å; K48-I50 HydrophobicContact CD-CD1 4.39Å; K48-I50 PolarHBondContact O-N 2.96Å
49	N	96.7	Very high	96.5	Very high	31 Å²	31	27.9 Å²	27.9	17%	0.166	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	43.3	-178.3	-159.9	55.1	0	0	0	113	Y45 M46 H47 P279 S280 W282	Y45-N49 WeakPolarHBondContact O-CA 3.26Å; Y45-N49 PolarHBondContact O-N 2.87Å; M46-N49 PolarHBondContact O-N 3.23Å; H47-N49 PolarHBondContact O-N 3.2Å; N49-P279 HydrophobicContact CB-CB 4.26Å; N49-P279 WeakPolarHBondContact OD1-CB 3.39Å; N49-S280 PolarHBondContact ND2-O 3.44Å; N49-S280 PolarHBondContact OD1-N 3Å; N49-W282 PolarHBondContact O-NE1 3.33Å
50	I	96.9	Very high	96.3	Very high	23 Å²	23	32.3 Å²	32.3	12%	0.118	16%	0.163	C	C	.	.			trans	-111.8	131.4	-177.2	-62.9	175.1	0	0	0	110.1	P24 P27 Y45 K48 F277	P24-I50 HydrophobicContact CB-CD1 4.49Å; P27-I50 HydrophobicContact CG-CG2 4.19Å; Y45-I50 WeakPolarHBondContact CB-O 3.23Å; Y45-I50 HydrophobicContact CD1-CG2 4.25Å; Y45-I50 PolarHBondContact O-N 3.32Å; K48-I50 HydrophobicContact CB-CD1 3.81Å; K48-I50 HydrophobicContact CB-CG1 3.99Å; K48-I50 HydrophobicContact CD-CD1 4.39Å; K48-I50 PolarHBondContact O-N 2.96Å; I50-F277 WeakPolarHBondContact O-CD1 3.35Å; I50-F277 WeakPolarHBondContact O-CE1 3.4Å
51	P	98.2	Very high	96.3	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.006	15%	0.151	C	C	.	.			trans	-70	149.5	178.8	29.5	-36.5	0	0	0	111.3	I30 F277 P279 W282	I30-P51 HydrophobicContact CD1-CB 4.02Å; I30-P51 HydrophobicContact CD1-CG 3.62Å; I30-P51 HydrophobicContact CG1-CG 3.89Å; I30-P51 HydrophobicContact CG2-CB 4.32Å; I30-P51 HydrophobicContact CG2-CG 4.46Å; P51-F277 WeakPolarHBondContact CA-O 3.45Å; P51-F277 WeakPolarHBondContact CB-O 3.27Å; P51-P279 HydrophobicContact CB-CG 4.15Å; P51-P279 VanDerWaalsContact N-CG 3.28Å; P51-W282 HydrophobicContact CG-CD2 4.42Å; P51-W282 HydrophobicContact CG-CE3 4.1Å; P51-W282 HydrophobicContact CG-CH2 3.69Å; P51-W282 HydrophobicContact CG-CZ2 4.08Å; P51-W282 HydrophobicContact CG-CZ3 3.71Å
52	V	98.4	Very high	96.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	149.6	175.3	64.3	0	0	0	0	110.4	E31 C33 F41 Y45 I54 F277	E31-V52 HydrophobicContact CB-CG2 4.44Å; E31-V52 WeakPolarHBondContact O-CG2 3.46Å; C33-V52 HydrophobicContact CB-CG2 4.32Å; F41-V52 HydrophobicContact CD2-CG1 4.16Å; F41-V52 HydrophobicContact CE2-CG1 3.73Å; Y45-V52 HydrophobicContact CD1-CB 3.54Å; Y45-V52 HydrophobicContact CD1-CG1 3.95Å; Y45-V52 HydrophobicContact CD1-CG2 3.99Å; Y45-V52 HydrophobicContact CD2-CG1 4.25Å; Y45-V52 HydrophobicContact CE1-CB 3.77Å; Y45-V52 HydrophobicContact CE1-CG1 4.48Å; Y45-V52 HydrophobicContact CE1-CG2 3.69Å; Y45-V52 HydrophobicContact CE2-CG2 4.38Å; Y45-V52 HydrophobicContact CG-CB 3.94Å; Y45-V52 HydrophobicContact CG-CG1 3.79Å; Y45-V52 HydrophobicContact CG-CG2 4.43Å; V52-I54 HydrophobicContact CG1-CG1 4.28Å; V52-F277 HydrophobicContact CG1-CB 3.96Å; V52-F277 HydrophobicContact CG1-CD1 4.25Å; V52-F277 PolarHBondContact O-N 3.24Å
53	I	98.7	Very high	96.3	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.015	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123.9	173.8	-57.6	157	0	0	0	107.9	I30 E31 R32 C33 I268 E274 A275 V276	I30-I53 HydrophobicContact CG2-CD1 4.05Å; I30-I53 HydrophobicContact CG2-CG1 4Å; E31-I53 PolarHBondContact O-N 2.82Å; R32-I53 CarbonylContact C-O 3.56Å; R32-I53 WeakPolarHBondContact CA-O 3.43Å; R32-I53 HydrophobicContact CB-CB 4.49Å; R32-I53 HydrophobicContact CG-CB 3.83Å; R32-I53 HydrophobicContact CG-CD1 3.66Å; R32-I53 HydrophobicContact CG-CG1 4.36Å; R32-I53 HydrophobicContact CG-CG2 4.01Å; C33-I53 PolarHBondContact N-O 2.96Å; I53-I268 HydrophobicContact CD1-CB 4.49Å; I53-I268 HydrophobicContact CD1-CD1 4.48Å; I53-I268 HydrophobicContact CD1-CG1 4.36Å; I53-I268 HydrophobicContact CD1-CG2 3.48Å; I53-I268 VanDerWaalsContact CD1-CG2 3.48Å; I53-I268 HydrophobicContact CG1-CD1 4.47Å; I53-I268 HydrophobicContact CG1-CG2 4.06Å; I53-E274 HydrophobicContact CG2-CB 3.9Å; I53-E274 HydrophobicContact CG2-CG 4.16Å; I53-A275 CarbonylContact C-O 3.56Å; I53-A275 WeakPolarHBondContact CA-O 3.42Å; I53-V276 HydrophobicContact CG1-CG2 4.29Å
54	I	98.3	Very high	96.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.8	178	-51.6	179.7	0	0	0	108.2	C33 F41 V52 V57 Y179 F180 E274 A275	C33-I54 WeakPolarHBondContact O-CA 3.49Å; F41-I54 HydrophobicContact CD2-CD1 4.06Å; F41-I54 HydrophobicContact CE2-CD1 4.04Å; V52-I54 HydrophobicContact CG1-CG1 4.28Å; I54-V57 HydrophobicContact CB-CG2 3.95Å; I54-V57 HydrophobicContact CG2-CG2 3.63Å; I54-V57 VanDerWaalsContact O-CG2 3.24Å; I54-V57 WeakPolarHBondContact O-CG2 3.43Å; I54-Y179 HydrophobicContact CD1-CD1 4.35Å; I54-Y179 HydrophobicContact CD1-CD2 3.48Å; I54-Y179 VanDerWaalsContact CD1-CD2 3.48Å; I54-Y179 HydrophobicContact CD1-CE2 3.81Å; I54-Y179 HydrophobicContact CD1-CG 3.78Å; I54-Y179 HydrophobicContact CG2-CD2 4.31Å; I54-Y179 HydrophobicContact CG2-CE2 3.67Å; I54-F180 HydrophobicContact CD1-CE1 4.47Å; I54-F180 HydrophobicContact CD1-CZ 3.96Å; I54-E274 CarbonylContact O-C 3.6Å; I54-E274 WeakPolarHBondContact O-CA 3.36Å; I54-A275 HydrophobicContact CB-CB 4.49Å; I54-A275 PolarHBondContact N-O 3.21Å; I54-A275 PolarHBondContact O-N 3.16Å
55	A	97.6	Very high	96.4	Very high	24 Å²	24	31.4 Å²	31.4	20%	0.198	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	163.4	177.7	0	0	0	0	0	112.2	C33 V57 N273 E274	C33-A55 PolarHBondContact O-N 2.81Å; A55-V57 VanDerWaalsContact C-N 3.32Å; A55-V57 PolarHBondContact O-N 3.37Å; A55-N273 CarbonylContact C-O 3.55Å; A55-E274 HydrophobicContact CB-CG 4.47Å
56	N	95.4	Very high	96.4	Very high	91 Å²	91	31 Å²	31	49%	0.487	16%	0.162	S	C	.	.	S	Bend	trans	65.3	28.3	173.1	-61.8	-39.5	0	0	0	114.9	N59 N273	N56-N59 VanDerWaalsContact CB-ND2 3.34Å; N56-N59 WeakPolarHBondContact CB-ND2 3.08Å; N56-N59 PolarHBondContact O-ND2 3.25Å; N56-N273 VanDerWaalsContact C-OD1 3.3Å; N56-N273 WeakPolarHBondContact CA-OD1 3.07Å; N56-N273 PolarHBondContact N-O 2.85Å
57	V	95.6	Very high	96.3	Very high	17 Å²	17	31.5 Å²	31.5	10%	0.103	17%	0.165	C	C	.	.			trans	-79.8	-35.8	-170.5	173.9	0	0	0	0	113.4	I54 A55 W61 P177 T223 N273 A275	I54-V57 HydrophobicContact CB-CG2 3.95Å; I54-V57 HydrophobicContact CG2-CG2 3.63Å; I54-V57 VanDerWaalsContact O-CG2 3.24Å; I54-V57 WeakPolarHBondContact O-CG2 3.43Å; A55-V57 VanDerWaalsContact C-N 3.32Å; A55-V57 PolarHBondContact O-N 3.37Å; V57-W61 HydrophobicContact CG1-CH2 4.21Å; V57-W61 HydrophobicContact CG1-CZ2 3.84Å; V57-W61 PolarHBondContact O-NE1 3.33Å; V57-P177 HydrophobicContact CG1-CB 4.22Å; V57-P177 HydrophobicContact CG1-CG 3.41Å; V57-P177 VanDerWaalsContact CG1-CG 3.41Å; V57-T223 HydrophobicContact CB-CG2 4.22Å; V57-T223 HydrophobicContact CG1-CG2 4.01Å; V57-N273 PolarHBondContact N-O 2.69Å; V57-N273 VanDerWaalsContact N-O 3.16Å; V57-N273 PolarHBondContact N-OD1 3.48Å; V57-N273 VanDerWaalsContact N-OD1 3.13Å; V57-A275 HydrophobicContact CB-CB 4.24Å; V57-A275 HydrophobicContact CG1-CB 4.19Å; V57-A275 HydrophobicContact CG2-CB 3.82Å
58	S	95.2	Very high	95.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-109.3	15.4	-170.5	59.7	0	0	0	0	114	D60 W61 Q64 N273	S58-D60 VanDerWaalsContact C-N 3.28Å; S58-D60 PolarHBondContact O-N 3.16Å; S58-W61 VanDerWaalsContact CB-CD2 3.49Å; S58-W61 WeakPolarHBondContact O-CB 3.12Å; S58-W61 PolarHBondContact O-N 3.31Å; S58-W61 VanDerWaalsContact O-N 3.16Å; S58-Q64 VanDerWaalsContact O-CD 3.32Å; S58-Q64 WeakPolarHBondContact O-CG 3.47Å; S58-Q64 PolarHBondContact O-NE2 2.84Å; S58-Q64 PolarHBondContact OG-NE2 3.13Å; S58-N273 PolarHBondContact N-OD1 3.24Å; S58-N273 PolarHBondContact OG-OD1 3.4Å
59	N	92.3	Very high	94.8	Very high	89 Å²	89	31.5 Å²	31.5	48%	0.476	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-40.3	-177.5	-81.9	-41.5	0	0	0	113.9	N56 N273	N56-N59 VanDerWaalsContact CB-ND2 3.34Å; N56-N59 WeakPolarHBondContact CB-ND2 3.08Å; N56-N59 PolarHBondContact O-ND2 3.25Å; N59-N273 VanDerWaalsContact CG-ND2 3.3Å; N59-N273 PolarHBondContact N-OD1 2.97Å; N59-N273 PolarHBondContact ND2-ND2 3.35Å; N59-N273 PolarHBondContact OD1-ND2 3.46Å
60	D	92.8	Very high	92.7	Very high	101 Å²	101	35.4 Å²	35.4	54%	0.54	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	8	-176.6	72.4	-47	0	0	0	113	S58 K175	S58-D60 VanDerWaalsContact C-N 3.28Å; S58-D60 PolarHBondContact O-N 3.16Å; D60-K175 IonicContact OD2-NZ 3.73Å; D60-K175 PolarHBondContact OD2-NZ 2.84Å
61	W	96.9	Very high	89.9	Confident	10 Å²	10	38.2 Å²	38.2	4%	0.038	22%	0.222	C	C	.	.			trans	-78.5	138.3	-178.7	-67.7	8	0	0	0	111	V57 S58 C63 Q64 Y174 K175 P177 W221 T223 I225 V295	V57-W61 HydrophobicContact CG1-CH2 4.21Å; V57-W61 HydrophobicContact CG1-CZ2 3.84Å; V57-W61 PolarHBondContact O-NE1 3.33Å; S58-W61 VanDerWaalsContact CB-CD2 3.49Å; S58-W61 WeakPolarHBondContact O-CB 3.12Å; S58-W61 PolarHBondContact O-N 3.31Å; S58-W61 VanDerWaalsContact O-N 3.16Å; W61-C63 PolarHBondContact O-N 2.84Å; W61-Q64 VanDerWaalsContact O-CB 3.26Å; W61-Q64 WeakPolarHBondContact O-CB 3.48Å; W61-Q64 VanDerWaalsContact O-CG 3.23Å; W61-Q64 WeakPolarHBondContact O-CG 3.04Å; W61-Q64 PolarHBondContact O-N 2.96Å; W61-Y174 VanDerWaalsContact CE3-CB 3.41Å; W61-Y174 HydrophobicContact CE3-CG 4.48Å; W61-Y174 HydrophobicContact CH2-CD2 4.15Å; W61-Y174 HydrophobicContact CZ2-CD2 4.46Å; W61-Y174 HydrophobicContact CZ3-CD2 4.3Å; W61-Y174 HydrophobicContact CZ3-CG 4.42Å; W61-K175 VanDerWaalsContact CE2-O 3.24Å; W61-K175 WeakPolarHBondContact CZ2-O 3.48Å; W61-K175 PolarHBondContact NE1-O 3.39Å; W61-P177 HydrophobicContact CH2-CG 4.46Å; W61-P177 HydrophobicContact CZ2-CG 3.91Å; W61-W221 HydrophobicContact CH2-CH2 4.17Å; W61-W221 HydrophobicContact CH2-CZ3 4.05Å; W61-T223 HydrophobicContact CE3-CG2 4.48Å; W61-T223 HydrophobicContact CH2-CG2 3.77Å; W61-T223 HydrophobicContact CZ3-CG2 3.69Å; W61-I225 HydrophobicContact CE3-CD1 3.76Å; W61-I225 HydrophobicContact CZ3-CD1 3.93Å; W61-V295 HydrophobicContact CZ3-CB 4.13Å; W61-V295 HydrophobicContact CZ3-CG2 4.26Å
62	E	97.1	Very high	87.3	Confident	47 Å²	47	41.7 Å²	41.7	22%	0.22	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-60	-34	179.1	-170	-60.3	137.1	0	0	111.3	Q64 N65 Y91 Y171 F173	E62-Q64 PolarHBondContact O-N 3.24Å; E62-N65 WeakPolarHBondContact O-CB 3.24Å; E62-N65 PolarHBondContact O-N 3.16Å; E62-N65 PolarHBondContact O-ND2 2.94Å; E62-N65 VanDerWaalsContact O-ND2 3.1Å; E62-N65 PolarHBondContact OE1-ND2 2.76Å; E62-Y91 PolarHBondContact OE1-OH 2.93Å; E62-Y171 HydrophobicContact CG-CE2 4.28Å; E62-Y171 WeakPolarHBondContact OE2-CE2 3.28Å; E62-Y171 PolarHBondContact OE2-OH 3.19Å; E62-F173 PolarHBondContact N-O 3.13Å
63	C	97.4	Very high	84.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63.8	-7.2	177.3	67.3	0	0	0	0	114.4	W61 N65 W66 F173	W61-C63 PolarHBondContact O-N 2.84Å; C63-N65 PolarHBondContact O-N 3.23Å; C63-W66 HydrophobicContact CB-CD2 3.49Å; C63-W66 VanDerWaalsContact CB-CD2 3.49Å; C63-W66 VanDerWaalsContact CB-CE2 3.4Å; C63-W66 HydrophobicContact CB-CE3 3.63Å; C63-W66 HydrophobicContact CB-CG 4.16Å; C63-W66 HydrophobicContact CB-CH2 3.72Å; C63-W66 HydrophobicContact CB-CZ2 3.54Å; C63-W66 HydrophobicContact CB-CZ3 3.75Å; C63-W66 WeakPolarHBondContact O-CB 3.28Å; C63-W66 PolarHBondContact O-N 3.49Å; C63-F173 HydrophobicContact CB-CB 4.23Å; C63-F173 HydrophobicContact CB-CD2 4.24Å; C63-F173 WeakPolarHBondContact CB-O 3.28Å; C63-F173 PolarHBondContact N-O 3.19Å; C63-F173 PolarHBondContact SG-O 3.26Å
64	Q	95.3	Very high	81.9	Confident	34 Å²	34	56 Å²	56	16%	0.159	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-58.2	-24.6	165	-69.3	-64.8	-33	0	0	112.3	S58 W61 E62 W66 T67 Q70	S58-Q64 VanDerWaalsContact O-CD 3.32Å; S58-Q64 WeakPolarHBondContact O-CG 3.47Å; S58-Q64 PolarHBondContact O-NE2 2.84Å; S58-Q64 PolarHBondContact OG-NE2 3.13Å; W61-Q64 VanDerWaalsContact O-CB 3.26Å; W61-Q64 WeakPolarHBondContact O-CB 3.48Å; W61-Q64 VanDerWaalsContact O-CG 3.23Å; W61-Q64 WeakPolarHBondContact O-CG 3.04Å; W61-Q64 PolarHBondContact O-N 2.96Å; E62-Q64 PolarHBondContact O-N 3.24Å; Q64-W66 PolarHBondContact O-N 3.43Å; Q64-T67 PolarHBondContact O-N 2.84Å; Q64-T67 PolarHBondContact O-OG1 3.42Å; Q64-Q70 VanDerWaalsContact C-NE2 3.27Å; Q64-Q70 VanDerWaalsContact CB-NE2 3.32Å; Q64-Q70 PolarHBondContact O-NE2 3.19Å
65	N	96	Very high	79	Confident	61 Å²	61	60.2 Å²	60.2	33%	0.326	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-68.1	-12.6	173.2	-67.1	-42.8	0	0	0	113.6	E62 C63 T67 N88 Y91	E62-N65 WeakPolarHBondContact O-CB 3.24Å; E62-N65 PolarHBondContact O-N 3.16Å; E62-N65 PolarHBondContact O-ND2 2.94Å; E62-N65 VanDerWaalsContact O-ND2 3.1Å; E62-N65 PolarHBondContact OE1-ND2 2.76Å; C63-N65 PolarHBondContact O-N 3.23Å; N65-T67 PolarHBondContact O-N 3.42Å; N65-T67 VanDerWaalsContact O-N 3.16Å; N65-N88 WeakPolarHBondContact O-CB 3.39Å; N65-N88 PolarHBondContact O-ND2 2.9Å; N65-Y91 HydrophobicContact CB-CD1 3.87Å; N65-Y91 HydrophobicContact CB-CD2 4.36Å; N65-Y91 HydrophobicContact CB-CE1 3.47Å; N65-Y91 VanDerWaalsContact CB-CE1 3.47Å; N65-Y91 HydrophobicContact CB-CE2 4.04Å; N65-Y91 HydrophobicContact CB-CG 4.3Å; N65-Y91 WeakPolarHBondContact O-CD1 3.33Å
66	W	97.4	Very high	76.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-70.7	-1.5	172.5	-56.1	-8.6	0	0	0	112.7	C63 Q64 N88 Y91 L92 L164 Y171 F173 V200 M202 I293 V295	C63-W66 HydrophobicContact CB-CD2 3.49Å; C63-W66 VanDerWaalsContact CB-CD2 3.49Å; C63-W66 VanDerWaalsContact CB-CE2 3.4Å; C63-W66 HydrophobicContact CB-CE3 3.63Å; C63-W66 HydrophobicContact CB-CG 4.16Å; C63-W66 HydrophobicContact CB-CH2 3.72Å; C63-W66 HydrophobicContact CB-CZ2 3.54Å; C63-W66 HydrophobicContact CB-CZ3 3.75Å; C63-W66 WeakPolarHBondContact O-CB 3.28Å; C63-W66 PolarHBondContact O-N 3.49Å; Q64-W66 PolarHBondContact O-N 3.43Å; W66-N88 WeakPolarHBondContact O-CB 3.48Å; W66-N88 PolarHBondContact O-N 3.39Å; W66-Y91 AromaticContact CD1-CD1 3.8Å; W66-Y91 AromaticContact CD1-CE1 3.76Å; W66-L92 HydrophobicContact CB-CD2 3.98Å; W66-L92 HydrophobicContact CB-CG 4.38Å; W66-L92 HydrophobicContact CD2-CD2 3.85Å; W66-L92 HydrophobicContact CG-CD2 3.51Å; W66-L92 HydrophobicContact CG-CG 4.36Å; W66-L164 HydrophobicContact CH2-CD2 4.25Å; W66-L164 HydrophobicContact CZ2-CD2 4.13Å; W66-Y171 HydrophobicContact CZ2-CE1 4.41Å; W66-Y171 PolarHBondContact NE1-OH 2.86Å; W66-F173 AromaticContact CH2-CD2 3.43Å; W66-F173 HydrophobicContact CH2-CD2 3.43Å; W66-F173 VanDerWaalsContact CH2-CD2 3.43Å; W66-F173 AromaticContact CH2-CE2 3.8Å; W66-F173 HydrophobicContact CH2-CE2 3.8Å; W66-F173 HydrophobicContact CH2-CG 4.16Å; W66-F173 HydrophobicContact CZ2-CB 3.91Å; W66-F173 AromaticContact CZ2-CD2 3.61Å; W66-F173 HydrophobicContact CZ2-CD2 3.61Å; W66-F173 HydrophobicContact CZ2-CE2 4.34Å; W66-F173 AromaticContact CZ2-CG 3.88Å; W66-F173 HydrophobicContact CZ2-CG 3.88Å; W66-V200 HydrophobicContact CH2-CG1 4.16Å; W66-V200 HydrophobicContact CH2-CG2 4.22Å; W66-V200 HydrophobicContact CZ3-CG1 4.1Å; W66-M202 HydrophobicContact CE3-CE 4.32Å; W66-M202 HydrophobicContact CH2-CE 4.45Å; W66-M202 HydrophobicContact CZ3-CE 4.22Å; W66-I293 HydrophobicContact CB-CD1 4.34Å; W66-I293 HydrophobicContact CE3-CB 4.46Å; W66-I293 HydrophobicContact CE3-CD1 4.49Å; W66-I293 HydrophobicContact CE3-CG2 3.44Å; W66-I293 VanDerWaalsContact CE3-CG2 3.44Å; W66-I293 HydrophobicContact CZ3-CG2 3.53Å; W66-V295 HydrophobicContact CZ3-CG2 4.44Å
67	T	94.8	Very high	73.7	Confident	11 Å²	11	66.4 Å²	66.4	7%	0.067	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	148.3	179.1	72.5	0	0	0	0	111.4	Q64 N65 S86 I225 V226	Q64-T67 PolarHBondContact O-N 2.84Å; Q64-T67 PolarHBondContact O-OG1 3.42Å; N65-T67 PolarHBondContact O-N 3.42Å; N65-T67 VanDerWaalsContact O-N 3.16Å; T67-S86 CarbonylContact C-O 3.6Å; T67-S86 WeakPolarHBondContact CA-O 3.48Å; T67-I225 HydrophobicContact CG2-CG2 4.36Å; T67-V226 HydrophobicContact CG2-CB 3.62Å; T67-V226 HydrophobicContact CG2-CG1 4.31Å; T67-V226 HydrophobicContact CG2-CG2 3.87Å
68	V	88.8	Confident	71.1	Confident	69 Å²	69	71.7 Å²	71.7	42%	0.418	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.9	172.5	-175.3	0	0	0	0	108.9	S86 N88	V68-S86 WeakPolarHBondContact CB-OG 3.39Å; V68-S86 PolarHBondContact N-O 3Å; V68-N88 HydrophobicContact CG2-CB 3.72Å
69	G	70.9	Confident	68.5	Low	48 Å²	48	78.2 Å²	78.2	50%	0.495	43%	0.434	S	S	.	.			trans	96.6	45.9	169	0	0	0	0	0	116.3	S71	G69-S71 PolarHBondContact O-N 2.82Å
70	Q	52.8	Low	65.9	Low	113 Å²	113	77.3 Å²	77.3	53%	0.528	44%	0.435	S	S	.	.			trans	-69.6	79.4	163.9	-64.7	-177.2	7.8	0	0	110.3	Q64	Q64-Q70 VanDerWaalsContact C-NE2 3.27Å; Q64-Q70 VanDerWaalsContact CB-NE2 3.32Å; Q64-Q70 PolarHBondContact O-NE2 3.19Å
71	S	39.1	Very low	63.4	Low	83 Å²	83	80.1 Å²	80.1	58%	0.58	45%	0.45	S	S	*	.			trans	-75.7	129.7	153.7	-40.4	0	0	0	0	106.2	G69	G69-S71 PolarHBondContact O-N 2.82Å
72	S	43.8	Very low	60.8	Low	74 Å²	74	84.1 Å²	84.1	52%	0.517	48%	0.477	S	S	.	.			trans	-28.9	143	-177.5	50.9	0	0	0	0	115.9	E74 S75	S72-E74 PolarHBondContact O-N 2.8Å; S72-S75 PolarHBondContact O-N 3.43Å
73	P	43.9	Very low	58.4	Low	115 Å²	115	87.3 Å²	87.3	75%	0.747	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-54.7	-16.7	-174.2	16.4	-29.4	0	0	0	116.1	S75	P73-S75 PolarHBondContact O-N 2.83Å
74	E	38.3	Very low	56.1	Low	187 Å²	187	91.2 Å²	91.2	87%	0.874	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-77.6	-11	-173.3	-63.1	177.8	174.9	0	0	115.4	S72	S72-E74 PolarHBondContact O-N 2.8Å
75	S	37.9	Very low	54.2	Low	90 Å²	90	91.2 Å²	91.2	63%	0.629	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-110.9	16.3	-172.3	90.6	0	0	0	0	116.3	S72 P73	S72-S75 PolarHBondContact O-N 3.43Å; P73-S75 PolarHBondContact O-N 2.83Å
76	R	44.8	Very low	53.6	Low	138 Å²	138	91.3 Å²	91.3	52%	0.521	55%	0.546	S	S	.	.			trans	-95.6	114.1	-178.7	-71.4	-172.5	179.5	-168.1	-1.9	112.5	L78	R76-L78 PolarHBondContact O-N 2.98Å; R76-L78 VanDerWaalsContact O-N 3.16Å
77	D	37.5	Very low	53.5	Low	108 Å²	108	91.9 Å²	91.9	58%	0.578	55%	0.549	S	S	*	.			trans	-72.5	97.3	156.2	-168.9	-7	0	0	0	108.2	N79 S80	D77-N79 PolarHBondContact O-N 2.79Å; D77-N79 PolarHBondContact OD1-N 2.79Å; D77-S80 PolarHBondContact O-N 3.35Å; D77-S80 VanDerWaalsContact O-N 3.07Å; D77-S80 PolarHBondContact O-OG 2.76Å
78	L	40.4	Very low	53.5	Low	127 Å²	127	93.2 Å²	93.2	67%	0.665	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-4.9	-177.3	-67.5	169.5	0	0	0	113.7	R76 R271	R76-L78 PolarHBondContact O-N 2.98Å; R76-L78 VanDerWaalsContact O-N 3.16Å; L78-R271 PolarHBondContact O-NH1 3.02Å
79	N	41.2	Very low	53.9	Low	137 Å²	137	91 Å²	91	73%	0.733	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-9.2	176.7	-69	-37.3	0	0	0	114.2	D77	D77-N79 PolarHBondContact O-N 2.79Å; D77-N79 PolarHBondContact OD1-N 2.79Å
80	S	36.2	Very low	55.1	Low	71 Å²	71	93 Å²	93	50%	0.497	54%	0.54	S	S	.	.	S	Bend	trans	-81.4	135.6	175.4	64.3	0	0	0	0	110.4	D77 P82	D77-S80 PolarHBondContact O-N 3.35Å; D77-S80 VanDerWaalsContact O-N 3.07Å; D77-S80 PolarHBondContact O-OG 2.76Å; S80-P82 VanDerWaalsContact O-CD 3.23Å; S80-P82 WeakPolarHBondContact O-CD 3.49Å
81	N	40.9	Very low	57.3	Low	159 Å²	159	90.2 Å²	90.2	85%	0.85	53%	0.525	S	S	*	.			trans	-47.7	109.8	168.1	-119.4	-9.7	0	0	0	106.7	S83	N81-S83 PolarHBondContact O-N 2.69Å
82	P	43.4	Very low	60.1	Low	95 Å²	95	86.3 Å²	86.3	62%	0.617	50%	0.497	S	S	*	.			trans	-58.8	120.4	-172.8	20.3	-29.7	0	0	0	106.6	S80 A84	S80-P82 VanDerWaalsContact O-CD 3.23Å; S80-P82 WeakPolarHBondContact O-CD 3.49Å; P82-A84 VanDerWaalsContact C-N 3.3Å; P82-A84 WeakPolarHBondContact O-CA 3.3Å; P82-A84 PolarHBondContact O-N 3.47Å
83	S	45.4	Very low	62.6	Low	113 Å²	113	88.2 Å²	88.2	79%	0.79	50%	0.497	S	S	*	.			trans	-49	108.2	160.1	57.9	0	0	0	0	104.8	N81 S85	N81-S83 PolarHBondContact O-N 2.69Å; S83-S85 PolarHBondContact O-N 3.41Å
84	A	49.5	Very low	65.2	Low	83 Å²	83	88.7 Å²	88.7	69%	0.686	50%	0.497	S	S	*	.			trans	-46.7	108.8	-161.7	0	0	0	0	0	109.3	P82 S86	P82-A84 VanDerWaalsContact C-N 3.3Å; P82-A84 WeakPolarHBondContact O-CA 3.3Å; P82-A84 PolarHBondContact O-N 3.47Å; A84-S86 PolarHBondContact O-N 3.4Å
85	S	55.5	Low	68	Low	34 Å²	34	84 Å²	84	24%	0.238	47%	0.474	C	S	.	.			trans	-55	113.3	162.7	-62.4	0	0	0	0	104.6	S83 V226	S83-S85 PolarHBondContact O-N 3.41Å; S85-V226 WeakPolarHBondContact O-CG2 3.49Å
86	S	82.9	Confident	70.9	Confident	63 Å²	63	79.8 Å²	79.8	44%	0.441	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	154.6	-172.5	56.1	0	0	0	0	109.6	T67 V68 A84 N88	T67-S86 CarbonylContact C-O 3.6Å; T67-S86 WeakPolarHBondContact CA-O 3.48Å; V68-S86 WeakPolarHBondContact CB-OG 3.39Å; V68-S86 PolarHBondContact N-O 3Å; A84-S86 PolarHBondContact O-N 3.4Å; S86-N88 PolarHBondContact O-N 3.45Å
87	I	94.6	Very high	73.2	Confident	12 Å²	12	77 Å²	77	6%	0.062	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	128.4	175	-52.7	-53.7	0	0	0	109.2	F89 L92 W128 V226 D291 I293	I87-F89 VanDerWaalsContact C-N 3.28Å; I87-F89 HydrophobicContact CB-CD2 4.03Å; I87-F89 HydrophobicContact CB-CE1 4.31Å; I87-F89 HydrophobicContact CB-CE2 3.63Å; I87-F89 HydrophobicContact CB-CZ 3.78Å; I87-F89 HydrophobicContact CG1-CE2 4.41Å; I87-F89 HydrophobicContact CG1-CZ 4.24Å; I87-F89 HydrophobicContact CG2-CD1 3.99Å; I87-F89 HydrophobicContact CG2-CD2 4.1Å; I87-F89 HydrophobicContact CG2-CE1 3.85Å; I87-F89 HydrophobicContact CG2-CE2 3.99Å; I87-F89 HydrophobicContact CG2-CG 4.11Å; I87-F89 HydrophobicContact CG2-CZ 3.85Å; I87-F89 WeakPolarHBondContact O-CD2 3.24Å; I87-F89 PolarHBondContact O-N 2.98Å; I87-L92 HydrophobicContact CG2-CD1 3.68Å; I87-W128 HydrophobicContact CD1-CH2 3.97Å; I87-W128 HydrophobicContact CD1-CZ2 4.28Å; I87-W128 HydrophobicContact CG1-CH2 3.87Å; I87-W128 HydrophobicContact CG1-CZ2 3.93Å; I87-W128 HydrophobicContact CG1-CZ3 4.47Å; I87-W128 HydrophobicContact CG2-CH2 4.44Å; I87-W128 HydrophobicContact CG2-CZ3 4.27Å; I87-V226 HydrophobicContact CD1-CB 4.41Å; I87-V226 HydrophobicContact CD1-CG1 3.35Å; I87-V226 HydrophobicContact CD1-CG2 4.21Å; I87-D291 HydrophobicContact CG1-CB 4.29Å; I87-I293 HydrophobicContact CD1-CD1 3.83Å; I87-I293 HydrophobicContact CD1-CG1 3.94Å; I87-I293 HydrophobicContact CG2-CD1 4.02Å
88	N	96.3	Very high	76.1	Confident	39 Å²	39	75.4 Å²	75.4	21%	0.209	44%	0.438	C	S	.	.			trans	-84.2	72.9	174.3	-166.7	-11.6	0	0	0	110.3	N65 W66 V68 S86 D90 Y91 L92	N65-N88 WeakPolarHBondContact O-CB 3.39Å; N65-N88 PolarHBondContact O-ND2 2.9Å; W66-N88 WeakPolarHBondContact O-CB 3.48Å; W66-N88 PolarHBondContact O-N 3.39Å; V68-N88 HydrophobicContact CG2-CB 3.72Å; S86-N88 PolarHBondContact O-N 3.45Å; N88-D90 PolarHBondContact O-N 3.32Å; N88-Y91 VanDerWaalsContact ND2-CB 3.31Å; N88-Y91 WeakPolarHBondContact ND2-CB 3.45Å; N88-Y91 PolarHBondContact O-N 2.97Å; N88-Y91 WeakPolarHBondContact OD1-CB 3.38Å; N88-Y91 PolarHBondContact OD1-N 2.98Å; N88-Y91 VanDerWaalsContact OD1-N 3.13Å; N88-L92 PolarHBondContact O-N 3.41Å
89	F	96.4	Very high	78.7	Confident	21 Å²	21	70.4 Å²	70.4	9%	0.092	42%	0.417	C	S	.	.	H	α-helix	trans	-55.6	-37.5	-178.5	-69.5	-78	0	0	0	112.8	I87 L92 K93 L125 W128 R129 I132	I87-F89 VanDerWaalsContact C-N 3.28Å; I87-F89 HydrophobicContact CB-CD2 4.03Å; I87-F89 HydrophobicContact CB-CE1 4.31Å; I87-F89 HydrophobicContact CB-CE2 3.63Å; I87-F89 HydrophobicContact CB-CZ 3.78Å; I87-F89 HydrophobicContact CG1-CE2 4.41Å; I87-F89 HydrophobicContact CG1-CZ 4.24Å; I87-F89 HydrophobicContact CG2-CD1 3.99Å; I87-F89 HydrophobicContact CG2-CD2 4.1Å; I87-F89 HydrophobicContact CG2-CE1 3.85Å; I87-F89 HydrophobicContact CG2-CE2 3.99Å; I87-F89 HydrophobicContact CG2-CG 4.11Å; I87-F89 HydrophobicContact CG2-CZ 3.85Å; I87-F89 WeakPolarHBondContact O-CD2 3.24Å; I87-F89 PolarHBondContact O-N 2.98Å; F89-L92 PolarHBondContact O-N 2.9Å; F89-K93 VanDerWaalsContact O-CB 3.3Å; F89-K93 WeakPolarHBondContact O-CB 3.38Å; F89-K93 PolarHBondContact O-N 3.01Å; F89-L125 HydrophobicContact CD1-CB 4.2Å; F89-L125 HydrophobicContact CD1-CD2 4.02Å; F89-L125 HydrophobicContact CE1-CD2 4.33Å; F89-W128 HydrophobicContact CE1-CB 4.13Å; F89-W128 AromaticContact CE1-CD2 3.82Å; F89-W128 HydrophobicContact CE1-CD2 3.82Å; F89-W128 AromaticContact CE1-CE3 3.7Å; F89-W128 HydrophobicContact CE1-CE3 3.7Å; F89-W128 HydrophobicContact CE1-CG 4.01Å; F89-W128 HydrophobicContact CE1-CZ3 4.39Å; F89-W128 AromaticContact CZ-CD2 3.97Å; F89-W128 HydrophobicContact CZ-CD2 3.97Å; F89-W128 HydrophobicContact CZ-CE3 4.22Å; F89-W128 HydrophobicContact CZ-CG 4.09Å; F89-R129 HydrophobicContact CD1-CB 4.17Å; F89-R129 HydrophobicContact CD2-CB 4.19Å; F89-R129 HydrophobicContact CD2-CG 4.06Å; F89-R129 HydrophobicContact CE1-CB 4.11Å; F89-R129 HydrophobicContact CE2-CB 4.1Å; F89-R129 HydrophobicContact CE2-CG 4.19Å; F89-R129 HydrophobicContact CG-CB 4.22Å; F89-R129 HydrophobicContact CG-CG 4.38Å; F89-R129 HydrophobicContact CZ-CB 4.08Å; F89-I132 HydrophobicContact CE2-CD1 3.94Å; F89-I132 HydrophobicContact CZ-CD1 3.76Å
90	D	96.5	Very high	81.3	Confident	92 Å²	92	67 Å²	67	49%	0.492	40%	0.402	S	S	.	.	H	α-helix	trans	-70.3	-39.1	-177.9	-59.9	-36.3	0	0	0	111.2	N88 T94 R129	N88-D90 PolarHBondContact O-N 3.32Å; D90-T94 WeakPolarHBondContact O-CB 3.21Å; D90-T94 PolarHBondContact O-N 2.91Å; D90-T94 PolarHBondContact O-OG1 3.29Å; D90-R129 IonicContact OD1-CZ 3.91Å; D90-R129 IonicContact OD1-NH1 3.5Å; D90-R129 PolarHBondContact OD1-NH1 3.27Å; D90-R129 IonicContact OD2-NH1 2.78Å; D90-R129 IonicContact OD2-NH2 2.76Å
91	Y	97.8	Very high	84.3	Confident	54 Å²	54	63.7 Å²	63.7	21%	0.212	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-50	172.1	-176.9	-97	0	0	0	111.8	E62 N65 W66 N88 K93 T94 K95	E62-Y91 PolarHBondContact OE1-OH 2.93Å; N65-Y91 HydrophobicContact CB-CD1 3.87Å; N65-Y91 HydrophobicContact CB-CD2 4.36Å; N65-Y91 HydrophobicContact CB-CE1 3.47Å; N65-Y91 VanDerWaalsContact CB-CE1 3.47Å; N65-Y91 HydrophobicContact CB-CE2 4.04Å; N65-Y91 HydrophobicContact CB-CG 4.3Å; N65-Y91 WeakPolarHBondContact O-CD1 3.33Å; W66-Y91 AromaticContact CD1-CD1 3.8Å; W66-Y91 AromaticContact CD1-CE1 3.76Å; N88-Y91 VanDerWaalsContact ND2-CB 3.31Å; N88-Y91 WeakPolarHBondContact ND2-CB 3.45Å; N88-Y91 PolarHBondContact O-N 2.97Å; N88-Y91 WeakPolarHBondContact OD1-CB 3.38Å; N88-Y91 PolarHBondContact OD1-N 2.98Å; N88-Y91 VanDerWaalsContact OD1-N 3.13Å; Y91-K93 VanDerWaalsContact C-N 3.3Å; Y91-K93 PolarHBondContact O-N 2.85Å; Y91-T94 PolarHBondContact O-N 2.96Å; Y91-T94 VanDerWaalsContact O-N 3.08Å; Y91-K95 HydrophobicContact CD1-CB 4.25Å; Y91-K95 HydrophobicContact CE1-CB 3.83Å; Y91-K95 HydrophobicContact CE1-CG 3.86Å; Y91-K95 HydrophobicContact CE2-CB 4.43Å; Y91-K95 VanDerWaalsContact O-CB 3.24Å; Y91-K95 WeakPolarHBondContact O-CB 3.35Å; Y91-K95 PolarHBondContact O-N 3.26Å; Y91-K95 VanDerWaalsContact OH-CD 3.32Å; Y91-K95 WeakPolarHBondContact OH-CD 3.47Å; Y91-K95 WeakPolarHBondContact OH-CE 3.33Å; Y91-K95 WeakPolarHBondContact OH-CG 3.38Å
92	L	98.3	Very high	87	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-54.7	-47.4	178.4	-74	169.9	0	0	0	111.4	W66 I87 N88 F89 T94 K95 I96 F121 L125 M202 I293	W66-L92 HydrophobicContact CB-CD2 3.98Å; W66-L92 HydrophobicContact CB-CG 4.38Å; W66-L92 HydrophobicContact CD2-CD2 3.85Å; W66-L92 HydrophobicContact CG-CD2 3.51Å; W66-L92 HydrophobicContact CG-CG 4.36Å; I87-L92 HydrophobicContact CG2-CD1 3.68Å; N88-L92 PolarHBondContact O-N 3.41Å; F89-L92 PolarHBondContact O-N 2.9Å; L92-T94 VanDerWaalsContact C-N 3.31Å; L92-T94 PolarHBondContact O-N 3.08Å; L92-K95 PolarHBondContact O-N 3.1Å; L92-I96 HydrophobicContact CD2-CD1 3.98Å; L92-I96 PolarHBondContact O-N 3.44Å; L92-F121 HydrophobicContact CB-CE1 4.46Å; L92-F121 HydrophobicContact CB-CZ 4.32Å; L92-L125 HydrophobicContact CB-CD1 3.82Å; L92-L125 HydrophobicContact CD1-CD2 4.07Å; L92-M202 HydrophobicContact CD2-CE 3.88Å; L92-I293 HydrophobicContact CD1-CD1 4.01Å
93	K	97.2	Very high	89.5	Confident	115 Å²	115	54.2 Å²	54.2	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-34.3	178.3	-169.6	176	-177.3	172.3	0	113.2	F89 Y91 H122 L125	F89-K93 VanDerWaalsContact O-CB 3.3Å; F89-K93 WeakPolarHBondContact O-CB 3.38Å; F89-K93 PolarHBondContact O-N 3.01Å; Y91-K93 VanDerWaalsContact C-N 3.3Å; Y91-K93 PolarHBondContact O-N 2.85Å; K93-H122 WeakPolarHBondContact CE-ND1 3.15Å; K93-H122 PolarHBondContact O-CE1 3.44Å; K93-H122 VanDerWaalsContact O-CE1 3.27Å; K93-H122 PolarHBondContact O-NE2 3.38Å; K93-L125 HydrophobicContact CB-CD1 4.27Å
94	T	97.5	Very high	91.7	Very high	124 Å²	124	48.8 Å²	48.8	76%	0.761	29%	0.288	S	S	*	.	H	α-helix	trans	-78.6	-38.4	179.5	-57.9	0	0	0	0	111.9	D90 Y91 L92	D90-T94 WeakPolarHBondContact O-CB 3.21Å; D90-T94 PolarHBondContact O-N 2.91Å; D90-T94 PolarHBondContact O-OG1 3.29Å; Y91-T94 PolarHBondContact O-N 2.96Å; Y91-T94 VanDerWaalsContact O-N 3.08Å; L92-T94 VanDerWaalsContact C-N 3.31Å; L92-T94 PolarHBondContact O-N 3.08Å
95	K	97.7	Very high	93.6	Very high	88 Å²	88	45.6 Å²	45.6	38%	0.383	26%	0.26	S	S	.	.	H	α-helix	trans	-84.9	-37.9	-171.1	-172.4	63.6	170.2	-169.4	0	113	Y91 L92 Y171	Y91-K95 HydrophobicContact CD1-CB 4.25Å; Y91-K95 HydrophobicContact CE1-CB 3.83Å; Y91-K95 HydrophobicContact CE1-CG 3.86Å; Y91-K95 HydrophobicContact CE2-CB 4.43Å; Y91-K95 VanDerWaalsContact O-CB 3.24Å; Y91-K95 WeakPolarHBondContact O-CB 3.35Å; Y91-K95 PolarHBondContact O-N 3.26Å; Y91-K95 VanDerWaalsContact OH-CD 3.32Å; Y91-K95 WeakPolarHBondContact OH-CD 3.47Å; Y91-K95 WeakPolarHBondContact OH-CE 3.33Å; Y91-K95 WeakPolarHBondContact OH-CG 3.38Å; L92-K95 PolarHBondContact O-N 3.1Å; K95-Y171 HydrophobicContact CD-CE2 4.21Å; K95-Y171 HydrophobicContact CG-CE1 4.06Å; K95-Y171 HydrophobicContact CG-CE2 3.96Å
96	I	97.9	Very high	95	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	25%	0.251	C	S	.	.	S	Bend	trans	-107.9	125	-176.6	-58.6	162.2	0	0	0	108.9	L92 F121 H122 W162 L164 M168 Y171	L92-I96 HydrophobicContact CD2-CD1 3.98Å; L92-I96 PolarHBondContact O-N 3.44Å; I96-F121 HydrophobicContact CB-CD1 4.13Å; I96-F121 HydrophobicContact CB-CE1 3.73Å; I96-F121 HydrophobicContact CD1-CE1 4.05Å; I96-F121 HydrophobicContact CD1-CZ 4.12Å; I96-F121 HydrophobicContact CG1-CE1 4.5Å; I96-F121 HydrophobicContact CG2-CD1 3.83Å; I96-F121 HydrophobicContact CG2-CE1 3.83Å; I96-H122 PolarHBondContact O-NE2 3.25Å; I96-W162 HydrophobicContact CD1-CH2 4.16Å; I96-W162 HydrophobicContact CD1-CZ3 4.5Å; I96-W162 HydrophobicContact CG2-CH2 3.73Å; I96-W162 HydrophobicContact CG2-CZ2 4.03Å; I96-L164 HydrophobicContact CD1-CD2 3.91Å; I96-L164 HydrophobicContact CG2-CD1 4.08Å; I96-M168 HydrophobicContact CB-SD 4.37Å; I96-M168 HydrophobicContact CG1-SD 4.43Å; I96-M168 HydrophobicContact CG2-SD 3.83Å; I96-Y171 HydrophobicContact CD1-CE1 4.25Å; I96-Y171 HydrophobicContact CG1-CD1 4.39Å; I96-Y171 HydrophobicContact CG1-CE1 3.83Å
97	S	94.4	Very high	94.8	Very high	81 Å²	81	44.1 Å²	44.1	57%	0.566	25%	0.245	S	C	*	.			trans	-60.3	149	178.9	50.4	0	0	0	0	111.5
98	D	97	Very high	93.7	Very high	74 Å²	74	45.7 Å²	45.7	40%	0.396	26%	0.257	S	S	.	.			trans	-69.8	141.6	172.6	-159.7	22.4	0	0	0	110.7	N120 F121 H122	D98-N120 WeakPolarHBondContact OD1-CB 3.18Å; D98-F121 PolarHBondContact OD1-N 3.1Å; D98-H122 HydrophobicContact CB-CB 4.3Å; D98-H122 VanDerWaalsContact CG-CG 3.5Å; D98-H122 PolarHBondContact N-NE2 3.19Å; D98-H122 WeakPolarHBondContact OD1-CB 3.28Å; D98-H122 IonicContact OD1-CD2 2.8Å; D98-H122 IonicContact OD1-CG 3.47Å; D98-H122 PolarHBondContact OD1-N 2.97Å
99	G	95.7	Very high	92.1	Very high	21 Å²	21	48 Å²	48	22%	0.216	28%	0.276	C	S	.	.			trans	173.4	167.5	-176.3	0	0	0	0	0	112.1	V101 N120 F121	G99-V101 PolarHBondContact O-N 2.96Å; G99-N120 CarbonylContact O-C 3.52Å; G99-N120 WeakPolarHBondContact O-CA 3.45Å; G99-F121 PolarHBondContact O-N 3.43Å
100	P	97	Very high	90.4	Very high	66 Å²	66	54.1 Å²	54.1	43%	0.429	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	130.5	-176.2	25	-33.4	0	0	0	111.9	E118 L119	P100-E118 HydrophobicContact CB-CG 3.53Å; P100-E118 WeakPolarHBondContact CB-OE1 2.91Å; P100-L119 CarbonylContact C-O 3.46Å; P100-L119 WeakPolarHBondContact CA-O 3.33Å
101	V	98	Very high	88.8	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.6	176.3	-65.5	0	0	0	0	111.7	G99 V103 L119 F121 L159 W162	G99-V101 PolarHBondContact O-N 2.96Å; V101-V103 HydrophobicContact CG2-CG2 4.1Å; V101-V103 PolarHBondContact O-N 3.11Å; V101-L119 WeakPolarHBondContact CG2-O 3.45Å; V101-L119 PolarHBondContact N-O 3.39Å; V101-L119 PolarHBondContact O-N 3.31Å; V101-F121 HydrophobicContact CG1-CB 3.84Å; V101-F121 HydrophobicContact CG1-CD2 4.14Å; V101-F121 HydrophobicContact CG1-CG 4.33Å; V101-F121 HydrophobicContact CG2-CB 4.3Å; V101-F121 HydrophobicContact CG2-CD2 4.42Å; V101-L159 HydrophobicContact CB-CD1 3.97Å; V101-L159 HydrophobicContact CB-CG 4.28Å; V101-L159 HydrophobicContact CG1-CD1 4.31Å; V101-L159 HydrophobicContact CG2-CD1 3.79Å; V101-L159 HydrophobicContact CG2-CG 4.31Å; V101-W162 HydrophobicContact CG1-CD2 4.08Å; V101-W162 HydrophobicContact CG1-CG 4.41Å; V101-W162 HydrophobicContact CG1-CH2 4.32Å; V101-W162 HydrophobicContact CG1-CZ2 3.67Å
102	P	97.2	Very high	87.3	Confident	52 Å²	52	61 Å²	61	34%	0.338	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	123.1	176.8	28.7	-33.8	0	0	0	111.1	L159 K160 W162	P102-L159 WeakPolarHBondContact O-CA 3.35Å; P102-K160 WeakPolarHBondContact CB-O 3.43Å; P102-K160 WeakPolarHBondContact CG-O 3.46Å; P102-K160 PolarHBondContact O-N 2.99Å; P102-W162 HydrophobicContact CG-CB 4.1Å
103	V	95.9	Very high	86	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.012	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.2	179.4	-178.5	0	0	0	0	109.6	V101 K116 L117 L119 Y124 L157 Y158 L159	V101-V103 HydrophobicContact CG2-CG2 4.1Å; V101-V103 PolarHBondContact O-N 3.11Å; V103-K116 WeakPolarHBondContact O-CA 3.39Å; V103-L117 HydrophobicContact CB-CD1 3.86Å; V103-L117 HydrophobicContact CB-CG 4.14Å; V103-L117 HydrophobicContact CG1-CD1 4.09Å; V103-L117 HydrophobicContact CG1-CG 4.36Å; V103-L117 PolarHBondContact N-O 2.79Å; V103-L117 PolarHBondContact O-N 3.29Å; V103-L119 HydrophobicContact CG1-CD1 4.46Å; V103-L119 HydrophobicContact CG2-CB 4.27Å; V103-L119 HydrophobicContact CG2-CD1 4.28Å; V103-L119 HydrophobicContact CG2-CG 4.42Å; V103-Y124 HydrophobicContact CG1-CD2 4.22Å; V103-Y124 HydrophobicContact CG1-CE2 4.29Å; V103-Y124 HydrophobicContact CG2-CD2 3.87Å; V103-Y124 HydrophobicContact CG2-CE2 4.42Å; V103-Y124 HydrophobicContact CG2-CG 4.38Å; V103-L157 HydrophobicContact CG1-CB 3.78Å; V103-L157 HydrophobicContact CG1-CD2 4.09Å; V103-L157 HydrophobicContact CG1-CG 4.41Å; V103-Y158 CarbonylContact C-O 3.57Å; V103-Y158 WeakPolarHBondContact CA-O 3.48Å; V103-L159 HydrophobicContact CG2-CB 4.32Å
104	A	92.4	Very high	84.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.4	173.3	0	0	0	0	0	109.8	H114 T115 L157 Y158 K160	A104-H114 HydrophobicContact CB-CB 3.77Å; A104-T115 WeakPolarHBondContact CA-O 3.45Å; A104-L157 CarbonylContact O-C 3.58Å; A104-L157 WeakPolarHBondContact O-CA 3.36Å; A104-Y158 PolarHBondContact N-O 3.02Å; A104-Y158 PolarHBondContact O-N 2.93Å; A104-K160 HydrophobicContact CB-CD 3.92Å; A104-K160 HydrophobicContact CB-CG 4.11Å
105	N	88.9	Confident	83.9	Confident	16 Å²	16	54.6 Å²	54.6	9%	0.086	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.5	169.3	-171	-4.3	0	0	0	110.2	N107 S108 T115 L117 D155 N156 L157	N105-N107 PolarHBondContact O-N 3.24Å; N105-N107 VanDerWaalsContact O-N 3.12Å; N105-N107 PolarHBondContact OD1-N 3.43Å; N105-S108 PolarHBondContact O-N 2.97Å; N105-S108 VanDerWaalsContact O-N 3.09Å; N105-T115 PolarHBondContact N-O 3.28Å; N105-L117 HydrophobicContact CB-CD2 4.35Å; N105-D155 PolarHBondContact ND2-OD1 3.49Å; N105-N156 PolarHBondContact OD1-N 3.22Å; N105-N156 VanDerWaalsContact OD1-N 3.09Å; N105-L157 HydrophobicContact CB-CD2 4.16Å
106	C	84.6	Confident	83.2	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.061	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	-12.7	-179.3	-72.6	0	0	0	0	114.2	N156 W208	C106-N156 HydrophobicContact CB-CB 3.99Å; C106-N156 WeakPolarHBondContact CB-ND2 3.49Å; C106-N156 PolarHBondContact N-O 3.33Å; C106-W208 PolarHBondContact O-NE1 2.78Å; C106-W208 PolarHBondContact SG-N 3.4Å; C106-W208 VanDerWaalsContact SG-N 3.41Å; C106-W208 PolarHBondContact SG-O 3.18Å
107	N	79.3	Confident	82.8	Confident	56 Å²	56	60.5 Å²	60.5	30%	0.299	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	0.2	177.4	-67.9	-8.6	0	0	0	113	N105 P151 G154 N156	N105-N107 PolarHBondContact O-N 3.24Å; N105-N107 VanDerWaalsContact O-N 3.12Å; N105-N107 PolarHBondContact OD1-N 3.43Å; N107-P151 HydrophobicContact CB-CB 4.08Å; N107-P151 HydrophobicContact CB-CG 3.49Å; N107-P151 VanDerWaalsContact CB-CG 3.49Å; N107-P151 WeakPolarHBondContact ND2-CB 3.25Å; N107-P151 VanDerWaalsContact OD1-CB 3.3Å; N107-P151 WeakPolarHBondContact OD1-CB 3.32Å; N107-P151 WeakPolarHBondContact OD1-CG 3.32Å; N107-G154 PolarHBondContact ND2-O 3.05Å; N107-N156 HydrophobicContact CB-CB 4.41Å; N107-N156 VanDerWaalsContact CG-CB 3.48Å; N107-N156 WeakPolarHBondContact ND2-CB 3.41Å; N107-N156 WeakPolarHBondContact OD1-CB 3.19Å
108	S	70.8	Confident	82.7	Confident	46 Å²	46	63.6 Å²	63.6	32%	0.322	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.2	-179.8	178.1	0	0	0	0	110.1	N105 T115	N105-S108 PolarHBondContact O-N 2.97Å; N105-S108 VanDerWaalsContact O-N 3.09Å; S108-T115 PolarHBondContact O-N 2.83Å; S108-T115 PolarHBondContact O-OG1 3.28Å; S108-T115 PolarHBondContact OG-OG1 2.92Å
109	S	63.3	Low	82.6	Confident	88 Å²	88	61.8 Å²	61.8	62%	0.615	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.2	173.8	58	0	0	0	0	111.7	S113	S109-S113 CarbonylContact C-O 3.57Å; S109-S113 WeakPolarHBondContact CA-O 3.24Å
110	Y	61.8	Low	82.7	Confident	149 Å²	149	64 Å²	64	58%	0.584	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	112	169.2	-172.9	-100	0	0	0	107.5	S113	Y110-S113 PolarHBondContact N-O 3.08Å; Y110-S113 PolarHBondContact O-N 3.43Å; Y110-S113 VanDerWaalsContact O-N 3.14Å; Y110-S113 VanDerWaalsContact O-O 3.08Å; Y110-S113 PolarHBondContact O-OG 2.92Å
111	F	61.7	Low	82.7	Confident	171 Å²	171	61 Å²	61	75%	0.75	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.6	73.4	-179.6	-71.2	-85	0	0	0	114.9	S113	F111-S113 PolarHBondContact O-N 2.81Å
112	N	67.2	Low	82.8	Confident	119 Å²	119	62.5 Å²	62.5	64%	0.636	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	24.7	179	-62.8	-18.7	0	0	0	114.7	F251	N112-F251 HydrophobicContact CB-CD2 4.32Å; N112-F251 WeakPolarHBondContact O-CD2 3.19Å; N112-F251 WeakPolarHBondContact O-CE2 3.31Å
113	S	70.4	Confident	82.8	Confident	49 Å²	49	64 Å²	64	34%	0.343	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	159.3	174.7	75.7	0	0	0	0	109.6	S109 Y110 F111	S109-S113 CarbonylContact C-O 3.57Å; S109-S113 WeakPolarHBondContact CA-O 3.24Å; Y110-S113 PolarHBondContact N-O 3.08Å; Y110-S113 PolarHBondContact O-N 3.43Å; Y110-S113 VanDerWaalsContact O-N 3.14Å; Y110-S113 VanDerWaalsContact O-O 3.08Å; Y110-S113 PolarHBondContact O-OG 2.92Å; F111-S113 PolarHBondContact O-N 2.81Å
114	H	73.6	Confident	82.8	Confident	8 Å²	8	64 Å²	64	4%	0.037	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	142.9	167.7	-64	135.5	0	0	0	109.9	A104 K116 W208 F251	A104-H114 HydrophobicContact CB-CB 3.77Å; H114-K116 PolarHBondContact O-N 2.89Å; H114-K116 VanDerWaalsContact O-N 3.08Å; H114-W208 AromaticContact CE1-CD2 3.9Å; H114-W208 AromaticContact CE1-CE2 3.79Å; H114-W208 PolarHBondContact CE1-O 2.91Å; H114-W208 AromaticContact NE2-CD2 3.86Å; H114-W208 AromaticContact NE2-CE2 3.27Å; H114-W208 VanDerWaalsContact NE2-CE2 3.27Å; H114-W208 AromaticContact NE2-CH2 3.74Å; H114-W208 AromaticContact NE2-CZ2 3.2Å; H114-W208 WeakPolarHBondContact NE2-CZ2 3.29Å; H114-W208 AromaticContact NE2-NE1 3.71Å; H114-F251 AromaticContact CD2-CZ 3.72Å; H114-F251 AromaticContact NE2-CZ 3.68Å
115	T	77.8	Confident	83.1	Confident	47 Å²	47	64.3 Å²	64.3	29%	0.288	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	117.6	170	-58.4	0	0	0	0	109.2	A104 N105 S108	A104-T115 WeakPolarHBondContact CA-O 3.45Å; N105-T115 PolarHBondContact N-O 3.28Å; S108-T115 PolarHBondContact O-N 2.83Å; S108-T115 PolarHBondContact O-OG1 3.28Å; S108-T115 PolarHBondContact OG-OG1 2.92Å
116	K	82	Confident	83.4	Confident	154 Å²	154	66.2 Å²	66.2	67%	0.67	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	136.7	174.9	-66.2	-172.2	178.7	-171.2	0	109.9	V103 H114	V103-K116 WeakPolarHBondContact O-CA 3.39Å; H114-K116 PolarHBondContact O-N 2.89Å; H114-K116 VanDerWaalsContact O-N 3.08Å
117	L	89.1	Confident	83.8	Confident	60 Å²	60	71 Å²	71	31%	0.314	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	160.3	175.5	62.6	102.8	0	0	0	109.4	V103 N105 L119 L157	V103-L117 HydrophobicContact CB-CD1 3.86Å; V103-L117 HydrophobicContact CB-CG 4.14Å; V103-L117 HydrophobicContact CG1-CD1 4.09Å; V103-L117 HydrophobicContact CG1-CG 4.36Å; V103-L117 PolarHBondContact N-O 2.79Å; V103-L117 PolarHBondContact O-N 3.29Å; N105-L117 HydrophobicContact CB-CD2 4.35Å; L117-L119 HydrophobicContact CD1-CD1 3.85Å; L117-L119 HydrophobicContact CD1-CD2 3.99Å; L117-L119 HydrophobicContact CD1-CG 3.49Å; L117-L119 VanDerWaalsContact CD1-CG 3.49Å; L117-L157 HydrophobicContact CD2-CD2 4.12Å
118	E	92.9	Very high	84.6	Confident	146 Å²	146	68.6 Å²	68.6	68%	0.682	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.4	176	-171	175.2	91.1	0	0	108.6	P100	P100-E118 HydrophobicContact CB-CG 3.53Å; P100-E118 WeakPolarHBondContact CB-OE1 2.91Å
119	L	94.8	Very high	85.6	Confident	36 Å²	36	70.8 Å²	70.8	19%	0.188	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	154.8	170.2	-68.7	175.9	0	0	0	108.9	P100 V101 V103 L117 Y124 K127 L157	P100-L119 CarbonylContact C-O 3.46Å; P100-L119 WeakPolarHBondContact CA-O 3.33Å; V101-L119 WeakPolarHBondContact CG2-O 3.45Å; V101-L119 PolarHBondContact N-O 3.39Å; V101-L119 PolarHBondContact O-N 3.31Å; V103-L119 HydrophobicContact CG1-CD1 4.46Å; V103-L119 HydrophobicContact CG2-CB 4.27Å; V103-L119 HydrophobicContact CG2-CD1 4.28Å; V103-L119 HydrophobicContact CG2-CG 4.42Å; L117-L119 HydrophobicContact CD1-CD1 3.85Å; L117-L119 HydrophobicContact CD1-CD2 3.99Å; L117-L119 HydrophobicContact CD1-CG 3.49Å; L117-L119 VanDerWaalsContact CD1-CG 3.49Å; L119-Y124 HydrophobicContact CD1-CD2 4.4Å; L119-K127 HydrophobicContact CD1-CD 4.06Å; L119-L157 HydrophobicContact CD1-CD1 4.02Å
120	N	97.6	Very high	87	Confident	69 Å²	69	69.9 Å²	69.9	37%	0.369	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	138.9	160.9	-76.3	-24.8	0	0	0	109.7	D98 G99 H122 D123 Y124	D98-N120 WeakPolarHBondContact OD1-CB 3.18Å; G99-N120 CarbonylContact O-C 3.52Å; G99-N120 WeakPolarHBondContact O-CA 3.45Å; N120-H122 VanDerWaalsContact C-N 3.27Å; N120-H122 PolarHBondContact O-N 2.95Å; N120-D123 HydrophobicContact CB-CB 4.38Å; N120-D123 WeakPolarHBondContact O-CB 3.22Å; N120-D123 PolarHBondContact O-N 2.9Å; N120-D123 VanDerWaalsContact O-N 3.09Å; N120-Y124 PolarHBondContact O-N 3.2Å
121	F	98.3	Very high	88.3	Confident	1 Å²	1	64.5 Å²	64.5	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-54.2	-42.3	-176.1	-179	-123.6	0	0	0	112.5	L92 I96 D98 G99 V101 D123 Y124 L125 L159 W162 M202	L92-F121 HydrophobicContact CB-CE1 4.46Å; L92-F121 HydrophobicContact CB-CZ 4.32Å; I96-F121 HydrophobicContact CB-CD1 4.13Å; I96-F121 HydrophobicContact CB-CE1 3.73Å; I96-F121 HydrophobicContact CD1-CE1 4.05Å; I96-F121 HydrophobicContact CD1-CZ 4.12Å; I96-F121 HydrophobicContact CG1-CE1 4.5Å; I96-F121 HydrophobicContact CG2-CD1 3.83Å; I96-F121 HydrophobicContact CG2-CE1 3.83Å; D98-F121 PolarHBondContact OD1-N 3.1Å; G99-F121 PolarHBondContact O-N 3.43Å; V101-F121 HydrophobicContact CG1-CB 3.84Å; V101-F121 HydrophobicContact CG1-CD2 4.14Å; V101-F121 HydrophobicContact CG1-CG 4.33Å; V101-F121 HydrophobicContact CG2-CB 4.3Å; V101-F121 HydrophobicContact CG2-CD2 4.42Å; F121-D123 PolarHBondContact O-N 3.42Å; F121-Y124 HydrophobicContact CD2-CD1 4.49Å; F121-Y124 WeakPolarHBondContact O-CB 3.34Å; F121-Y124 PolarHBondContact O-N 2.79Å; F121-L125 HydrophobicContact CD1-CD1 4.17Å; F121-L125 HydrophobicContact CD2-CG 4.39Å; F121-L125 HydrophobicContact CE1-CD1 3.59Å; F121-L125 HydrophobicContact CE1-CG 4.17Å; F121-L125 HydrophobicContact CE2-CD1 4.29Å; F121-L125 HydrophobicContact CE2-CD2 3.9Å; F121-L125 HydrophobicContact CE2-CG 3.99Å; F121-L125 HydrophobicContact CZ-CD1 3.67Å; F121-L125 HydrophobicContact CZ-CD2 3.84Å; F121-L125 HydrophobicContact CZ-CG 3.87Å; F121-L125 WeakPolarHBondContact O-CG 3.27Å; F121-L125 PolarHBondContact O-N 3.36Å; F121-L159 HydrophobicContact CD2-CD1 3.88Å; F121-L159 HydrophobicContact CE2-CD1 3.98Å; F121-W162 HydrophobicContact CD1-CH2 4.19Å; F121-W162 AromaticContact CD2-CH2 3.66Å; F121-W162 HydrophobicContact CD2-CH2 3.66Å; F121-W162 HydrophobicContact CD2-CZ2 4.38Å; F121-W162 AromaticContact CD2-CZ3 4Å; F121-W162 HydrophobicContact CD2-CZ3 4Å; F121-W162 HydrophobicContact CE1-CH2 4.14Å; F121-W162 AromaticContact CE2-CH2 3.59Å; F121-W162 HydrophobicContact CE2-CH2 3.59Å; F121-W162 AromaticContact CE2-CZ3 3.59Å; F121-W162 HydrophobicContact CE2-CZ3 3.59Å; F121-W162 AromaticContact CG-CH2 3.98Å; F121-W162 HydrophobicContact CG-CH2 3.98Å; F121-W162 HydrophobicContact CG-CZ2 4.48Å; F121-W162 AromaticContact CZ-CH2 3.84Å; F121-W162 HydrophobicContact CZ-CH2 3.84Å; F121-W162 HydrophobicContact CZ-CZ3 4.02Å; F121-M202 HydrophobicContact CE2-CE 4.37Å; F121-M202 HydrophobicContact CE2-SD 3.75Å; F121-M202 HydrophobicContact CZ-CE 4.27Å; F121-M202 HydrophobicContact CZ-SD 4.04Å
122	H	98.3	Very high	89.5	Confident	35 Å²	35	59 Å²	59	16%	0.162	31%	0.31	C	S	.	.	H	α-helix	trans	-70.3	-33.9	-178.7	-68.9	-161.8	0	0	0	112	K93 I96 D98 N120 L125 A126	K93-H122 WeakPolarHBondContact CE-ND1 3.15Å; K93-H122 PolarHBondContact O-CE1 3.44Å; K93-H122 VanDerWaalsContact O-CE1 3.27Å; K93-H122 PolarHBondContact O-NE2 3.38Å; I96-H122 PolarHBondContact O-NE2 3.25Å; D98-H122 HydrophobicContact CB-CB 4.3Å; D98-H122 VanDerWaalsContact CG-CG 3.5Å; D98-H122 PolarHBondContact N-NE2 3.19Å; D98-H122 WeakPolarHBondContact OD1-CB 3.28Å; D98-H122 IonicContact OD1-CD2 2.8Å; D98-H122 IonicContact OD1-CG 3.47Å; D98-H122 PolarHBondContact OD1-N 2.97Å; N120-H122 VanDerWaalsContact C-N 3.27Å; N120-H122 PolarHBondContact O-N 2.95Å; H122-L125 PolarHBondContact O-N 3.43Å; H122-A126 WeakPolarHBondContact O-CB 3.46Å; H122-A126 PolarHBondContact O-N 3.32Å
123	D	97.4	Very high	90.5	Very high	83 Å²	83	58.1 Å²	58.1	44%	0.444	30%	0.302	S	S	.	.	H	α-helix	trans	-68	-40.2	173.2	-69.9	-30.9	0	0	0	111.2	N120 F121 A126 K127	N120-D123 HydrophobicContact CB-CB 4.38Å; N120-D123 WeakPolarHBondContact O-CB 3.22Å; N120-D123 PolarHBondContact O-N 2.9Å; N120-D123 VanDerWaalsContact O-N 3.09Å; F121-D123 PolarHBondContact O-N 3.42Å; D123-A126 PolarHBondContact O-N 3.39Å; D123-K127 WeakPolarHBondContact O-CG 3.34Å; D123-K127 PolarHBondContact O-N 3.31Å
124	Y	97.3	Very high	91	Very high	1 Å²	1	59 Å²	59	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-58.8	-50.9	172.6	170.9	-100.6	0	0	0	111.2	V103 L119 N120 F121 A126 K127 W128 L157 L159 M202	V103-Y124 HydrophobicContact CG1-CD2 4.22Å; V103-Y124 HydrophobicContact CG1-CE2 4.29Å; V103-Y124 HydrophobicContact CG2-CD2 3.87Å; V103-Y124 HydrophobicContact CG2-CE2 4.42Å; V103-Y124 HydrophobicContact CG2-CG 4.38Å; L119-Y124 HydrophobicContact CD1-CD2 4.4Å; N120-Y124 PolarHBondContact O-N 3.2Å; F121-Y124 HydrophobicContact CD2-CD1 4.49Å; F121-Y124 WeakPolarHBondContact O-CB 3.34Å; F121-Y124 PolarHBondContact O-N 2.79Å; Y124-A126 VanDerWaalsContact C-N 3.31Å; Y124-A126 PolarHBondContact O-N 3.12Å; Y124-K127 PolarHBondContact O-N 3.05Å; Y124-W128 AromaticContact CE1-CE3 3.78Å; Y124-W128 HydrophobicContact CE1-CE3 3.78Å; Y124-W128 HydrophobicContact CE1-CZ3 4.35Å; Y124-W128 WeakPolarHBondContact O-CB 3.23Å; Y124-W128 PolarHBondContact O-N 2.95Å; Y124-L157 HydrophobicContact CD2-CB 4.45Å; Y124-L157 HydrophobicContact CE2-CB 4.03Å; Y124-L157 WeakPolarHBondContact CE2-O 3.46Å; Y124-L157 PolarHBondContact OH-O 3.16Å; Y124-L159 HydrophobicContact CD1-CB 4.19Å; Y124-L159 HydrophobicContact CD1-CD1 3.74Å; Y124-L159 HydrophobicContact CD2-CB 4.47Å; Y124-L159 HydrophobicContact CE1-CB 3.7Å; Y124-L159 HydrophobicContact CE1-CD1 3.87Å; Y124-L159 HydrophobicContact CE1-CG 4.47Å; Y124-L159 HydrophobicContact CE2-CB 4.02Å; Y124-L159 HydrophobicContact CG-CD1 4.39Å; Y124-M202 HydrophobicContact CE1-CB 4.12Å; Y124-M202 PolarHBondContact OH-O 3.48Å
125	L	97.5	Very high	91.1	Very high	7 Å²	7	61.9 Å²	61.9	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-58.5	-41.6	177.1	-69.1	-177.4	0	0	0	112.2	F89 L92 K93 F121 H122 W128 R129	F89-L125 HydrophobicContact CD1-CB 4.2Å; F89-L125 HydrophobicContact CD1-CD2 4.02Å; F89-L125 HydrophobicContact CE1-CD2 4.33Å; L92-L125 HydrophobicContact CB-CD1 3.82Å; L92-L125 HydrophobicContact CD1-CD2 4.07Å; K93-L125 HydrophobicContact CB-CD1 4.27Å; F121-L125 HydrophobicContact CD1-CD1 4.17Å; F121-L125 HydrophobicContact CD2-CG 4.39Å; F121-L125 HydrophobicContact CE1-CD1 3.59Å; F121-L125 HydrophobicContact CE1-CG 4.17Å; F121-L125 HydrophobicContact CE2-CD1 4.29Å; F121-L125 HydrophobicContact CE2-CD2 3.9Å; F121-L125 HydrophobicContact CE2-CG 3.99Å; F121-L125 HydrophobicContact CZ-CD1 3.67Å; F121-L125 HydrophobicContact CZ-CD2 3.84Å; F121-L125 HydrophobicContact CZ-CG 3.87Å; F121-L125 WeakPolarHBondContact O-CG 3.27Å; F121-L125 PolarHBondContact O-N 3.36Å; H122-L125 PolarHBondContact O-N 3.43Å; L125-W128 HydrophobicContact CD2-CE3 4.35Å; L125-W128 PolarHBondContact O-N 2.71Å; L125-R129 WeakPolarHBondContact O-CB 3.32Å; L125-R129 PolarHBondContact O-N 2.96Å
126	A	95.5	Very high	90.6	Very high	57 Å²	57	64.4 Å²	64.4	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-44.2	178.4	0	0	0	0	0	112.2	H122 D123 Y124 S130	H122-A126 WeakPolarHBondContact O-CB 3.46Å; H122-A126 PolarHBondContact O-N 3.32Å; D123-A126 PolarHBondContact O-N 3.39Å; Y124-A126 VanDerWaalsContact C-N 3.31Å; Y124-A126 PolarHBondContact O-N 3.12Å; A126-S130 WeakPolarHBondContact O-CB 3.46Å; A126-S130 PolarHBondContact O-N 3.18Å
127	K	94.3	Very high	89.6	Confident	108 Å²	108	62 Å²	62	47%	0.47	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-44.4	175	-74.6	171.5	178.4	-74.9	0	111.6	L119 D123 Y124 S130 S131 L157	L119-K127 HydrophobicContact CD1-CD 4.06Å; D123-K127 WeakPolarHBondContact O-CG 3.34Å; D123-K127 PolarHBondContact O-N 3.31Å; Y124-K127 PolarHBondContact O-N 3.05Å; K127-S130 PolarHBondContact O-N 2.78Å; K127-S131 PolarHBondContact O-N 2.94Å; K127-L157 HydrophobicContact CB-CD1 4.48Å; K127-L157 HydrophobicContact CD-CD1 3.82Å
128	W	94.7	Very high	88	Confident	7 Å²	7	62 Å²	62	3%	0.027	35%	0.353	C	S	.	.	H	α-helix	trans	-62.5	-49.9	178.6	-174.3	10.5	0	0	0	111.3	I87 F89 Y124 L125 S130 S131 I132 M202 G203 P204 D291 I293	I87-W128 HydrophobicContact CD1-CH2 3.97Å; I87-W128 HydrophobicContact CD1-CZ2 4.28Å; I87-W128 HydrophobicContact CG1-CH2 3.87Å; I87-W128 HydrophobicContact CG1-CZ2 3.93Å; I87-W128 HydrophobicContact CG1-CZ3 4.47Å; I87-W128 HydrophobicContact CG2-CH2 4.44Å; I87-W128 HydrophobicContact CG2-CZ3 4.27Å; F89-W128 HydrophobicContact CE1-CB 4.13Å; F89-W128 AromaticContact CE1-CD2 3.82Å; F89-W128 HydrophobicContact CE1-CD2 3.82Å; F89-W128 AromaticContact CE1-CE3 3.7Å; F89-W128 HydrophobicContact CE1-CE3 3.7Å; F89-W128 HydrophobicContact CE1-CG 4.01Å; F89-W128 HydrophobicContact CE1-CZ3 4.39Å; F89-W128 AromaticContact CZ-CD2 3.97Å; F89-W128 HydrophobicContact CZ-CD2 3.97Å; F89-W128 HydrophobicContact CZ-CE3 4.22Å; F89-W128 HydrophobicContact CZ-CG 4.09Å; Y124-W128 AromaticContact CE1-CE3 3.78Å; Y124-W128 HydrophobicContact CE1-CE3 3.78Å; Y124-W128 HydrophobicContact CE1-CZ3 4.35Å; Y124-W128 WeakPolarHBondContact O-CB 3.23Å; Y124-W128 PolarHBondContact O-N 2.95Å; L125-W128 HydrophobicContact CD2-CE3 4.35Å; L125-W128 PolarHBondContact O-N 2.71Å; W128-S130 VanDerWaalsContact C-N 3.35Å; W128-S130 PolarHBondContact O-N 2.79Å; W128-S131 WeakPolarHBondContact O-CB 3.4Å; W128-S131 PolarHBondContact O-N 2.78Å; W128-S131 VanDerWaalsContact O-N 3.11Å; W128-I132 PolarHBondContact O-N 3.4Å; W128-M202 HydrophobicContact CH2-CB 4.16Å; W128-M202 HydrophobicContact CZ3-CB 3.74Å; W128-G203 VanDerWaalsContact CZ2-C 3.48Å; W128-G203 WeakPolarHBondContact CZ2-O 3.39Å; W128-P204 VanDerWaalsContact NE1-CA 3.32Å; W128-D291 HydrophobicContact CZ2-CB 3.85Å; W128-D291 PolarHBondContact NE1-OD1 2.98Å; W128-I293 HydrophobicContact CH2-CD1 4.26Å; W128-I293 HydrophobicContact CH2-CG1 3.82Å; W128-I293 HydrophobicContact CZ3-CD1 4.36Å; W128-I293 HydrophobicContact CZ3-CG1 4.27Å
129	R	93.3	Very high	85.8	Confident	92 Å²	92	59.7 Å²	59.7	35%	0.347	36%	0.358	S	S	.	.	H	α-helix	trans	-56.5	-45.9	176.5	-173.3	176.4	-174.6	154.9	6	112.3	F89 D90 L125 S131 I132 E133	F89-R129 HydrophobicContact CD1-CB 4.17Å; F89-R129 HydrophobicContact CD2-CB 4.19Å; F89-R129 HydrophobicContact CD2-CG 4.06Å; F89-R129 HydrophobicContact CE1-CB 4.11Å; F89-R129 HydrophobicContact CE2-CB 4.1Å; F89-R129 HydrophobicContact CE2-CG 4.19Å; F89-R129 HydrophobicContact CG-CB 4.22Å; F89-R129 HydrophobicContact CG-CG 4.38Å; F89-R129 HydrophobicContact CZ-CB 4.08Å; D90-R129 IonicContact OD1-CZ 3.91Å; D90-R129 IonicContact OD1-NH1 3.5Å; D90-R129 PolarHBondContact OD1-NH1 3.27Å; D90-R129 IonicContact OD2-NH1 2.78Å; D90-R129 IonicContact OD2-NH2 2.76Å; L125-R129 WeakPolarHBondContact O-CB 3.32Å; L125-R129 PolarHBondContact O-N 2.96Å; R129-S131 VanDerWaalsContact C-N 3.31Å; R129-S131 PolarHBondContact O-N 2.79Å; R129-I132 PolarHBondContact O-N 3.34Å; R129-E133 IonicContact NE-OE1 3.92Å; R129-E133 PolarHBondContact NE-OE1 2.7Å; R129-E133 WeakPolarHBondContact O-CG 3.32Å; R129-E133 PolarHBondContact O-N 3.01Å; R129-E133 VanDerWaalsContact O-N 3.1Å
130	S	91.3	Very high	83.4	Confident	68 Å²	68	67 Å²	67	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-63.5	-33.9	177.6	179.3	0	0	0	0	113.1	A126 K127 W128 E133 S134	A126-S130 WeakPolarHBondContact O-CB 3.46Å; A126-S130 PolarHBondContact O-N 3.18Å; K127-S130 PolarHBondContact O-N 2.78Å; W128-S130 VanDerWaalsContact C-N 3.35Å; W128-S130 PolarHBondContact O-N 2.79Å; S130-E133 PolarHBondContact O-N 3.48Å; S130-S134 WeakPolarHBondContact O-CB 3.45Å; S130-S134 PolarHBondContact O-N 3.39Å; S130-S134 PolarHBondContact O-OG 3.43Å
131	S	88.6	Confident	80.8	Confident	37 Å²	37	69.8 Å²	69.8	26%	0.259	40%	0.403	S	S	.	.	H	α-helix	trans	-64.4	-42.8	175.5	-177.8	0	0	0	0	111.6	K127 W128 R129 S134 Q135	K127-S131 PolarHBondContact O-N 2.94Å; W128-S131 WeakPolarHBondContact O-CB 3.4Å; W128-S131 PolarHBondContact O-N 2.78Å; W128-S131 VanDerWaalsContact O-N 3.11Å; R129-S131 VanDerWaalsContact C-N 3.31Å; R129-S131 PolarHBondContact O-N 2.79Å; S131-S134 PolarHBondContact O-N 3.3Å; S131-S134 PolarHBondContact O-OG 2.93Å; S131-Q135 WeakPolarHBondContact O-CG 3.39Å; S131-Q135 PolarHBondContact O-N 3.26Å; S131-Q135 VanDerWaalsContact O-N 3.1Å; S131-Q135 PolarHBondContact OG-NE2 3.03Å
132	I	88.6	Confident	78.2	Confident	54 Å²	54	75.4 Å²	75.4	28%	0.277	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-46.8	176.3	-63	172.2	0	0	0	110.6	F89 W128 R129 S134 Q135 S136 D291	F89-I132 HydrophobicContact CE2-CD1 3.94Å; F89-I132 HydrophobicContact CZ-CD1 3.76Å; W128-I132 PolarHBondContact O-N 3.4Å; R129-I132 PolarHBondContact O-N 3.34Å; I132-S134 VanDerWaalsContact C-N 3.35Å; I132-S134 PolarHBondContact O-N 3.24Å; I132-Q135 PolarHBondContact O-N 3.12Å; I132-S136 PolarHBondContact O-N 2.85Å; I132-S136 VanDerWaalsContact O-N 3.13Å; I132-D291 HydrophobicContact CD1-CB 4.48Å
133	E	86.4	Confident	75.8	Confident	102 Å²	102	77.5 Å²	77.5	48%	0.477	47%	0.466	S	S	.	.	H	α-helix	trans	-63.1	-39.2	-179.4	-70.1	169.2	179.8	0	0	112	R129 S130 S136 S137	R129-E133 IonicContact NE-OE1 3.92Å; R129-E133 PolarHBondContact NE-OE1 2.7Å; R129-E133 WeakPolarHBondContact O-CG 3.32Å; R129-E133 PolarHBondContact O-N 3.01Å; R129-E133 VanDerWaalsContact O-N 3.1Å; S130-E133 PolarHBondContact O-N 3.48Å; E133-S136 PolarHBondContact O-N 2.9Å; E133-S136 PolarHBondContact O-OG 2.95Å; E133-S137 PolarHBondContact O-OG 2.78Å
134	S	82.4	Confident	73.2	Confident	68 Å²	68	81 Å²	81	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-71	-37.6	178.4	66.5	0	0	0	0	113.3	S130 S131 I132 S136 S137 A138	S130-S134 WeakPolarHBondContact O-CB 3.45Å; S130-S134 PolarHBondContact O-N 3.39Å; S130-S134 PolarHBondContact O-OG 3.43Å; S131-S134 PolarHBondContact O-N 3.3Å; S131-S134 PolarHBondContact O-OG 2.93Å; I132-S134 VanDerWaalsContact C-N 3.35Å; I132-S134 PolarHBondContact O-N 3.24Å; S134-S136 VanDerWaalsContact C-N 3.34Å; S134-S136 PolarHBondContact O-N 3.25Å; S134-S137 PolarHBondContact O-N 2.92Å; S134-A138 PolarHBondContact O-N 3.26Å
135	Q	74.5	Confident	70.8	Confident	68 Å²	68	85 Å²	85	32%	0.318	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-36	174.8	-72.1	175.3	41.5	0	0	112.5	S131 I132 S137 A138	S131-Q135 WeakPolarHBondContact O-CG 3.39Å; S131-Q135 PolarHBondContact O-N 3.26Å; S131-Q135 VanDerWaalsContact O-N 3.1Å; S131-Q135 PolarHBondContact OG-NE2 3.03Å; I132-Q135 PolarHBondContact O-N 3.12Å; Q135-S137 PolarHBondContact O-N 2.8Å; Q135-A138 PolarHBondContact O-N 2.97Å
136	S	67.1	Low	68.4	Low	99 Å²	99	85.5 Å²	85.5	69%	0.692	51%	0.506	S	S	*	.	H	α-helix	trans	-63.3	-21.1	175.9	75.8	0	0	0	0	113.5	I132 E133 S134	I132-S136 PolarHBondContact O-N 2.85Å; I132-S136 VanDerWaalsContact O-N 3.13Å; E133-S136 PolarHBondContact O-N 2.9Å; E133-S136 PolarHBondContact O-OG 2.95Å; S134-S136 VanDerWaalsContact C-N 3.34Å; S134-S136 PolarHBondContact O-N 3.25Å
137	S	61.8	Low	66	Low	103 Å²	103	84.5 Å²	84.5	72%	0.72	50%	0.496	S	S	*	.	H	α-helix	trans	-93.3	-15.5	-179.4	-55.6	0	0	0	0	113.5	E133 S134 Q135	E133-S137 PolarHBondContact O-OG 2.78Å; S134-S137 PolarHBondContact O-N 2.92Å; Q135-S137 PolarHBondContact O-N 2.8Å
138	A	56.4	Low	63.6	Low	61 Å²	61	84.1 Å²	84.1	50%	0.504	50%	0.499	S	S	.	.	S	Bend	trans	-92.2	131	-178.7	0	0	0	0	0	110.9	S134 Q135 W140	S134-A138 PolarHBondContact O-N 3.26Å; Q135-A138 PolarHBondContact O-N 2.97Å; A138-W140 PolarHBondContact O-N 3.36Å
139	A	46.6	Very low	61.2	Low	97 Å²	97	88.8 Å²	88.8	80%	0.802	53%	0.528	S	S	*	.			trans	-60.8	120.7	174	0	0	0	0	0	110.1	T141	A139-T141 PolarHBondContact O-N 2.54Å; A139-T141 VanDerWaalsContact O-N 3.12Å
140	W	42.8	Very low	59	Low	191 Å²	191	88.7 Å²	88.7	72%	0.723	55%	0.547	S	S	*	.			trans	-47.2	111.1	-178.8	-100.1	179.8	0	0	0	113.5	A138	A138-W140 PolarHBondContact O-N 3.36Å
141	T	43.5	Very low	56.9	Low	126 Å²	126	88.7 Å²	88.7	77%	0.773	55%	0.545	S	S	*	.			trans	-92.5	122.8	150.8	53.3	0	0	0	0	107.7	A139 A143	A139-T141 PolarHBondContact O-N 2.54Å; A139-T141 VanDerWaalsContact O-N 3.12Å; T141-A143 VanDerWaalsContact C-N 3.32Å; T141-A143 PolarHBondContact O-N 3.4Å
142	S	44.4	Very low	55.2	Low	119 Å²	119	91.2 Å²	91.2	83%	0.832	57%	0.569	S	S	*	*			trans	-70.2	85.4	176.2	54.3	0	0	0	0	109.6
143	A	47.8	Very low	53.7	Low	79 Å²	79	95.2 Å²	95.2	65%	0.653	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-69.3	130.9	161.3	0	0	0	0	0	108.3	T141 V145	T141-A143 VanDerWaalsContact C-N 3.32Å; T141-A143 PolarHBondContact O-N 3.4Å; A143-V145 PolarHBondContact O-N 3.1Å
144	E	42.9	Very low	53	Low	157 Å²	157	92.5 Å²	92.5	73%	0.734	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-62.2	129.7	174.8	-74.3	179.2	163.1	0	0	110.1	S147	E144-S147 WeakPolarHBondContact O-CB 3.37Å; E144-S147 PolarHBondContact O-N 2.86Å; E144-S147 PolarHBondContact O-OG 3.4Å
145	V	46.7	Very low	52.9	Low	86 Å²	86	94.4 Å²	94.4	52%	0.521	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.3	132.5	169.3	178	0	0	0	0	107.9	A143 S147 L289	A143-V145 PolarHBondContact O-N 3.1Å; V145-S147 VanDerWaalsContact C-N 3.34Å; V145-L289 HydrophobicContact CG1-CD2 3.55Å
146	N	46.6	Very low	53.6	Low	16 Å²	16	92 Å²	92	9%	0.086	60%	0.595	C	S	.	*	T	Hydrogen-bonded Turn	trans	72	8.1	-173.9	-65.3	4	0	0	0	116.8	N148 K230 E255	N146-N148 PolarHBondContact O-N 3.17Å; N146-K230 PolarHBondContact ND2-NZ 3.38Å; N146-E255 PolarHBondContact ND2-OE2 2.81Å
147	S	45.9	Very low	54.9	Low	37 Å²	37	88.2 Å²	88.2	26%	0.259	57%	0.567	S	S	.	*			trans	-74	121.9	172.6	70.1	0	0	0	0	109.9	E144 V145 V149	E144-S147 WeakPolarHBondContact O-CB 3.37Å; E144-S147 PolarHBondContact O-N 2.86Å; E144-S147 PolarHBondContact O-OG 3.4Å; V145-S147 VanDerWaalsContact C-N 3.34Å; S147-V149 PolarHBondContact O-N 3.25Å; S147-V149 WeakPolarHBondContact OG-CG2 3.42Å
148	N	43.6	Very low	56.6	Low	100 Å²	100	83.4 Å²	83.4	54%	0.535	53%	0.533	S	S	.	.			trans	-66.4	28.7	169.7	-70.6	-56	0	0	0	112.1	N146 S252 D254	N146-N148 PolarHBondContact O-N 3.17Å; N148-S252 PolarHBondContact OD1-OG 2.98Å; N148-D254 PolarHBondContact ND2-OD2 3.09Å
149	V	45.1	Very low	58.5	Low	105 Å²	105	80.5 Å²	80.5	64%	0.636	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-72	137.4	-179.4	175.2	0	0	0	0	108.7	S147 P151	S147-V149 PolarHBondContact O-N 3.25Å; S147-V149 WeakPolarHBondContact OG-CG2 3.42Å; V149-P151 VanDerWaalsContact O-N 3.1Å
150	A	46	Very low	60.9	Low	89 Å²	89	77.5 Å²	77.5	74%	0.736	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-47.5	119.4	176.6	0	0	0	0	0	109.8
151	P	47.6	Very low	63.4	Low	68 Å²	68	70.4 Å²	70.4	44%	0.442	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-62.6	153.3	-168.8	19.8	-28.8	0	0	0	111.1	N107 V149 S153	N107-P151 HydrophobicContact CB-CB 4.08Å; N107-P151 HydrophobicContact CB-CG 3.49Å; N107-P151 VanDerWaalsContact CB-CG 3.49Å; N107-P151 WeakPolarHBondContact ND2-CB 3.25Å; N107-P151 VanDerWaalsContact OD1-CB 3.3Å; N107-P151 WeakPolarHBondContact OD1-CB 3.32Å; N107-P151 WeakPolarHBondContact OD1-CG 3.32Å; V149-P151 VanDerWaalsContact O-N 3.1Å; P151-S153 PolarHBondContact O-N 3.49Å
152	A	51.8	Low	66	Low	91 Å²	91	64.7 Å²	64.7	75%	0.752	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-46.4	144.3	164.9	0	0	0	0	0	109.2	G154	A152-G154 PolarHBondContact O-N 2.99Å
153	S	57.3	Low	68.5	Low	138 Å²	138	61.4 Å²	61.4	97%	0.965	39%	0.39	S	S	*	.	S	Bend	trans	-65.4	39.8	-164.9	64.1	0	0	0	0	116.6	P151	P151-S153 PolarHBondContact O-N 3.49Å
154	G	72	Confident	70.9	Confident	45 Å²	45	57.7 Å²	57.7	46%	0.464	36%	0.359	S	S	.	.	S	Bend	trans	-137	165.2	179.3	0	0	0	0	0	112.3	N107 A152	N107-G154 PolarHBondContact ND2-O 3.05Å; A152-G154 PolarHBondContact O-N 2.99Å
155	D	81.4	Confident	73.5	Confident	107 Å²	107	50.6 Å²	50.6	57%	0.572	33%	0.327	S	S	*	.			trans	-72.4	139.9	178.2	-64.9	-36.6	0	0	0	111.5	N105 L157	N105-D155 PolarHBondContact ND2-OD1 3.49Å; D155-L157 HydrophobicContact CB-CD1 4.47Å; D155-L157 HydrophobicContact CB-CD2 3.82Å; D155-L157 HydrophobicContact CB-CG 3.85Å
156	N	88.4	Confident	75.8	Confident	17 Å²	17	49 Å²	49	9%	0.091	32%	0.323	C	S	.	.			trans	-111.7	83.7	171.2	-177.4	9.7	0	0	0	108.4	N105 C106 N107 Y158 P204 N206 S207	N105-N156 PolarHBondContact OD1-N 3.22Å; N105-N156 VanDerWaalsContact OD1-N 3.09Å; C106-N156 HydrophobicContact CB-CB 3.99Å; C106-N156 WeakPolarHBondContact CB-ND2 3.49Å; C106-N156 PolarHBondContact N-O 3.33Å; N107-N156 HydrophobicContact CB-CB 4.41Å; N107-N156 VanDerWaalsContact CG-CB 3.48Å; N107-N156 WeakPolarHBondContact ND2-CB 3.41Å; N107-N156 WeakPolarHBondContact OD1-CB 3.19Å; N156-Y158 PolarHBondContact O-N 3.29Å; N156-P204 WeakPolarHBondContact OD1-CG 3.43Å; N156-N206 PolarHBondContact ND2-O 2.82Å; N156-S207 PolarHBondContact ND2-N 2.93Å
157	L	94.1	Very high	78.1	Confident	20 Å²	20	53.3 Å²	53.3	11%	0.105	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	112.9	-169.6	-60.9	-178.5	0	0	0	111.4	V103 A104 N105 L117 L119 Y124 K127 D155 P204	V103-L157 HydrophobicContact CG1-CB 3.78Å; V103-L157 HydrophobicContact CG1-CD2 4.09Å; V103-L157 HydrophobicContact CG1-CG 4.41Å; A104-L157 CarbonylContact O-C 3.58Å; A104-L157 WeakPolarHBondContact O-CA 3.36Å; N105-L157 HydrophobicContact CB-CD2 4.16Å; L117-L157 HydrophobicContact CD2-CD2 4.12Å; L119-L157 HydrophobicContact CD1-CD1 4.02Å; Y124-L157 HydrophobicContact CD2-CB 4.45Å; Y124-L157 HydrophobicContact CE2-CB 4.03Å; Y124-L157 WeakPolarHBondContact CE2-O 3.46Å; Y124-L157 PolarHBondContact OH-O 3.16Å; K127-L157 HydrophobicContact CB-CD1 4.48Å; K127-L157 HydrophobicContact CD-CD1 3.82Å; D155-L157 HydrophobicContact CB-CD1 4.47Å; D155-L157 HydrophobicContact CB-CD2 3.82Å; D155-L157 HydrophobicContact CB-CG 3.85Å; L157-P204 WeakPolarHBondContact O-CD 3.5Å
158	Y	96.8	Very high	80.4	Confident	3 Å²	3	53.5 Å²	53.5	1%	0.012	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.7	179.4	-170.3	-167.9	0	0	0	110.6	V103 A104 N156 K160 Y201 M202 G203 T209	V103-Y158 CarbonylContact C-O 3.57Å; V103-Y158 WeakPolarHBondContact CA-O 3.48Å; A104-Y158 PolarHBondContact N-O 3.02Å; A104-Y158 PolarHBondContact O-N 2.93Å; N156-Y158 PolarHBondContact O-N 3.29Å; Y158-K160 HydrophobicContact CD1-CB 4.5Å; Y158-K160 HydrophobicContact CD1-CD 4.32Å; Y158-K160 PolarHBondContact O-N 3.36Å; Y158-Y201 HydrophobicContact CE1-CD1 4.37Å; Y158-Y201 HydrophobicContact CE2-CD1 4.15Å; Y158-Y201 AromaticContact CZ-CD1 3.72Å; Y158-Y201 WeakPolarHBondContact OH-CD1 3.49Å; Y158-M202 VanDerWaalsContact CD2-O 3.31Å; Y158-M202 WeakPolarHBondContact CD2-O 3.19Å; Y158-G203 VanDerWaalsContact CD2-CA 3.47Å; Y158-T209 HydrophobicContact CE1-CG2 4.02Å
159	L	97.9	Very high	82.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.1	169.7	-177.4	172.7	0	0	0	108.1	V101 P102 V103 F121 Y124 W162 Y201 M202	V101-L159 HydrophobicContact CB-CD1 3.97Å; V101-L159 HydrophobicContact CB-CG 4.28Å; V101-L159 HydrophobicContact CG1-CD1 4.31Å; V101-L159 HydrophobicContact CG2-CD1 3.79Å; V101-L159 HydrophobicContact CG2-CG 4.31Å; P102-L159 WeakPolarHBondContact O-CA 3.35Å; V103-L159 HydrophobicContact CG2-CB 4.32Å; F121-L159 HydrophobicContact CD2-CD1 3.88Å; F121-L159 HydrophobicContact CE2-CD1 3.98Å; Y124-L159 HydrophobicContact CD1-CB 4.19Å; Y124-L159 HydrophobicContact CD1-CD1 3.74Å; Y124-L159 HydrophobicContact CD2-CB 4.47Å; Y124-L159 HydrophobicContact CE1-CB 3.7Å; Y124-L159 HydrophobicContact CE1-CD1 3.87Å; Y124-L159 HydrophobicContact CE1-CG 4.47Å; Y124-L159 HydrophobicContact CE2-CB 4.02Å; Y124-L159 HydrophobicContact CG-CD1 4.39Å; L159-W162 HydrophobicContact CD1-CE3 4.02Å; L159-W162 HydrophobicContact CD1-CZ3 4.26Å; L159-W162 HydrophobicContact CD2-CB 3.44Å; L159-W162 VanDerWaalsContact CD2-CB 3.44Å; L159-W162 HydrophobicContact CD2-CD2 4.08Å; L159-W162 HydrophobicContact CD2-CE3 3.73Å; L159-W162 HydrophobicContact CD2-CG 4.03Å; L159-Y201 CarbonylContact O-C 3.6Å; L159-Y201 WeakPolarHBondContact O-CA 3.33Å; L159-M202 WeakPolarHBondContact CA-O 3.33Å; L159-M202 HydrophobicContact CB-CB 4.19Å; L159-M202 WeakPolarHBondContact CB-O 3.43Å; L159-M202 HydrophobicContact CD1-CB 4.48Å; L159-M202 PolarHBondContact N-O 3.25Å; L159-M202 PolarHBondContact O-N 2.89Å; L159-M202 VanDerWaalsContact O-O 3.1Å
160	K	96.6	Very high	85.1	Confident	33 Å²	33	52.2 Å²	52.2	14%	0.143	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155.9	-174.9	63.3	170.4	-138.4	157.8	0	111.9	P102 A104 Y158 W162 Y201	P102-K160 WeakPolarHBondContact CB-O 3.43Å; P102-K160 WeakPolarHBondContact CG-O 3.46Å; P102-K160 PolarHBondContact O-N 2.99Å; A104-K160 HydrophobicContact CB-CD 3.92Å; A104-K160 HydrophobicContact CB-CG 4.11Å; Y158-K160 HydrophobicContact CD1-CB 4.5Å; Y158-K160 HydrophobicContact CD1-CD 4.32Å; Y158-K160 PolarHBondContact O-N 3.36Å; K160-W162 PolarHBondContact O-N 3.37Å; K160-Y201 HydrophobicContact CB-CD1 3.35Å; K160-Y201 HydrophobicContact CB-CE1 3.41Å; K160-Y201 VanDerWaalsContact CB-CE1 3.41Å; K160-Y201 HydrophobicContact CB-CG 4.42Å
161	D	95.9	Very high	87.5	Confident	43 Å²	43	48.9 Å²	48.9	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61.8	32.7	179.9	-40.1	-36.8	0	0	0	111.5	H163 F199 Y201	D161-H163 PolarHBondContact O-CD2 2.91Å; D161-F199 HydrophobicContact CB-CD1 4.32Å; D161-Y201 PolarHBondContact OD1-OH 2.83Å
162	W	98	Very high	89.8	Confident	5 Å²	5	52 Å²	52	2%	0.019	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.7	-177.5	-179.7	31.9	0	0	0	112.2	I96 V101 P102 F121 L159 K160 L164 F199 V200 M202	I96-W162 HydrophobicContact CD1-CH2 4.16Å; I96-W162 HydrophobicContact CD1-CZ3 4.5Å; I96-W162 HydrophobicContact CG2-CH2 3.73Å; I96-W162 HydrophobicContact CG2-CZ2 4.03Å; V101-W162 HydrophobicContact CG1-CD2 4.08Å; V101-W162 HydrophobicContact CG1-CG 4.41Å; V101-W162 HydrophobicContact CG1-CH2 4.32Å; V101-W162 HydrophobicContact CG1-CZ2 3.67Å; P102-W162 HydrophobicContact CG-CB 4.1Å; F121-W162 HydrophobicContact CD1-CH2 4.19Å; F121-W162 AromaticContact CD2-CH2 3.66Å; F121-W162 HydrophobicContact CD2-CH2 3.66Å; F121-W162 HydrophobicContact CD2-CZ2 4.38Å; F121-W162 AromaticContact CD2-CZ3 4Å; F121-W162 HydrophobicContact CD2-CZ3 4Å; F121-W162 HydrophobicContact CE1-CH2 4.14Å; F121-W162 AromaticContact CE2-CH2 3.59Å; F121-W162 HydrophobicContact CE2-CH2 3.59Å; F121-W162 AromaticContact CE2-CZ3 3.59Å; F121-W162 HydrophobicContact CE2-CZ3 3.59Å; F121-W162 AromaticContact CG-CH2 3.98Å; F121-W162 HydrophobicContact CG-CH2 3.98Å; F121-W162 HydrophobicContact CG-CZ2 4.48Å; F121-W162 AromaticContact CZ-CH2 3.84Å; F121-W162 HydrophobicContact CZ-CH2 3.84Å; F121-W162 HydrophobicContact CZ-CZ3 4.02Å; L159-W162 HydrophobicContact CD1-CE3 4.02Å; L159-W162 HydrophobicContact CD1-CZ3 4.26Å; L159-W162 HydrophobicContact CD2-CB 3.44Å; L159-W162 VanDerWaalsContact CD2-CB 3.44Å; L159-W162 HydrophobicContact CD2-CD2 4.08Å; L159-W162 HydrophobicContact CD2-CE3 3.73Å; L159-W162 HydrophobicContact CD2-CG 4.03Å; K160-W162 PolarHBondContact O-N 3.37Å; W162-L164 HydrophobicContact CD2-CB 3.97Å; W162-L164 HydrophobicContact CE3-CB 4.19Å; W162-L164 HydrophobicContact CE3-CD2 4.46Å; W162-L164 HydrophobicContact CG-CB 4.47Å; W162-L164 HydrophobicContact CH2-CD1 3.88Å; W162-L164 HydrophobicContact CH2-CD2 4.2Å; W162-L164 HydrophobicContact CH2-CG 4.45Å; W162-L164 HydrophobicContact CZ2-CB 4.35Å; W162-L164 HydrophobicContact CZ2-CD1 3.62Å; W162-L164 HydrophobicContact CZ2-CG 4.39Å; W162-L164 HydrophobicContact CZ3-CD1 4.48Å; W162-L164 HydrophobicContact CZ3-CD2 4.08Å; W162-L164 PolarHBondContact O-N 3.03Å; W162-F199 CarbonylContact O-C 3.59Å; W162-F199 WeakPolarHBondContact O-CA 3.41Å; W162-V200 WeakPolarHBondContact CB-O 3.34Å; W162-V200 HydrophobicContact CE3-CB 3.99Å; W162-V200 HydrophobicContact CE3-CG1 4.05Å; W162-V200 PolarHBondContact N-O 2.76Å; W162-V200 PolarHBondContact O-N 3.19Å; W162-M202 HydrophobicContact CE3-CE 4.49Å; W162-M202 HydrophobicContact CZ3-CE 3.83Å; W162-M202 HydrophobicContact CZ3-SD 4.3Å
163	H	97.1	Very high	92	Very high	51 Å²	51	47.9 Å²	47.9	24%	0.236	30%	0.299	C	S	.	.			trans	-76.9	50.9	179.5	-62.3	-107	0	0	0	113	D161 A165 A166 Q167 D195 D196 F199	D161-H163 PolarHBondContact O-CD2 2.91Å; H163-A165 PolarHBondContact O-N 2.84Å; H163-A166 HydrophobicContact CB-CB 4.3Å; H163-A166 PolarHBondContact O-N 3.47Å; H163-Q167 WeakPolarHBondContact O-CG 3.38Å; H163-Q167 PolarHBondContact O-N 3.31Å; H163-D195 IonicContact CE1-OD1 3.83Å; H163-D195 PolarHBondContact CE1-OD1 3.06Å; H163-D195 VanDerWaalsContact CE1-OD1 3.3Å; H163-D195 IonicContact ND1-OD1 2.96Å; H163-D195 PolarHBondContact ND1-OD1 3.2Å; H163-D196 WeakPolarHBondContact CB-OD1 3.48Å; H163-D196 PolarHBondContact CE1-O 2.97Å; H163-D196 IonicContact CE1-OD1 3.84Å; H163-D196 IonicContact CG-OD1 3.47Å; H163-D196 PolarHBondContact ND1-O 2.82Å; H163-D196 IonicContact ND1-OD1 3.64Å; H163-D196 PolarHBondContact ND1-OD1 2.58Å; H163-F199 AromaticContact CE1-CE1 3.52Å; H163-F199 AromaticContact NE2-CE1 3.54Å
164	L	97.7	Very high	93.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.3	-36.8	-176.1	177.3	58.8	0	0	0	112.2	W66 I96 W162 Q167 M168 Y171 F173 V200	W66-L164 HydrophobicContact CH2-CD2 4.25Å; W66-L164 HydrophobicContact CZ2-CD2 4.13Å; I96-L164 HydrophobicContact CD1-CD2 3.91Å; I96-L164 HydrophobicContact CG2-CD1 4.08Å; W162-L164 HydrophobicContact CD2-CB 3.97Å; W162-L164 HydrophobicContact CE3-CB 4.19Å; W162-L164 HydrophobicContact CE3-CD2 4.46Å; W162-L164 HydrophobicContact CG-CB 4.47Å; W162-L164 HydrophobicContact CH2-CD1 3.88Å; W162-L164 HydrophobicContact CH2-CD2 4.2Å; W162-L164 HydrophobicContact CH2-CG 4.45Å; W162-L164 HydrophobicContact CZ2-CB 4.35Å; W162-L164 HydrophobicContact CZ2-CD1 3.62Å; W162-L164 HydrophobicContact CZ2-CG 4.39Å; W162-L164 HydrophobicContact CZ3-CD1 4.48Å; W162-L164 HydrophobicContact CZ3-CD2 4.08Å; W162-L164 PolarHBondContact O-N 3.03Å; L164-Q167 PolarHBondContact O-N 2.58Å; L164-M168 HydrophobicContact CD1-CB 4.31Å; L164-M168 HydrophobicContact CD1-CG 4.02Å; L164-M168 HydrophobicContact CD1-SD 3.76Å; L164-M168 PolarHBondContact O-N 3.12Å; L164-Y171 HydrophobicContact CD2-CE1 4.48Å; L164-F173 HydrophobicContact CB-CE1 4.15Å; L164-F173 HydrophobicContact CB-CZ 4.17Å; L164-F173 HydrophobicContact CD2-CD1 4.1Å; L164-F173 HydrophobicContact CD2-CE1 3.88Å; L164-F173 HydrophobicContact CD2-CE2 4.45Å; L164-F173 HydrophobicContact CD2-CZ 4.06Å; L164-F173 HydrophobicContact CG-CD1 4.26Å; L164-F173 HydrophobicContact CG-CE1 3.74Å; L164-F173 HydrophobicContact CG-CZ 4.14Å; L164-V200 HydrophobicContact CB-CB 4.46Å; L164-V200 HydrophobicContact CB-CG2 3.86Å; L164-V200 HydrophobicContact CD2-CG2 4.06Å
165	A	96.2	Very high	95.1	Very high	8 Å²	8	44.7 Å²	44.7	7%	0.066	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-36.3	-179.2	0	0	0	0	0	112.8	H163 M168 P169 F173 Y174 R198	H163-A165 PolarHBondContact O-N 2.84Å; A165-M168 CarbonylContact O-C 3.54Å; A165-P169 WeakPolarHBondContact O-CA 3.34Å; A165-F173 HydrophobicContact CB-CE1 3.93Å; A165-F173 HydrophobicContact CB-CZ 4.11Å; A165-Y174 HydrophobicContact CB-CE1 4.21Å; A165-R198 VanDerWaalsContact CB-NH2 3.3Å
166	A	95.4	Very high	95.8	Very high	52 Å²	52	40 Å²	40	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-73.5	-36.1	171.4	0	0	0	0	0	112.6	H163 D196	H163-A166 HydrophobicContact CB-CB 4.3Å; H163-A166 PolarHBondContact O-N 3.47Å; A166-D196 WeakPolarHBondContact CB-OD1 3.47Å; A166-D196 PolarHBondContact N-OD2 3.46Å
167	Q	94.9	Very high	96.2	Very high	107 Å²	107	39.9 Å²	39.9	50%	0.5	23%	0.23	S	C	.	.	H	α-helix	trans	-72	-32.5	179	-70.5	-177.5	-2.9	0	0	113.2	H163 L164	H163-Q167 WeakPolarHBondContact O-CG 3.38Å; H163-Q167 PolarHBondContact O-N 3.31Å; L164-Q167 PolarHBondContact O-N 2.58Å
168	M	95.3	Very high	96.3	Very high	42 Å²	42	42 Å²	42	21%	0.207	24%	0.239	C	C	.	.			trans	-128.1	69.4	-179.7	-64.5	-172.6	69.9	0	0	111.1	I96 L164 A165 G170 Y171	I96-M168 HydrophobicContact CB-SD 4.37Å; I96-M168 HydrophobicContact CG1-SD 4.43Å; I96-M168 HydrophobicContact CG2-SD 3.83Å; L164-M168 HydrophobicContact CD1-CB 4.31Å; L164-M168 HydrophobicContact CD1-CG 4.02Å; L164-M168 HydrophobicContact CD1-SD 3.76Å; L164-M168 PolarHBondContact O-N 3.12Å; A165-M168 CarbonylContact O-C 3.54Å; M168-G170 PolarHBondContact O-N 2.76Å; M168-G170 VanDerWaalsContact O-N 3.1Å; M168-Y171 HydrophobicContact CE-CD1 4.28Å; M168-Y171 WeakPolarHBondContact O-CB 3.42Å; M168-Y171 PolarHBondContact O-N 3.34Å; M168-Y171 HydrophobicContact SD-CD1 4.31Å
169	P	92.5	Very high	96.3	Very high	102 Å²	102	42.7 Å²	42.7	66%	0.662	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.3	-174.5	25.2	-34.8	0	0	0	114.1	A165 Y171	A165-P169 WeakPolarHBondContact O-CA 3.34Å; P169-Y171 VanDerWaalsContact C-N 3.32Å
170	G	93.8	Very high	96.3	Very high	76 Å²	76	42.7 Å²	42.7	78%	0.784	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.8	173.3	0	0	0	0	0	114.5	M168	M168-G170 PolarHBondContact O-N 2.76Å; M168-G170 VanDerWaalsContact O-N 3.1Å
171	Y	97.1	Very high	96.3	Very high	19 Å²	19	41.1 Å²	41.1	8%	0.075	23%	0.234	C	C	.	.			trans	-101.1	92.6	-179.8	-176.6	-152.2	0	0	0	110.5	E62 W66 K95 I96 L164 M168 P169 F173	E62-Y171 HydrophobicContact CG-CE2 4.28Å; E62-Y171 WeakPolarHBondContact OE2-CE2 3.28Å; E62-Y171 PolarHBondContact OE2-OH 3.19Å; W66-Y171 HydrophobicContact CZ2-CE1 4.41Å; W66-Y171 PolarHBondContact NE1-OH 2.86Å; K95-Y171 HydrophobicContact CD-CE2 4.21Å; K95-Y171 HydrophobicContact CG-CE1 4.06Å; K95-Y171 HydrophobicContact CG-CE2 3.96Å; I96-Y171 HydrophobicContact CD1-CE1 4.25Å; I96-Y171 HydrophobicContact CG1-CD1 4.39Å; I96-Y171 HydrophobicContact CG1-CE1 3.83Å; L164-Y171 HydrophobicContact CD2-CE1 4.48Å; M168-Y171 HydrophobicContact CE-CD1 4.28Å; M168-Y171 WeakPolarHBondContact O-CB 3.42Å; M168-Y171 PolarHBondContact O-N 3.34Å; M168-Y171 HydrophobicContact SD-CD1 4.31Å; P169-Y171 VanDerWaalsContact C-N 3.32Å; Y171-F173 HydrophobicContact CD1-CB 4.05Å; Y171-F173 AromaticContact CD1-CD1 3.89Å; Y171-F173 HydrophobicContact CD1-CD1 3.89Å; Y171-F173 HydrophobicContact CD1-CG 4.37Å; Y171-F173 HydrophobicContact CD2-CB 4.08Å; Y171-F173 HydrophobicContact CE1-CB 3.64Å; Y171-F173 HydrophobicContact CE1-CD1 4.15Å; Y171-F173 HydrophobicContact CE1-CG 4.19Å; Y171-F173 HydrophobicContact CE2-CB 3.65Å; Y171-F173 HydrophobicContact CG-CB 4.25Å; Y171-F173 HydrophobicContact CG-CD1 4.26Å; Y171-F173 VanDerWaalsContact CZ-CB 3.41Å; Y171-F173 VanDerWaalsContact O-CD1 3.24Å; Y171-F173 WeakPolarHBondContact O-CD1 3.46Å; Y171-F173 PolarHBondContact O-N 2.76Å
172	N	96	Very high	96.4	Very high	133 Å²	133	39 Å²	39	71%	0.711	22%	0.224	S	C	*	.			trans	-77.2	63.4	177.9	-62.3	-31.4	0	0	0	111.5	Y174	N172-Y174 PolarHBondContact O-N 2.81Å
173	F	97.8	Very high	96.3	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.018	22%	0.223	C	C	.	.			trans	-70.2	-17.2	-174.2	64.3	-91.5	0	0	0	113.7	E62 C63 W66 L164 A165 Y171 V200 V295	E62-F173 PolarHBondContact N-O 3.13Å; C63-F173 HydrophobicContact CB-CB 4.23Å; C63-F173 HydrophobicContact CB-CD2 4.24Å; C63-F173 WeakPolarHBondContact CB-O 3.28Å; C63-F173 PolarHBondContact N-O 3.19Å; C63-F173 PolarHBondContact SG-O 3.26Å; W66-F173 AromaticContact CH2-CD2 3.43Å; W66-F173 HydrophobicContact CH2-CD2 3.43Å; W66-F173 VanDerWaalsContact CH2-CD2 3.43Å; W66-F173 AromaticContact CH2-CE2 3.8Å; W66-F173 HydrophobicContact CH2-CE2 3.8Å; W66-F173 HydrophobicContact CH2-CG 4.16Å; W66-F173 HydrophobicContact CZ2-CB 3.91Å; W66-F173 AromaticContact CZ2-CD2 3.61Å; W66-F173 HydrophobicContact CZ2-CD2 3.61Å; W66-F173 HydrophobicContact CZ2-CE2 4.34Å; W66-F173 AromaticContact CZ2-CG 3.88Å; W66-F173 HydrophobicContact CZ2-CG 3.88Å; L164-F173 HydrophobicContact CB-CE1 4.15Å; L164-F173 HydrophobicContact CB-CZ 4.17Å; L164-F173 HydrophobicContact CD2-CD1 4.1Å; L164-F173 HydrophobicContact CD2-CE1 3.88Å; L164-F173 HydrophobicContact CD2-CE2 4.45Å; L164-F173 HydrophobicContact CD2-CZ 4.06Å; L164-F173 HydrophobicContact CG-CD1 4.26Å; L164-F173 HydrophobicContact CG-CE1 3.74Å; L164-F173 HydrophobicContact CG-CZ 4.14Å; A165-F173 HydrophobicContact CB-CE1 3.93Å; A165-F173 HydrophobicContact CB-CZ 4.11Å; Y171-F173 HydrophobicContact CD1-CB 4.05Å; Y171-F173 AromaticContact CD1-CD1 3.89Å; Y171-F173 HydrophobicContact CD1-CD1 3.89Å; Y171-F173 HydrophobicContact CD1-CG 4.37Å; Y171-F173 HydrophobicContact CD2-CB 4.08Å; Y171-F173 HydrophobicContact CE1-CB 3.64Å; Y171-F173 HydrophobicContact CE1-CD1 4.15Å; Y171-F173 HydrophobicContact CE1-CG 4.19Å; Y171-F173 HydrophobicContact CE2-CB 3.65Å; Y171-F173 HydrophobicContact CG-CB 4.25Å; Y171-F173 HydrophobicContact CG-CD1 4.26Å; Y171-F173 VanDerWaalsContact CZ-CB 3.41Å; Y171-F173 VanDerWaalsContact O-CD1 3.24Å; Y171-F173 WeakPolarHBondContact O-CD1 3.46Å; Y171-F173 PolarHBondContact O-N 2.76Å; F173-V200 HydrophobicContact CE2-CG2 3.64Å; F173-V200 HydrophobicContact CZ-CG2 3.7Å; F173-V295 HydrophobicContact CD2-CG2 4.39Å; F173-V295 HydrophobicContact CE2-CG1 4.4Å; F173-V295 HydrophobicContact CE2-CG2 3.94Å
174	Y	98	Very high	96.4	Very high	23 Å²	23	36.4 Å²	36.4	9%	0.09	21%	0.211	C	C	.	.			trans	-151.7	172.1	177.4	75.7	-68.7	0	0	0	110.2	W61 A165 N172 V176 R198 W221 V295 H297	W61-Y174 VanDerWaalsContact CE3-CB 3.41Å; W61-Y174 HydrophobicContact CE3-CG 4.48Å; W61-Y174 HydrophobicContact CH2-CD2 4.15Å; W61-Y174 HydrophobicContact CZ2-CD2 4.46Å; W61-Y174 HydrophobicContact CZ3-CD2 4.3Å; W61-Y174 HydrophobicContact CZ3-CG 4.42Å; A165-Y174 HydrophobicContact CB-CE1 4.21Å; N172-Y174 PolarHBondContact O-N 2.81Å; Y174-V176 HydrophobicContact CE2-CG2 4.02Å; Y174-R198 WeakPolarHBondContact OH-CD 3.4Å; Y174-W221 HydrophobicContact CD2-CH2 4.2Å; Y174-W221 AromaticContact CE2-CH2 3.99Å; Y174-W221 HydrophobicContact CE2-CH2 3.99Å; Y174-W221 HydrophobicContact CE2-CZ2 4.4Å; Y174-V295 HydrophobicContact CD1-CG1 4.25Å; Y174-V295 HydrophobicContact CD2-CG1 3.86Å; Y174-V295 HydrophobicContact CE1-CG1 4.3Å; Y174-V295 HydrophobicContact CE2-CG1 3.93Å; Y174-V295 HydrophobicContact CG-CG1 4.03Å; Y174-H297 AromaticContact CE2-CE1 3.94Å; Y174-H297 AromaticContact CE2-NE2 3.31Å; Y174-H297 VanDerWaalsContact CE2-NE2 3.31Å; Y174-H297 WeakPolarHBondContact CE2-NE2 3.43Å; Y174-H297 AromaticContact CZ-NE2 3.36Å; Y174-H297 PolarHBondContact OH-CE1 2.85Å; Y174-H297 PolarHBondContact OH-NE2 3.19Å
175	K	95.7	Very high	96.4	Very high	94 Å²	94	36.7 Å²	36.7	41%	0.409	21%	0.213	S	C	.	.			trans	-123.8	143	171.5	-59.8	174.1	-173.3	167.2	0	108.9	D60 W61 P177	D60-K175 IonicContact OD2-NZ 3.73Å; D60-K175 PolarHBondContact OD2-NZ 2.84Å; W61-K175 VanDerWaalsContact CE2-O 3.24Å; W61-K175 WeakPolarHBondContact CZ2-O 3.48Å; W61-K175 PolarHBondContact NE1-O 3.39Å; K175-P177 WeakPolarHBondContact O-CD 3.4Å
176	V	97	Very high	96.4	Very high	8 Å²	8	36.3 Å²	36.3	5%	0.048	21%	0.21	C	C	.	.			trans	-69.5	124.2	174	178.1	0	0	0	0	108.9	Y174 F180 F375 Y378	Y174-V176 HydrophobicContact CE2-CG2 4.02Å; V176-F180 HydrophobicContact CG1-CB 4.24Å; V176-F375 HydrophobicContact CB-CB 4.33Å; V176-F375 HydrophobicContact CB-CD1 4.4Å; V176-F375 HydrophobicContact CB-CD2 3.82Å; V176-F375 HydrophobicContact CB-CE2 4.16Å; V176-F375 HydrophobicContact CB-CG 3.93Å; V176-F375 HydrophobicContact CG1-CD2 3.83Å; V176-F375 HydrophobicContact CG1-CE2 3.79Å; V176-F375 HydrophobicContact CG1-CG 4.44Å; V176-F375 HydrophobicContact CG1-CZ 4.36Å; V176-F375 HydrophobicContact CG2-CB 4.26Å; V176-F375 HydrophobicContact CG2-CD1 3.57Å; V176-F375 HydrophobicContact CG2-CD2 3.83Å; V176-F375 HydrophobicContact CG2-CE1 3.71Å; V176-F375 HydrophobicContact CG2-CE2 3.96Å; V176-F375 HydrophobicContact CG2-CG 3.61Å; V176-F375 HydrophobicContact CG2-CZ 3.9Å; V176-Y378 WeakPolarHBondContact O-CE2 3.47Å; V176-Y378 PolarHBondContact O-OH 3.49Å
177	P	96.5	Very high	96.4	Very high	14 Å²	14	34.7 Å²	34.7	9%	0.091	19%	0.193	C	C	.	.			trans	-60.6	144.3	175.3	-24	34.4	0	0	0	112.1	V57 W61 K175 Y179 F180 A181	V57-P177 HydrophobicContact CG1-CB 4.22Å; V57-P177 HydrophobicContact CG1-CG 3.41Å; V57-P177 VanDerWaalsContact CG1-CG 3.41Å; W61-P177 HydrophobicContact CH2-CG 4.46Å; W61-P177 HydrophobicContact CZ2-CG 3.91Å; K175-P177 WeakPolarHBondContact O-CD 3.4Å; P177-Y179 HydrophobicContact CB-CD2 4.01Å; P177-Y179 PolarHBondContact O-N 2.89Å; P177-F180 HydrophobicContact CB-CD2 3.84Å; P177-F180 HydrophobicContact CB-CE2 4.1Å; P177-F180 HydrophobicContact CG-CD2 3.79Å; P177-F180 HydrophobicContact CG-CE2 3.99Å; P177-F180 PolarHBondContact O-N 2.97Å; P177-A181 PolarHBondContact O-N 2.96Å
178	K	96	Very high	96.5	Very high	64 Å²	64	30.4 Å²	30.4	28%	0.278	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-47.4	-35.4	179.3	70.9	-177.1	-177.6	-178.1	0	113.9	L12 L36 Y38 F180 A181 Y378	L12-K178 HydrophobicContact CD2-CB 3.96Å; L12-K178 WeakPolarHBondContact CD2-O 3.31Å; L36-K178 VanDerWaalsContact O-CE 3.28Å; L36-K178 WeakPolarHBondContact O-CE 3.36Å; L36-K178 PolarHBondContact O-NZ 2.89Å; Y38-K178 VanDerWaalsContact CD2-O 3.28Å; Y38-K178 WeakPolarHBondContact CD2-O 3.19Å; Y38-K178 WeakPolarHBondContact CE2-O 3.4Å; K178-F180 PolarHBondContact O-N 2.87Å; K178-A181 PolarHBondContact O-N 2.84Å; K178-Y378 HydrophobicContact CB-CD1 4.21Å; K178-Y378 HydrophobicContact CB-CE1 3.6Å; K178-Y378 PolarHBondContact N-OH 3.37Å
179	Y	97.7	Very high	96.5	Very high	18 Å²	18	29.5 Å²	29.5	7%	0.071	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-59.8	-34.4	-179.5	-50.8	-63.8	0	0	0	112.9	L36 F41 M46 I54 P177	L36-Y179 HydrophobicContact CB-CE1 3.94Å; L36-Y179 HydrophobicContact CG-CE1 4.47Å; L36-Y179 PolarHBondContact N-OH 3.02Å; L36-Y179 VanDerWaalsContact O-CE1 3.28Å; L36-Y179 WeakPolarHBondContact O-CE1 3.34Å; L36-Y179 PolarHBondContact O-OH 2.96Å; F41-Y179 HydrophobicContact CB-CD1 3.56Å; F41-Y179 HydrophobicContact CB-CE1 4.14Å; F41-Y179 HydrophobicContact CB-CG 4.48Å; F41-Y179 HydrophobicContact CD1-CD1 4.02Å; F41-Y179 HydrophobicContact CD1-CG 4.21Å; F41-Y179 HydrophobicContact CD2-CD1 4.28Å; F41-Y179 HydrophobicContact CD2-CG 4.5Å; F41-Y179 VanDerWaalsContact CE1-O 3.25Å; F41-Y179 WeakPolarHBondContact CE1-O 3.4Å; F41-Y179 AromaticContact CG-CD1 3.67Å; F41-Y179 HydrophobicContact CG-CD1 3.67Å; F41-Y179 HydrophobicContact CG-CG 4.12Å; M46-Y179 WeakPolarHBondContact CE-O 3.31Å; I54-Y179 HydrophobicContact CD1-CD1 4.35Å; I54-Y179 HydrophobicContact CD1-CD2 3.48Å; I54-Y179 VanDerWaalsContact CD1-CD2 3.48Å; I54-Y179 HydrophobicContact CD1-CE2 3.81Å; I54-Y179 HydrophobicContact CD1-CG 3.78Å; I54-Y179 HydrophobicContact CG2-CD2 4.31Å; I54-Y179 HydrophobicContact CG2-CE2 3.67Å; P177-Y179 HydrophobicContact CB-CD2 4.01Å; P177-Y179 PolarHBondContact O-N 2.89Å
180	F	97.8	Very high	96.6	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-109.7	10.4	-172	-43.3	-50.5	0	0	0	112.4	F41 I54 V176 P177 K178 W221 A275 F277 W299	F41-F180 HydrophobicContact CE1-CD1 4.19Å; F41-F180 HydrophobicContact CE1-CE1 4.14Å; F41-F180 HydrophobicContact CE2-CE1 4.22Å; F41-F180 HydrophobicContact CZ-CD1 4.05Å; F41-F180 AromaticContact CZ-CE1 3.59Å; F41-F180 HydrophobicContact CZ-CE1 3.59Å; I54-F180 HydrophobicContact CD1-CE1 4.47Å; I54-F180 HydrophobicContact CD1-CZ 3.96Å; V176-F180 HydrophobicContact CG1-CB 4.24Å; P177-F180 HydrophobicContact CB-CD2 3.84Å; P177-F180 HydrophobicContact CB-CE2 4.1Å; P177-F180 HydrophobicContact CG-CD2 3.79Å; P177-F180 HydrophobicContact CG-CE2 3.99Å; P177-F180 PolarHBondContact O-N 2.97Å; K178-F180 PolarHBondContact O-N 2.87Å; F180-W221 HydrophobicContact CB-CG 4.25Å; F180-W221 VanDerWaalsContact CB-NE1 3.32Å; F180-W221 HydrophobicContact CD1-CB 4.21Å; F180-W221 AromaticContact CD1-CD1 3.85Å; F180-W221 HydrophobicContact CD1-CG 4.17Å; F180-W221 HydrophobicContact CD2-CB 3.89Å; F180-W221 AromaticContact CD2-CD1 3.41Å; F180-W221 VanDerWaalsContact CD2-CD1 3.41Å; F180-W221 AromaticContact CD2-CD2 3.63Å; F180-W221 HydrophobicContact CD2-CD2 3.63Å; F180-W221 AromaticContact CD2-CE2 3.78Å; F180-W221 HydrophobicContact CD2-CE3 4.42Å; F180-W221 AromaticContact CD2-CG 3.37Å; F180-W221 HydrophobicContact CD2-CG 3.37Å; F180-W221 AromaticContact CD2-NE1 3.62Å; F180-W221 HydrophobicContact CE1-CB 3.99Å; F180-W221 HydrophobicContact CE1-CG 4.38Å; F180-W221 HydrophobicContact CE2-CB 3.67Å; F180-W221 AromaticContact CE2-CD2 3.98Å; F180-W221 HydrophobicContact CE2-CD2 3.98Å; F180-W221 HydrophobicContact CE2-CE3 4.46Å; F180-W221 AromaticContact CE2-CG 3.64Å; F180-W221 HydrophobicContact CE2-CG 3.64Å; F180-W221 HydrophobicContact CG-CB 4.17Å; F180-W221 AromaticContact CG-CD1 3.26Å; F180-W221 HydrophobicContact CG-CD2 4.3Å; F180-W221 AromaticContact CG-CG 3.67Å; F180-W221 HydrophobicContact CG-CG 3.67Å; F180-W221 AromaticContact CG-NE1 3.62Å; F180-W221 HydrophobicContact CZ-CB 3.72Å; F180-W221 HydrophobicContact CZ-CG 4.15Å; F180-A275 HydrophobicContact CE2-CB 4.21Å; F180-A275 HydrophobicContact CZ-CB 4.44Å; F180-F277 HydrophobicContact CD1-CD2 4.45Å; F180-F277 HydrophobicContact CE1-CB 4.09Å; F180-F277 AromaticContact CE1-CD2 3.96Å; F180-F277 HydrophobicContact CE1-CD2 3.96Å; F180-F277 HydrophobicContact CE1-CG 4.34Å; F180-F277 HydrophobicContact CZ-CB 4.42Å; F180-W299 HydrophobicContact CB-CZ2 4.4Å; F180-W299 HydrophobicContact CD1-CZ2 4Å
181	A	96.4	Very high	96.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.144	C	C	.	.			trans	-75.1	-26.2	-173.5	0	0	0	0	0	113.7	L12 P177 K178 D183 L374 Y378	L12-A181 HydrophobicContact CD1-CB 3.95Å; L12-A181 HydrophobicContact CD2-CB 4.38Å; P177-A181 PolarHBondContact O-N 2.96Å; K178-A181 PolarHBondContact O-N 2.84Å; A181-D183 PolarHBondContact O-N 2.7Å; A181-L374 WeakPolarHBondContact O-CB 3.48Å; A181-L374 WeakPolarHBondContact O-CD1 3.5Å; A181-Y378 HydrophobicContact CB-CD1 4.43Å; A181-Y378 HydrophobicContact CB-CD2 3.41Å; A181-Y378 VanDerWaalsContact CB-CD2 3.41Å; A181-Y378 HydrophobicContact CB-CE2 3.92Å; A181-Y378 HydrophobicContact CB-CG 3.72Å
182	S	96.7	Very high	96.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.			trans	-76	69.7	175.1	179.6	0	0	0	0	109.8	W299 N301 H384	S182-W299 WeakPolarHBondContact O-CZ3 3.4Å; S182-N301 VanDerWaalsContact O-CB 3.25Å; S182-N301 WeakPolarHBondContact O-CB 3.19Å; S182-N301 PolarHBondContact OG-ND2 2.79Å; S182-H384 PolarHBondContact OG-CE1 3.19Å
183	D	97.7	Very high	96	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.			trans	-113.9	93.5	-171.2	-178.3	-16.7	0	0	0	110.8	A181 L185 N186 E187 W299 F375	A181-D183 PolarHBondContact O-N 2.7Å; D183-L185 VanDerWaalsContact C-N 3.29Å; D183-L185 PolarHBondContact O-N 3.48Å; D183-L185 PolarHBondContact OD1-N 2.93Å; D183-N186 PolarHBondContact OD1-N 2.72Å; D183-N186 PolarHBondContact OD1-ND2 2.88Å; D183-N186 WeakPolarHBondContact OD2-CB 3.31Å; D183-N186 PolarHBondContact OD2-ND2 2.91Å; D183-E187 WeakPolarHBondContact O-CB 3.19Å; D183-E187 PolarHBondContact O-N 3.08Å; D183-W299 HydrophobicContact CB-CB 4.05Å; D183-W299 HydrophobicContact CB-CE3 4.35Å; D183-W299 VanDerWaalsContact OD1-CB 3.24Å; D183-W299 WeakPolarHBondContact OD1-CB 3.13Å; D183-W299 WeakPolarHBondContact OD2-CB 3.44Å; D183-F375 HydrophobicContact CB-CE2 3.78Å; D183-F375 HydrophobicContact CB-CZ 3.87Å
184	W	97.8	Very high	95.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-33.7	-175.7	-65.9	4.5	0	0	0	112.4	Q188 F300 N301 I305 L354 L355 I358 D388 C391 L392	W184-Q188 PolarHBondContact O-N 3.38Å; W184-F300 HydrophobicContact CB-CD2 4.32Å; W184-F300 HydrophobicContact CB-CE2 4.42Å; W184-F300 WeakPolarHBondContact CB-O 3.49Å; W184-F300 PolarHBondContact N-O 3.19Å; W184-N301 HydrophobicContact CD2-CB 4.24Å; W184-N301 HydrophobicContact CG-CB 4.17Å; W184-I305 HydrophobicContact CE3-CD1 4.17Å; W184-I305 HydrophobicContact CE3-CG1 4.42Å; W184-I305 HydrophobicContact CZ3-CB 4.13Å; W184-I305 HydrophobicContact CZ3-CD1 4.2Å; W184-I305 HydrophobicContact CZ3-CG1 3.95Å; W184-I305 HydrophobicContact CZ3-CG2 4.36Å; W184-L354 HydrophobicContact CB-CD1 4.46Å; W184-L354 WeakPolarHBondContact O-CD1 3.26Å; W184-L355 HydrophobicContact CZ3-CD2 4.38Å; W184-I358 HydrophobicContact CB-CD1 3.71Å; W184-I358 HydrophobicContact CB-CG1 3.86Å; W184-I358 HydrophobicContact CD2-CB 4.48Å; W184-I358 HydrophobicContact CD2-CG1 4.12Å; W184-I358 HydrophobicContact CD2-CG2 3.86Å; W184-I358 HydrophobicContact CE3-CG1 4.36Å; W184-I358 HydrophobicContact CE3-CG2 4.34Å; W184-I358 HydrophobicContact CG-CD1 3.89Å; W184-I358 HydrophobicContact CG-CG1 3.92Å; W184-I358 HydrophobicContact CG-CG2 4.13Å; W184-I358 HydrophobicContact CZ2-CG2 4.24Å; W184-D388 HydrophobicContact CZ2-CB 3.95Å; W184-D388 WeakPolarHBondContact CZ2-OD1 3.39Å; W184-D388 PolarHBondContact NE1-OD2 3.17Å; W184-D388 VanDerWaalsContact NE1-OD2 3.12Å; W184-C391 HydrophobicContact CH2-CB 4.46Å; W184-L392 HydrophobicContact CH2-CD2 4.06Å; W184-L392 HydrophobicContact CH2-CG 3.91Å; W184-L392 HydrophobicContact CZ3-CD2 3.96Å; W184-L392 HydrophobicContact CZ3-CG 4.33Å
185	L	97.8	Very high	95.1	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-57.5	-179.1	177.7	56.4	0	0	0	110.4	D183 E187 Q188 L189 Y197 F216 F300	D183-L185 VanDerWaalsContact C-N 3.29Å; D183-L185 PolarHBondContact O-N 3.48Å; D183-L185 PolarHBondContact OD1-N 2.93Å; L185-E187 VanDerWaalsContact C-N 3.34Å; L185-Q188 PolarHBondContact O-N 3.33Å; L185-L189 HydrophobicContact CD1-CD1 3.61Å; L185-L189 HydrophobicContact CD1-CG 4.22Å; L185-L189 HydrophobicContact CG-CD1 3.95Å; L185-L189 VanDerWaalsContact O-CG 3.3Å; L185-L189 WeakPolarHBondContact O-CG 3.44Å; L185-L189 PolarHBondContact O-N 3.17Å; L185-L189 VanDerWaalsContact O-N 3.1Å; L185-Y197 HydrophobicContact CD1-CD2 4.21Å; L185-Y197 HydrophobicContact CD1-CE2 4.38Å; L185-Y197 HydrophobicContact CD2-CD1 4.22Å; L185-Y197 HydrophobicContact CD2-CD2 3.64Å; L185-Y197 HydrophobicContact CD2-CE2 4.23Å; L185-Y197 HydrophobicContact CD2-CG 3.62Å; L185-Y197 HydrophobicContact CG-CD2 4Å; L185-Y197 HydrophobicContact CG-CG 4.39Å; L185-F216 HydrophobicContact CD1-CE2 4.48Å; L185-F216 HydrophobicContact CD2-CD2 4.25Å; L185-F216 HydrophobicContact CD2-CE2 4.1Å; L185-F300 HydrophobicContact CB-CD1 4.43Å; L185-F300 HydrophobicContact CB-CD2 4.27Å; L185-F300 HydrophobicContact CB-CE1 4Å; L185-F300 HydrophobicContact CB-CE2 3.73Å; L185-F300 HydrophobicContact CB-CZ 3.63Å; L185-F300 HydrophobicContact CD1-CE1 4.1Å; L185-F300 HydrophobicContact CD1-CZ 3.71Å; L185-F300 HydrophobicContact CD2-CD1 4.36Å; L185-F300 HydrophobicContact CD2-CE1 3.82Å; L185-F300 HydrophobicContact CD2-CZ 4.19Å; L185-F300 HydrophobicContact CG-CE1 4.19Å; L185-F300 HydrophobicContact CG-CZ 4.03Å
186	N	97.3	Very high	95.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-72.6	-28.6	-179.2	-70.3	-70.8	0	0	0	112	D183 Q188 L189 I190 Y197 N298 F375	D183-N186 PolarHBondContact OD1-N 2.72Å; D183-N186 PolarHBondContact OD1-ND2 2.88Å; D183-N186 WeakPolarHBondContact OD2-CB 3.31Å; D183-N186 PolarHBondContact OD2-ND2 2.91Å; N186-Q188 VanDerWaalsContact C-N 3.3Å; N186-Q188 PolarHBondContact O-N 3.01Å; N186-L189 PolarHBondContact O-N 2.72Å; N186-I190 HydrophobicContact CB-CD1 3.99Å; N186-I190 HydrophobicContact CB-CG1 4.48Å; N186-I190 WeakPolarHBondContact O-CB 3.31Å; N186-I190 WeakPolarHBondContact O-CD1 3.46Å; N186-I190 WeakPolarHBondContact O-CG1 3.17Å; N186-I190 PolarHBondContact O-N 2.78Å; N186-Y197 PolarHBondContact OD1-N 3.42Å; N186-N298 PolarHBondContact ND2-O 2.76Å; N186-N298 VanDerWaalsContact ND2-O 3.11Å; N186-F375 HydrophobicContact CB-CE1 4.21Å; N186-F375 HydrophobicContact CB-CZ 4.01Å
187	E	95.5	Very high	95.1	Very high	17 Å²	17	35.8 Å²	35.8	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-56.3	-44.2	173.2	-172.5	178.8	174.3	0	0	111.3	D183 L185 Q191 F357 I358 R361 R362 L374	D183-E187 WeakPolarHBondContact O-CB 3.19Å; D183-E187 PolarHBondContact O-N 3.08Å; L185-E187 VanDerWaalsContact C-N 3.34Å; E187-Q191 VanDerWaalsContact O-CB 3.23Å; E187-Q191 WeakPolarHBondContact O-CB 3.19Å; E187-Q191 PolarHBondContact O-N 2.89Å; E187-F357 HydrophobicContact CG-CE1 4.09Å; E187-I358 HydrophobicContact CB-CD1 4.35Å; E187-I358 HydrophobicContact CG-CD1 4.38Å; E187-R361 IonicContact OE1-CZ 3.71Å; E187-R361 VanDerWaalsContact OE1-CZ 3.24Å; E187-R361 IonicContact OE1-NE 3.93Å; E187-R361 PolarHBondContact OE1-NE 3.36Å; E187-R361 IonicContact OE1-NH2 2.69Å; E187-R361 PolarHBondContact OE1-NH2 3.32Å; E187-R362 IonicContact OE1-CZ 2.89Å; E187-R362 IonicContact OE1-NH1 3.55Å; E187-R362 PolarHBondContact OE1-NH1 3.5Å; E187-R362 IonicContact OE1-NH2 2.68Å; E187-R362 IonicContact OE2-CZ 3.3Å; E187-R362 IonicContact OE2-NH1 3.36Å; E187-R362 PolarHBondContact OE2-NH1 2.81Å; E187-R362 IonicContact OE2-NH2 3.36Å; E187-R362 PolarHBondContact OE2-NH2 3.49Å; E187-L374 HydrophobicContact CG-CD2 4.35Å; E187-L374 WeakPolarHBondContact OE2-CD2 3.48Å
188	Q	95.8	Very high	95.2	Very high	18 Å²	18	37 Å²	37	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-72.9	-50	176.1	-170.9	-170.6	44.7	0	0	112.4	W184 L185 N186 I190 Q191 Q192 E353 L354 F357	W184-Q188 PolarHBondContact O-N 3.38Å; L185-Q188 PolarHBondContact O-N 3.33Å; N186-Q188 VanDerWaalsContact C-N 3.3Å; N186-Q188 PolarHBondContact O-N 3.01Å; Q188-I190 PolarHBondContact O-N 3.35Å; Q188-Q191 PolarHBondContact O-N 2.8Å; Q188-Q192 HydrophobicContact CG-CG 4.38Å; Q188-Q192 WeakPolarHBondContact O-CB 3.42Å; Q188-Q192 WeakPolarHBondContact O-CG 3.3Å; Q188-Q192 PolarHBondContact O-N 2.83Å; Q188-E353 PolarHBondContact NE2-O 2.98Å; Q188-L354 HydrophobicContact CB-CD1 3.97Å; Q188-L354 VanDerWaalsContact NE2-CA 3.31Å; Q188-F357 HydrophobicContact CB-CD1 3.6Å; Q188-F357 HydrophobicContact CB-CE1 3.68Å; Q188-F357 HydrophobicContact CB-CG 4.2Å; Q188-F357 HydrophobicContact CB-CZ 4.31Å; Q188-F357 HydrophobicContact CG-CB 4.26Å; Q188-F357 HydrophobicContact CG-CD1 3.75Å; Q188-F357 HydrophobicContact CG-CD2 4.18Å; Q188-F357 HydrophobicContact CG-CE1 4.09Å; Q188-F357 HydrophobicContact CG-CE2 4.48Å; Q188-F357 HydrophobicContact CG-CG 3.79Å; Q188-F357 HydrophobicContact CG-CZ 4.43Å
189	L	95.8	Very high	95.3	Very high	22 Å²	22	34.7 Å²	34.7	12%	0.115	18%	0.18	C	C	.	.	H	α-helix	trans	-64.2	-42.4	-171.9	-69.3	174.7	0	0	0	112.5	L185 N186 Q192 G193 K194 D195 Y197	L185-L189 HydrophobicContact CD1-CD1 3.61Å; L185-L189 HydrophobicContact CD1-CG 4.22Å; L185-L189 HydrophobicContact CG-CD1 3.95Å; L185-L189 VanDerWaalsContact O-CG 3.3Å; L185-L189 WeakPolarHBondContact O-CG 3.44Å; L185-L189 PolarHBondContact O-N 3.17Å; L185-L189 VanDerWaalsContact O-N 3.1Å; N186-L189 PolarHBondContact O-N 2.72Å; L189-Q192 PolarHBondContact O-N 3.42Å; L189-G193 PolarHBondContact O-N 2.79Å; L189-K194 PolarHBondContact O-N 3.41Å; L189-D195 CarbonylContact C-O 3.59Å; L189-D195 VanDerWaalsContact CB-O 3.31Å; L189-D195 WeakPolarHBondContact CB-O 3.18Å; L189-D195 HydrophobicContact CD1-CB 4.38Å; L189-D195 HydrophobicContact CD2-CB 4.2Å; L189-Y197 HydrophobicContact CD1-CD2 3.58Å; L189-Y197 HydrophobicContact CD1-CE2 3.94Å
190	I	94.2	Very high	95.4	Very high	72 Å²	72	33.9 Å²	33.9	37%	0.369	18%	0.177	S	C	.	.	H	α-helix	trans	-64.6	-46.5	176.3	-65.6	168.7	0	0	0	110.1	N186 Q188 Q192 G193 F375	N186-I190 HydrophobicContact CB-CD1 3.99Å; N186-I190 HydrophobicContact CB-CG1 4.48Å; N186-I190 WeakPolarHBondContact O-CB 3.31Å; N186-I190 WeakPolarHBondContact O-CD1 3.46Å; N186-I190 WeakPolarHBondContact O-CG1 3.17Å; N186-I190 PolarHBondContact O-N 2.78Å; Q188-I190 PolarHBondContact O-N 3.35Å; I190-Q192 PolarHBondContact O-N 3.19Å; I190-G193 PolarHBondContact O-N 2.87Å; I190-G193 VanDerWaalsContact O-N 3.09Å; I190-F375 HydrophobicContact CD1-CD1 4.12Å; I190-F375 HydrophobicContact CD1-CE1 3.71Å
191	Q	91.9	Very high	95.4	Very high	118 Å²	118	35.1 Å²	35.1	55%	0.551	18%	0.182	S	C	*	.	H	α-helix	trans	-61.4	-32.8	-179.9	-179.4	63.2	69	0	0	112.6	E187 Q188 F357	E187-Q191 VanDerWaalsContact O-CB 3.23Å; E187-Q191 WeakPolarHBondContact O-CB 3.19Å; E187-Q191 PolarHBondContact O-N 2.89Å; Q188-Q191 PolarHBondContact O-N 2.8Å; Q191-F357 HydrophobicContact CB-CE2 4.15Å; Q191-F357 HydrophobicContact CB-CZ 3.77Å; Q191-F357 HydrophobicContact CG-CE2 3.79Å; Q191-F357 HydrophobicContact CG-CZ 3.8Å
192	Q	92.1	Very high	95.5	Very high	76 Å²	76	35.1 Å²	35.1	36%	0.355	18%	0.182	S	C	.	.	H	α-helix	trans	-88.6	-9.9	178.5	-65.4	-178.3	5.6	0	0	113.4	Q188 L189 I190 K194	Q188-Q192 HydrophobicContact CG-CG 4.38Å; Q188-Q192 WeakPolarHBondContact O-CB 3.42Å; Q188-Q192 WeakPolarHBondContact O-CG 3.3Å; Q188-Q192 PolarHBondContact O-N 2.83Å; L189-Q192 PolarHBondContact O-N 3.42Å; I190-Q192 PolarHBondContact O-N 3.19Å; Q192-K194 HydrophobicContact CB-CB 4.5Å; Q192-K194 HydrophobicContact CB-CD 4.12Å; Q192-K194 HydrophobicContact CB-CG 3.93Å; Q192-K194 PolarHBondContact O-N 2.78Å; Q192-K194 VanDerWaalsContact OE1-CD 3.26Å
193	G	90.6	Very high	95.5	Very high	71 Å²	71	35.1 Å²	35.1	73%	0.732	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	30.7	-176.3	0	0	0	0	0	113.5	L189 I190	L189-G193 PolarHBondContact O-N 2.79Å; I190-G193 PolarHBondContact O-N 2.87Å; I190-G193 VanDerWaalsContact O-N 3.09Å
194	K	85.8	Confident	95.3	Very high	136 Å²	136	35.5 Å²	35.5	59%	0.591	18%	0.184	S	C	*	.	S	Bend	trans	-93.2	-44.6	-174.4	-76.2	-176.8	-177.6	166.4	0	113.4	L189 Q192	L189-K194 PolarHBondContact O-N 3.41Å; Q192-K194 HydrophobicContact CB-CB 4.5Å; Q192-K194 HydrophobicContact CB-CD 4.12Å; Q192-K194 HydrophobicContact CB-CG 3.93Å; Q192-K194 PolarHBondContact O-N 2.78Å; Q192-K194 VanDerWaalsContact OE1-CD 3.26Å
195	D	90.3	Very high	95.1	Very high	77 Å²	77	38.7 Å²	38.7	41%	0.412	20%	0.198	S	C	.	.			trans	-165.1	-176.8	-173.2	-150.4	-22.1	0	0	0	109.8	H163 L189	H163-D195 IonicContact CE1-OD1 3.83Å; H163-D195 PolarHBondContact CE1-OD1 3.06Å; H163-D195 VanDerWaalsContact CE1-OD1 3.3Å; H163-D195 IonicContact ND1-OD1 2.96Å; H163-D195 PolarHBondContact ND1-OD1 3.2Å; L189-D195 CarbonylContact C-O 3.59Å; L189-D195 VanDerWaalsContact CB-O 3.31Å; L189-D195 WeakPolarHBondContact CB-O 3.18Å; L189-D195 HydrophobicContact CD1-CB 4.38Å; L189-D195 HydrophobicContact CD2-CB 4.2Å
196	D	96.5	Very high	94.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.214	C	C	.	.			trans	-153.1	147.1	163.2	67.1	-17.1	0	0	0	112.1	H163 A166 R198	H163-D196 WeakPolarHBondContact CB-OD1 3.48Å; H163-D196 PolarHBondContact CE1-O 2.97Å; H163-D196 IonicContact CE1-OD1 3.84Å; H163-D196 IonicContact CG-OD1 3.47Å; H163-D196 PolarHBondContact ND1-O 2.82Å; H163-D196 IonicContact ND1-OD1 3.64Å; H163-D196 PolarHBondContact ND1-OD1 2.58Å; A166-D196 WeakPolarHBondContact CB-OD1 3.47Å; A166-D196 PolarHBondContact N-OD2 3.46Å; D196-R198 VanDerWaalsContact C-N 3.25Å; D196-R198 HydrophobicContact CB-CB 4.33Å; D196-R198 HydrophobicContact CB-CG 4Å; D196-R198 PolarHBondContact O-N 2.88Å; D196-R198 IonicContact OD2-CZ 3.53Å; D196-R198 VanDerWaalsContact OD2-CZ 3.22Å; D196-R198 IonicContact OD2-NE 3.76Å; D196-R198 PolarHBondContact OD2-NE 2.94Å; D196-R198 IonicContact OD2-NH2 3.26Å; D196-R198 PolarHBondContact OD2-NH2 3.23Å
197	Y	97.6	Very high	94.7	Very high	40 Å²	40	41.8 Å²	41.8	16%	0.157	21%	0.214	C	C	.	.			trans	-97	53.6	170.8	-82.9	-101.4	0	0	0	109.8	L185 N186 L189 F199 V215 F216 H297 N298	L185-Y197 HydrophobicContact CD1-CD2 4.21Å; L185-Y197 HydrophobicContact CD1-CE2 4.38Å; L185-Y197 HydrophobicContact CD2-CD1 4.22Å; L185-Y197 HydrophobicContact CD2-CD2 3.64Å; L185-Y197 HydrophobicContact CD2-CE2 4.23Å; L185-Y197 HydrophobicContact CD2-CG 3.62Å; L185-Y197 HydrophobicContact CG-CD2 4Å; L185-Y197 HydrophobicContact CG-CG 4.39Å; N186-Y197 PolarHBondContact OD1-N 3.42Å; L189-Y197 HydrophobicContact CD1-CD2 3.58Å; L189-Y197 HydrophobicContact CD1-CE2 3.94Å; Y197-F199 HydrophobicContact CD1-CE2 4.08Å; Y197-F199 AromaticContact CD1-CZ 3.72Å; Y197-F199 HydrophobicContact CD1-CZ 3.72Å; Y197-F199 HydrophobicContact CE1-CZ 4.45Å; Y197-F199 HydrophobicContact CG-CE2 4.5Å; Y197-F199 HydrophobicContact CG-CZ 4.13Å; Y197-V215 HydrophobicContact CD1-CG1 4.24Å; Y197-V215 HydrophobicContact CE1-CG1 3.93Å; Y197-V215 HydrophobicContact CE1-CG2 3.85Å; Y197-F216 AromaticContact CE1-CE2 3.77Å; Y197-F216 HydrophobicContact CE1-CE2 3.77Å; Y197-F216 HydrophobicContact CE1-CZ 4.26Å; Y197-F216 HydrophobicContact CE2-CE2 4.02Å; Y197-F216 HydrophobicContact CE2-CZ 4.38Å; Y197-F216 AromaticContact CZ-CE2 3.48Å; Y197-F216 VanDerWaalsContact CZ-CE2 3.48Å; Y197-F216 AromaticContact CZ-CZ 3.7Å; Y197-F216 WeakPolarHBondContact OH-CE2 3.42Å; Y197-F216 WeakPolarHBondContact OH-CZ 3.45Å; Y197-H297 CarbonylContact O-C 3.54Å; Y197-H297 WeakPolarHBondContact O-CA 3.47Å; Y197-H297 WeakPolarHBondContact O-CB 3.36Å; Y197-N298 WeakPolarHBondContact CB-O 3.43Å; Y197-N298 HydrophobicContact CD1-CB 3.91Å; Y197-N298 HydrophobicContact CG-CB 4.4Å; Y197-N298 PolarHBondContact O-N 3.18Å
198	R	98.2	Very high	94.8	Very high	41 Å²	41	42 Å²	42	16%	0.155	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	107.5	-174.8	-49.1	-179	-55.7	172.2	-4.5	109.5	A165 Y174 D196 N296 H297	A165-R198 VanDerWaalsContact CB-NH2 3.3Å; Y174-R198 WeakPolarHBondContact OH-CD 3.4Å; D196-R198 VanDerWaalsContact C-N 3.25Å; D196-R198 HydrophobicContact CB-CB 4.33Å; D196-R198 HydrophobicContact CB-CG 4Å; D196-R198 PolarHBondContact O-N 2.88Å; D196-R198 IonicContact OD2-CZ 3.53Å; D196-R198 VanDerWaalsContact OD2-CZ 3.22Å; D196-R198 IonicContact OD2-NE 3.76Å; D196-R198 PolarHBondContact OD2-NE 2.94Å; D196-R198 IonicContact OD2-NH2 3.26Å; D196-R198 PolarHBondContact OD2-NH2 3.23Å; R198-N296 CarbonylContact C-O 3.58Å; R198-H297 WeakPolarHBondContact CB-NE2 3.4Å; R198-H297 WeakPolarHBondContact CD-CE1 3.3Å; R198-H297 WeakPolarHBondContact CG-CE1 3.39Å; R198-H297 WeakPolarHBondContact CG-NE2 3.27Å
199	F	98.5	Very high	94.7	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.066	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.4	-164.3	-50.6	-68.6	0	0	0	111.6	D161 W162 H163 Y197 Y201 V295 N296 N298	D161-F199 HydrophobicContact CB-CD1 4.32Å; W162-F199 CarbonylContact O-C 3.59Å; W162-F199 WeakPolarHBondContact O-CA 3.41Å; H163-F199 AromaticContact CE1-CE1 3.52Å; H163-F199 AromaticContact NE2-CE1 3.54Å; Y197-F199 HydrophobicContact CD1-CE2 4.08Å; Y197-F199 AromaticContact CD1-CZ 3.72Å; Y197-F199 HydrophobicContact CD1-CZ 3.72Å; Y197-F199 HydrophobicContact CE1-CZ 4.45Å; Y197-F199 HydrophobicContact CG-CE2 4.5Å; Y197-F199 HydrophobicContact CG-CZ 4.13Å; F199-Y201 HydrophobicContact CB-CD2 4.11Å; F199-Y201 HydrophobicContact CB-CE2 3.47Å; F199-Y201 VanDerWaalsContact CB-CE2 3.47Å; F199-Y201 HydrophobicContact CG-CE2 4.29Å; F199-V295 WeakPolarHBondContact O-CA 3.34Å; F199-N296 HydrophobicContact CB-CB 4.43Å; F199-N296 PolarHBondContact N-O 3.27Å; F199-N296 PolarHBondContact O-N 2.96Å; F199-N298 VanDerWaalsContact CE2-OD1 3.28Å; F199-N298 WeakPolarHBondContact CE2-OD1 3.43Å
200	V	98.7	Very high	94.7	Very high	1 Å²	1	42 Å²	42	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.9	162.8	178.7	0	0	0	0	108.5	W66 W162 L164 F173 M202 I293 S294	W66-V200 HydrophobicContact CH2-CG1 4.16Å; W66-V200 HydrophobicContact CH2-CG2 4.22Å; W66-V200 HydrophobicContact CZ3-CG1 4.1Å; W162-V200 WeakPolarHBondContact CB-O 3.34Å; W162-V200 HydrophobicContact CE3-CB 3.99Å; W162-V200 HydrophobicContact CE3-CG1 4.05Å; W162-V200 PolarHBondContact N-O 2.76Å; W162-V200 PolarHBondContact O-N 3.19Å; L164-V200 HydrophobicContact CB-CB 4.46Å; L164-V200 HydrophobicContact CB-CG2 3.86Å; L164-V200 HydrophobicContact CD2-CG2 4.06Å; F173-V200 HydrophobicContact CE2-CG2 3.64Å; F173-V200 HydrophobicContact CZ-CG2 3.7Å; V200-M202 HydrophobicContact CG1-CE 3.74Å; V200-M202 HydrophobicContact CG1-CG 4.03Å; V200-I293 HydrophobicContact CG1-CG2 4.37Å; V200-S294 WeakPolarHBondContact CA-O 3.25Å
201	Y	98.7	Very high	94.8	Very high	26 Å²	26	39.2 Å²	39.2	10%	0.102	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.4	172.9	-67.4	-104.7	0	0	0	108.4	Y158 L159 K160 D161 F199 I293 S294 N296	Y158-Y201 HydrophobicContact CE1-CD1 4.37Å; Y158-Y201 HydrophobicContact CE2-CD1 4.15Å; Y158-Y201 AromaticContact CZ-CD1 3.72Å; Y158-Y201 WeakPolarHBondContact OH-CD1 3.49Å; L159-Y201 CarbonylContact O-C 3.6Å; L159-Y201 WeakPolarHBondContact O-CA 3.33Å; K160-Y201 HydrophobicContact CB-CD1 3.35Å; K160-Y201 HydrophobicContact CB-CE1 3.41Å; K160-Y201 VanDerWaalsContact CB-CE1 3.41Å; K160-Y201 HydrophobicContact CB-CG 4.42Å; D161-Y201 PolarHBondContact OD1-OH 2.83Å; F199-Y201 HydrophobicContact CB-CD2 4.11Å; F199-Y201 HydrophobicContact CB-CE2 3.47Å; F199-Y201 VanDerWaalsContact CB-CE2 3.47Å; F199-Y201 HydrophobicContact CG-CE2 4.29Å; Y201-I293 CarbonylContact O-C 3.59Å; Y201-I293 VanDerWaalsContact O-CA 3.25Å; Y201-I293 WeakPolarHBondContact O-CA 3.28Å; Y201-I293 WeakPolarHBondContact O-CG2 3.38Å; Y201-S294 PolarHBondContact N-O 2.82Å; Y201-S294 PolarHBondContact O-N 3.27Å; Y201-N296 HydrophobicContact CD2-CB 4.03Å; Y201-N296 WeakPolarHBondContact CD2-OD1 3.48Å; Y201-N296 HydrophobicContact CE2-CB 3.7Å
202	M	98.3	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119.3	175.2	-60.1	-168.9	177.6	0	0	107.8	W66 L92 F121 Y124 W128 Y158 L159 W162 V200 I293	W66-M202 HydrophobicContact CE3-CE 4.32Å; W66-M202 HydrophobicContact CH2-CE 4.45Å; W66-M202 HydrophobicContact CZ3-CE 4.22Å; L92-M202 HydrophobicContact CD2-CE 3.88Å; F121-M202 HydrophobicContact CE2-CE 4.37Å; F121-M202 HydrophobicContact CE2-SD 3.75Å; F121-M202 HydrophobicContact CZ-CE 4.27Å; F121-M202 HydrophobicContact CZ-SD 4.04Å; Y124-M202 HydrophobicContact CE1-CB 4.12Å; Y124-M202 PolarHBondContact OH-O 3.48Å; W128-M202 HydrophobicContact CH2-CB 4.16Å; W128-M202 HydrophobicContact CZ3-CB 3.74Å; Y158-M202 VanDerWaalsContact CD2-O 3.31Å; Y158-M202 WeakPolarHBondContact CD2-O 3.19Å; L159-M202 WeakPolarHBondContact CA-O 3.33Å; L159-M202 HydrophobicContact CB-CB 4.19Å; L159-M202 WeakPolarHBondContact CB-O 3.43Å; L159-M202 HydrophobicContact CD1-CB 4.48Å; L159-M202 PolarHBondContact N-O 3.25Å; L159-M202 PolarHBondContact O-N 2.89Å; L159-M202 VanDerWaalsContact O-O 3.1Å; W162-M202 HydrophobicContact CE3-CE 4.49Å; W162-M202 HydrophobicContact CZ3-CE 3.83Å; W162-M202 HydrophobicContact CZ3-SD 4.3Å; V200-M202 HydrophobicContact CG1-CE 3.74Å; V200-M202 HydrophobicContact CG1-CG 4.03Å; M202-I293 HydrophobicContact CB-CG1 4.3Å; M202-I293 HydrophobicContact CE-CD1 4.37Å; M202-I293 HydrophobicContact CE-CG2 4.15Å; M202-I293 HydrophobicContact CG-CB 4.43Å; M202-I293 HydrophobicContact CG-CD1 4.3Å; M202-I293 HydrophobicContact CG-CG1 3.96Å; M202-I293 HydrophobicContact CG-CG2 3.87Å; M202-I293 HydrophobicContact SD-CD1 4.27Å
203	G	95.8	Very high	95.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	141.6	-172.3	0	0	0	0	0	113.5	W128 Y158 T292	W128-G203 VanDerWaalsContact CZ2-C 3.48Å; W128-G203 WeakPolarHBondContact CZ2-O 3.39Å; Y158-G203 VanDerWaalsContact CD2-CA 3.47Å; G203-T292 PolarHBondContact N-O 3.09Å; G203-T292 PolarHBondContact O-N 3.4Å
204	P	94.3	Very high	95.6	Very high	8 Å²	8	31.4 Å²	31.4	5%	0.052	15%	0.152	C	C	.	.			trans	-66.2	166.5	173.9	31.4	-38.1	0	0	0	111.9	W128 N156 L157 N206 S207 D291	W128-P204 VanDerWaalsContact NE1-CA 3.32Å; N156-P204 WeakPolarHBondContact OD1-CG 3.43Å; L157-P204 WeakPolarHBondContact O-CD 3.5Å; P204-N206 PolarHBondContact O-N 3.44Å; P204-S207 WeakPolarHBondContact O-CB 3.47Å; P204-S207 PolarHBondContact O-N 3.09Å; P204-S207 VanDerWaalsContact O-N 3.08Å; P204-S207 PolarHBondContact O-OG 2.97Å; P204-D291 VanDerWaalsContact CA-OD1 3.24Å; P204-D291 WeakPolarHBondContact CA-OD1 3.45Å
205	K	92.7	Very high	95.9	Very high	66 Å²	66	27.4 Å²	27.4	29%	0.287	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	137.2	166.3	177.2	171.9	180	-171.9	0	111.2	S207 L289 D291	K205-S207 VanDerWaalsContact C-N 3.27Å; K205-S207 PolarHBondContact O-N 3.27Å; K205-L289 WeakPolarHBondContact CE-O 3.4Å; K205-L289 WeakPolarHBondContact CG-O 3.49Å; K205-D291 PolarHBondContact N-OD1 3.42Å
206	N	93	Very high	96.1	Very high	72 Å²	72	24 Å²	24	39%	0.385	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	5.8	-177.7	-51.4	-32.2	0	0	0	115.5	N156 P204 N288	N156-N206 PolarHBondContact ND2-O 2.82Å; P204-N206 PolarHBondContact O-N 3.44Å; N206-N288 WeakPolarHBondContact CA-O 3.49Å; N206-N288 PolarHBondContact N-O 3.28Å
207	S	95	Very high	96	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.			trans	-69.2	150.2	165	68.1	0	0	0	0	110.6	N156 P204 K205 N288	N156-S207 PolarHBondContact ND2-N 2.93Å; P204-S207 WeakPolarHBondContact O-CB 3.47Å; P204-S207 PolarHBondContact O-N 3.09Å; P204-S207 VanDerWaalsContact O-N 3.08Å; P204-S207 PolarHBondContact O-OG 2.97Å; K205-S207 VanDerWaalsContact C-N 3.27Å; K205-S207 PolarHBondContact O-N 3.27Å; S207-N288 WeakPolarHBondContact O-CB 3.48Å; S207-N288 PolarHBondContact O-N 2.91Å; S207-N288 PolarHBondContact OG-ND2 3.07Å
208	W	96.1	Very high	96.1	Very high	23 Å²	23	22.4 Å²	22.4	9%	0.087	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-152.5	164.9	-170.5	63.8	-80.6	0	0	0	113.3	C106 H114 F251 Q285 V286 W287	C106-W208 PolarHBondContact O-NE1 2.78Å; C106-W208 PolarHBondContact SG-N 3.4Å; C106-W208 VanDerWaalsContact SG-N 3.41Å; C106-W208 PolarHBondContact SG-O 3.18Å; H114-W208 AromaticContact CE1-CD2 3.9Å; H114-W208 AromaticContact CE1-CE2 3.79Å; H114-W208 PolarHBondContact CE1-O 2.91Å; H114-W208 AromaticContact NE2-CD2 3.86Å; H114-W208 AromaticContact NE2-CE2 3.27Å; H114-W208 VanDerWaalsContact NE2-CE2 3.27Å; H114-W208 AromaticContact NE2-CH2 3.74Å; H114-W208 AromaticContact NE2-CZ2 3.2Å; H114-W208 WeakPolarHBondContact NE2-CZ2 3.29Å; H114-W208 AromaticContact NE2-NE1 3.71Å; W208-F251 AromaticContact CH2-CD1 3.67Å; W208-F251 HydrophobicContact CH2-CD1 3.67Å; W208-F251 AromaticContact CH2-CE1 3.22Å; W208-F251 HydrophobicContact CH2-CE1 3.22Å; W208-F251 HydrophobicContact CH2-CG 4.49Å; W208-F251 AromaticContact CH2-CZ 3.7Å; W208-F251 HydrophobicContact CH2-CZ 3.7Å; W208-F251 HydrophobicContact CZ2-CD1 4.47Å; W208-F251 AromaticContact CZ2-CE1 3.72Å; W208-F251 HydrophobicContact CZ2-CE1 3.72Å; W208-F251 HydrophobicContact CZ2-CZ 4.23Å; W208-F251 HydrophobicContact CZ3-CE1 4.25Å; W208-F251 HydrophobicContact CZ3-CZ 4.42Å; W208-Q285 VanDerWaalsContact CZ3-NE2 3.28Å; W208-V286 CarbonylContact C-O 3.6Å; W208-V286 WeakPolarHBondContact CA-O 3.48Å; W208-V286 WeakPolarHBondContact CB-O 3.28Å; W208-W287 HydrophobicContact CB-CD2 3.67Å; W208-W287 HydrophobicContact CB-CE3 3.49Å; W208-W287 VanDerWaalsContact CB-CE3 3.49Å; W208-W287 HydrophobicContact CB-CG 4.22Å; W208-W287 HydrophobicContact CB-CH2 4.25Å; W208-W287 HydrophobicContact CB-CZ2 4.41Å; W208-W287 HydrophobicContact CB-CZ3 3.8Å; W208-W287 AromaticContact CD1-CH2 3.83Å; W208-W287 AromaticContact CD1-CZ3 3.48Å; W208-W287 VanDerWaalsContact CD1-CZ3 3.48Å; W208-W287 AromaticContact CD2-CH2 3.94Å; W208-W287 HydrophobicContact CD2-CH2 3.94Å; W208-W287 HydrophobicContact CD2-CZ2 4.16Å; W208-W287 HydrophobicContact CD2-CZ3 4.26Å; W208-W287 HydrophobicContact CE3-CZ2 4.29Å; W208-W287 HydrophobicContact CG-CD2 4.26Å; W208-W287 AromaticContact CG-CE3 3.85Å; W208-W287 HydrophobicContact CG-CE3 3.85Å; W208-W287 AromaticContact CG-CH2 3.77Å; W208-W287 HydrophobicContact CG-CH2 3.77Å; W208-W287 HydrophobicContact CG-CZ2 4.2Å; W208-W287 AromaticContact CG-CZ3 3.59Å; W208-W287 HydrophobicContact CG-CZ3 3.59Å
209	T	95.3	Very high	96.1	Very high	13 Å²	13	20.5 Å²	20.5	8%	0.08	11%	0.109	C	C	.	.			trans	-108.1	142.7	173.5	64.4	0	0	0	0	110.4	Y158 Q285 V286	Y158-T209 HydrophobicContact CE1-CG2 4.02Å; T209-Q285 VanDerWaalsContact O-CG 3.31Å; T209-Q285 WeakPolarHBondContact O-CG 3.18Å; T209-V286 PolarHBondContact N-O 2.99Å; T209-V286 PolarHBondContact OG1-N 2.67Å; T209-V286 VanDerWaalsContact OG1-N 3.16Å
210	S	94.3	Very high	96.1	Very high	27 Å²	27	20 Å²	20	19%	0.189	11%	0.108	C	C	.	.			trans	-56.7	158.8	172.4	55	0	0	0	0	112.1	H212 F251	S210-H212 PolarHBondContact O-N 3.38Å; S210-H212 PolarHBondContact O-ND1 2.76Å; S210-F251 WeakPolarHBondContact CA-O 3.45Å
211	Y	96.9	Very high	96.1	Very high	13 Å²	13	20 Å²	20	5%	0.051	11%	0.108	C	C	.	.	S	Bend	trans	-65.3	120.2	171.2	178.4	-121.5	0	0	0	110.6	M234 E239 L242 L249 P250 F251 I253 F283 H284	Y211-M234 HydrophobicContact CE2-CE 3.56Å; Y211-M234 HydrophobicContact CE2-SD 4.15Å; Y211-M234 PolarHBondContact OH-SD 3.41Å; Y211-E239 WeakPolarHBondContact OH-CA 3.03Å; Y211-E239 WeakPolarHBondContact OH-CB 3.48Å; Y211-L242 HydrophobicContact CE1-CD1 4.04Å; Y211-L249 HydrophobicContact CD1-CB 4.28Å; Y211-L249 HydrophobicContact CE1-CB 4.24Å; Y211-L249 HydrophobicContact CE1-CD1 4.43Å; Y211-L249 HydrophobicContact CE1-CD2 4.12Å; Y211-P250 HydrophobicContact CD1-CG 3.95Å; Y211-P250 WeakPolarHBondContact CD1-O 3.35Å; Y211-P250 HydrophobicContact CE1-CG 4.29Å; Y211-F251 PolarHBondContact N-O 2.94Å; Y211-I253 HydrophobicContact CD1-CG2 4.04Å; Y211-I253 HydrophobicContact CD2-CD1 3.49Å; Y211-I253 VanDerWaalsContact CD2-CD1 3.49Å; Y211-I253 HydrophobicContact CD2-CG1 3.92Å; Y211-I253 HydrophobicContact CD2-CG2 4.17Å; Y211-I253 HydrophobicContact CE1-CG2 4.47Å; Y211-I253 HydrophobicContact CE2-CD1 3.75Å; Y211-I253 HydrophobicContact CG-CD1 4.25Å; Y211-I253 HydrophobicContact CG-CG1 4.23Å; Y211-I253 HydrophobicContact CG-CG2 3.87Å; Y211-F283 HydrophobicContact CE1-CD1 4.11Å; Y211-F283 HydrophobicContact CE2-CB 3.57Å; Y211-F283 HydrophobicContact CE2-CD1 4.24Å; Y211-F283 HydrophobicContact CE2-CG 4.37Å; Y211-F283 AromaticContact CZ-CD1 3.87Å; Y211-F283 VanDerWaalsContact OH-CB 3.28Å; Y211-F283 WeakPolarHBondContact OH-CB 3.23Å; Y211-H284 WeakPolarHBondContact CA-O 3.3Å
212	H	96.2	Very high	96.1	Very high	59 Å²	59	18.7 Å²	18.7	27%	0.273	10%	0.103	S	C	.	.	B	Isolated β-bridge	trans	-160.3	166.4	-175.7	68.9	-64	0	0	0	112.3	S210 F283 H284	S210-H212 PolarHBondContact O-N 3.38Å; S210-H212 PolarHBondContact O-ND1 2.76Å; H212-F283 CarbonylContact O-C 3.57Å; H212-F283 VanDerWaalsContact O-CA 3.32Å; H212-F283 WeakPolarHBondContact O-CA 3.35Å; H212-H284 AromaticContact CE1-NE2 3.57Å; H212-H284 PolarHBondContact N-O 3.3Å; H212-H284 AromaticContact NE2-NE2 3.74Å; H212-H284 PolarHBondContact O-N 2.8Å
213	A	97.1	Very high	96.1	Very high	25 Å²	25	18.7 Å²	18.7	21%	0.207	10%	0.103	C	C	.	.			trans	-106.5	155.7	157.3	0	0	0	0	0	109	F283	A213-F283 HydrophobicContact CB-CD1 3.99Å; A213-F283 HydrophobicContact CB-CD2 3.69Å; A213-F283 HydrophobicContact CB-CE1 3.89Å; A213-F283 HydrophobicContact CB-CE2 3.59Å; A213-F283 HydrophobicContact CB-CG 3.88Å; A213-F283 HydrophobicContact CB-CZ 3.7Å; A213-F283 VanDerWaalsContact N-CD1 3.35Å
214	D	97.4	Very high	96.2	Very high	17 Å²	17	18.7 Å²	18.7	9%	0.091	10%	0.103	C	C	.	.			trans	-62.6	146.4	-176.7	-77.9	-65.9	0	0	0	113.3	G217 S220 H284 N298	D214-G217 WeakPolarHBondContact O-CA 3.33Å; D214-G217 PolarHBondContact O-N 3.39Å; D214-S220 WeakPolarHBondContact OD2-CB 3.44Å; D214-H284 IonicContact OD2-CE1 2.84Å; D214-H284 PolarHBondContact OD2-CE1 2.81Å; D214-N298 VanDerWaalsContact CB-ND2 3.32Å; D214-N298 WeakPolarHBondContact CB-ND2 3.2Å; D214-N298 PolarHBondContact OD1-ND2 2.88Å
215	V	93	Very high	96.4	Very high	52 Å²	52	18.5 Å²	18.5	32%	0.315	10%	0.101	S	C	.	.	G	3₁₀ helix	trans	-50.7	140.9	-178.5	29.7	0	0	0	0	111.3	Y197 G217 S218 N298	Y197-V215 HydrophobicContact CD1-CG1 4.24Å; Y197-V215 HydrophobicContact CE1-CG1 3.93Å; Y197-V215 HydrophobicContact CE1-CG2 3.85Å; V215-G217 PolarHBondContact O-N 2.78Å; V215-S218 WeakPolarHBondContact O-CB 3.37Å; V215-S218 PolarHBondContact O-N 3.39Å; V215-S218 PolarHBondContact O-OG 3.39Å; V215-N298 HydrophobicContact CG1-CB 4.38Å
216	F	95.6	Very high	96.5	Very high	4 Å²	4	15.5 Å²	15.5	2%	0.018	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	65	-4.4	-172.9	-43.4	-50.8	0	0	0	115.8	L185 Y197 F300 V308 N311 F344 I346	L185-F216 HydrophobicContact CD1-CE2 4.48Å; L185-F216 HydrophobicContact CD2-CD2 4.25Å; L185-F216 HydrophobicContact CD2-CE2 4.1Å; Y197-F216 AromaticContact CE1-CE2 3.77Å; Y197-F216 HydrophobicContact CE1-CE2 3.77Å; Y197-F216 HydrophobicContact CE1-CZ 4.26Å; Y197-F216 HydrophobicContact CE2-CE2 4.02Å; Y197-F216 HydrophobicContact CE2-CZ 4.38Å; Y197-F216 AromaticContact CZ-CE2 3.48Å; Y197-F216 VanDerWaalsContact CZ-CE2 3.48Å; Y197-F216 AromaticContact CZ-CZ 3.7Å; Y197-F216 WeakPolarHBondContact OH-CE2 3.42Å; Y197-F216 WeakPolarHBondContact OH-CZ 3.45Å; F216-F300 HydrophobicContact CB-CE1 4.35Å; F216-F300 HydrophobicContact CD2-CD1 4.48Å; F216-F300 AromaticContact CD2-CE1 3.79Å; F216-F300 HydrophobicContact CD2-CE1 3.79Å; F216-F300 HydrophobicContact CG-CE1 4.37Å; F216-V308 HydrophobicContact CB-CG1 4.16Å; F216-V308 WeakPolarHBondContact O-CA 3.31Å; F216-N311 PolarHBondContact O-ND2 3.09Å; F216-F344 HydrophobicContact CB-CE1 4.49Å; F216-F344 HydrophobicContact CB-CZ 4.33Å; F216-F344 AromaticContact CD1-CD1 3.94Å; F216-F344 HydrophobicContact CD1-CD1 3.94Å; F216-F344 AromaticContact CD1-CE1 3.7Å; F216-F344 HydrophobicContact CD1-CE1 3.7Å; F216-F344 HydrophobicContact CD1-CZ 4.1Å; F216-F344 HydrophobicContact CE1-CD1 4.36Å; F216-F344 WeakPolarHBondContact CE1-O 3.3Å; F216-I346 HydrophobicContact CD1-CD1 4Å; F216-I346 HydrophobicContact CD1-CG1 3.97Å; F216-I346 HydrophobicContact CE1-CB 4.26Å; F216-I346 HydrophobicContact CE1-CD1 4.04Å; F216-I346 HydrophobicContact CE1-CG1 3.69Å; F216-I346 HydrophobicContact CE1-CG2 3.96Å; F216-I346 HydrophobicContact CG-CD1 4.43Å; F216-I346 HydrophobicContact CZ-CG1 4.37Å; F216-I346 HydrophobicContact CZ-CG2 3.84Å
217	G	94.3	Very high	96.6	Very high	8 Å²	8	13 Å²	13	8%	0.082	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	62.8	33.2	-157.2	0	0	0	0	0	111.9	D214 V215 S280 N311	D214-G217 WeakPolarHBondContact O-CA 3.33Å; D214-G217 PolarHBondContact O-N 3.39Å; V215-G217 PolarHBondContact O-N 2.78Å; G217-S280 VanDerWaalsContact O-CB 3.23Å; G217-S280 WeakPolarHBondContact O-CB 3.46Å; G217-S280 PolarHBondContact O-OG 3.1Å; G217-N311 VanDerWaalsContact CA-ND2 3.34Å; G217-N311 WeakPolarHBondContact CA-ND2 3.28Å
218	S	98.4	Very high	96.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.091	C	C	.	.			trans	-59.1	164.4	168.2	58.4	0	0	0	0	111.1	V215 N298 W299	V215-S218 WeakPolarHBondContact O-CB 3.37Å; V215-S218 PolarHBondContact O-N 3.39Å; V215-S218 PolarHBondContact O-OG 3.39Å; S218-N298 PolarHBondContact OG-ND2 2.97Å; S218-W299 CarbonylContact C-O 3.58Å; S218-W299 VanDerWaalsContact CB-O 3.27Å; S218-W299 WeakPolarHBondContact CB-O 3.4Å
219	F	98.8	Very high	96.8	Very high	1 Å²	1	14.3 Å²	14.3	0%	0.004	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	158.3	153.7	-62.6	-37.8	0	0	0	109.5	M46 F277 V278 P279 S280 N298 W299 C303 N304	M46-F219 HydrophobicContact CG-CD2 4.34Å; M46-F219 HydrophobicContact CG-CE2 3.61Å; M46-F219 HydrophobicContact CG-CZ 4Å; M46-F219 WeakPolarHBondContact O-CZ 3.2Å; M46-F219 HydrophobicContact SD-CE2 4.44Å; F219-F277 HydrophobicContact CB-CE2 3.87Å; F219-F277 AromaticContact CD1-CE2 3.99Å; F219-F277 HydrophobicContact CD1-CE2 3.99Å; F219-F277 AromaticContact CD1-CZ 3.82Å; F219-F277 HydrophobicContact CD1-CZ 3.82Å; F219-F277 HydrophobicContact CD2-CE2 4.17Å; F219-F277 HydrophobicContact CD2-CZ 4.36Å; F219-F277 AromaticContact CE1-CZ 3.98Å; F219-F277 HydrophobicContact CE1-CZ 3.98Å; F219-F277 AromaticContact CG-CE2 3.76Å; F219-F277 HydrophobicContact CG-CE2 3.76Å; F219-F277 HydrophobicContact CG-CZ 4Å; F219-F277 HydrophobicContact CZ-CZ 4.31Å; F219-V278 WeakPolarHBondContact CA-O 3.37Å; F219-P279 HydrophobicContact CD1-CB 4.41Å; F219-P279 HydrophobicContact CE1-CB 4.37Å; F219-S280 WeakPolarHBondContact CD1-OG 3.22Å; F219-N298 WeakPolarHBondContact O-CA 3.16Å; F219-W299 WeakPolarHBondContact CA-O 3.07Å; F219-W299 HydrophobicContact CB-CD2 4.14Å; F219-W299 HydrophobicContact CB-CG 4.27Å; F219-W299 HydrophobicContact CB-CZ2 4.15Å; F219-W299 WeakPolarHBondContact CB-O 3.43Å; F219-W299 HydrophobicContact CD2-CD2 4.17Å; F219-W299 AromaticContact CD2-CE2 3.86Å; F219-W299 HydrophobicContact CD2-CE3 4.18Å; F219-W299 AromaticContact CD2-CH2 3.69Å; F219-W299 HydrophobicContact CD2-CH2 3.69Å; F219-W299 AromaticContact CD2-CZ2 3.64Å; F219-W299 HydrophobicContact CD2-CZ2 3.64Å; F219-W299 AromaticContact CD2-CZ3 3.95Å; F219-W299 HydrophobicContact CD2-CZ3 3.95Å; F219-W299 HydrophobicContact CE2-CH2 4.18Å; F219-W299 HydrophobicContact CE2-CZ2 4.47Å; F219-W299 HydrophobicContact CE2-CZ3 4.47Å; F219-W299 HydrophobicContact CG-CZ2 4.26Å; F219-W299 PolarHBondContact N-O 3.04Å; F219-W299 PolarHBondContact O-N 3.23Å; F219-C303 HydrophobicContact CE2-CB 4.02Å; F219-C303 HydrophobicContact CZ-CB 3.98Å; F219-N304 HydrophobicContact CD1-CB 4.42Å; F219-N304 VanDerWaalsContact CD1-ND2 3.31Å; F219-N304 WeakPolarHBondContact CD1-ND2 3.41Å; F219-N304 VanDerWaalsContact CD2-ND2 3.35Å; F219-N304 WeakPolarHBondContact CD2-ND2 3.25Å; F219-N304 HydrophobicContact CE1-CB 3.76Å; F219-N304 WeakPolarHBondContact CE1-ND2 3.28Å; F219-N304 HydrophobicContact CE2-CB 3.99Å; F219-N304 VanDerWaalsContact CE2-CG 3.48Å; F219-N304 VanDerWaalsContact CG-ND2 3.26Å; F219-N304 WeakPolarHBondContact CG-ND2 3.38Å; F219-N304 HydrophobicContact CZ-CB 3.52Å; F219-N304 PolarHBondContact N-ND2 2.76Å
220	S	98.7	Very high	96.9	Very high	5 Å²	5	14.9 Å²	14.9	4%	0.035	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.6	167.2	178.4	0	0	0	0	110.2	D214 V278 H297	D214-S220 WeakPolarHBondContact OD2-CB 3.44Å; S220-V278 PolarHBondContact N-O 3.45Å; S220-V278 PolarHBondContact O-N 2.87Å; S220-H297 WeakPolarHBondContact CA-O 3.14Å; S220-H297 PolarHBondContact OG-O 3.43Å
221	W	98.7	Very high	97.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144	161.2	61.5	-97.2	0	0	0	110	W61 Y174 F180 T223 V276 V295 N296 H297 W299	W61-W221 HydrophobicContact CH2-CH2 4.17Å; W61-W221 HydrophobicContact CH2-CZ3 4.05Å; Y174-W221 HydrophobicContact CD2-CH2 4.2Å; Y174-W221 AromaticContact CE2-CH2 3.99Å; Y174-W221 HydrophobicContact CE2-CH2 3.99Å; Y174-W221 HydrophobicContact CE2-CZ2 4.4Å; F180-W221 HydrophobicContact CB-CG 4.25Å; F180-W221 VanDerWaalsContact CB-NE1 3.32Å; F180-W221 HydrophobicContact CD1-CB 4.21Å; F180-W221 AromaticContact CD1-CD1 3.85Å; F180-W221 HydrophobicContact CD1-CG 4.17Å; F180-W221 HydrophobicContact CD2-CB 3.89Å; F180-W221 AromaticContact CD2-CD1 3.41Å; F180-W221 VanDerWaalsContact CD2-CD1 3.41Å; F180-W221 AromaticContact CD2-CD2 3.63Å; F180-W221 HydrophobicContact CD2-CD2 3.63Å; F180-W221 AromaticContact CD2-CE2 3.78Å; F180-W221 HydrophobicContact CD2-CE3 4.42Å; F180-W221 AromaticContact CD2-CG 3.37Å; F180-W221 HydrophobicContact CD2-CG 3.37Å; F180-W221 AromaticContact CD2-NE1 3.62Å; F180-W221 HydrophobicContact CE1-CB 3.99Å; F180-W221 HydrophobicContact CE1-CG 4.38Å; F180-W221 HydrophobicContact CE2-CB 3.67Å; F180-W221 AromaticContact CE2-CD2 3.98Å; F180-W221 HydrophobicContact CE2-CD2 3.98Å; F180-W221 HydrophobicContact CE2-CE3 4.46Å; F180-W221 AromaticContact CE2-CG 3.64Å; F180-W221 HydrophobicContact CE2-CG 3.64Å; F180-W221 HydrophobicContact CG-CB 4.17Å; F180-W221 AromaticContact CG-CD1 3.26Å; F180-W221 HydrophobicContact CG-CD2 4.3Å; F180-W221 AromaticContact CG-CG 3.67Å; F180-W221 HydrophobicContact CG-CG 3.67Å; F180-W221 AromaticContact CG-NE1 3.62Å; F180-W221 HydrophobicContact CZ-CB 3.72Å; F180-W221 HydrophobicContact CZ-CG 4.15Å; W221-T223 WeakPolarHBondContact CZ3-OG1 3.41Å; W221-V276 CarbonylContact C-O 3.53Å; W221-V276 WeakPolarHBondContact CA-O 3.17Å; W221-V295 HydrophobicContact CH2-CG1 3.96Å; W221-V295 HydrophobicContact CZ3-CB 4.38Å; W221-V295 HydrophobicContact CZ3-CG1 4.15Å; W221-V295 VanDerWaalsContact CZ3-O 3.31Å; W221-V295 WeakPolarHBondContact CZ3-O 3.35Å; W221-N296 CarbonylContact O-C 3.59Å; W221-N296 WeakPolarHBondContact O-CA 3.28Å; W221-H297 HydrophobicContact CD2-CB 4.35Å; W221-H297 AromaticContact CE2-CD2 3.83Å; W221-H297 AromaticContact CE2-CG 3.49Å; W221-H297 VanDerWaalsContact CE2-CG 3.49Å; W221-H297 AromaticContact CE2-ND1 3.88Å; W221-H297 AromaticContact CH2-CD2 3.57Å; W221-H297 AromaticContact CH2-NE2 3.77Å; W221-H297 HydrophobicContact CZ2-CB 3.95Å; W221-H297 AromaticContact CZ2-CD2 3.19Å; W221-H297 WeakPolarHBondContact CZ2-CD2 3.32Å; W221-H297 AromaticContact CZ2-CE1 3.59Å; W221-H297 AromaticContact CZ2-CG 3.26Å; W221-H297 AromaticContact CZ2-ND1 3.5Å; W221-H297 AromaticContact CZ2-NE2 3.4Å; W221-H297 WeakPolarHBondContact CZ2-NE2 3.32Å; W221-H297 PolarHBondContact N-O 3.3Å; W221-H297 AromaticContact NE1-CG 3.59Å; W221-H297 AromaticContact NE1-ND1 3.78Å; W221-H297 PolarHBondContact O-N 2.88Å; W221-W299 AromaticContact CD1-CD1 3.72Å; W221-W299 AromaticContact CD1-NE1 3.59Å
222	S	98.7	Very high	97.2	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	111.7	177.1	173.6	0	0	0	0	108.8	K229 Q270 A275 V276 N296	S222-K229 PolarHBondContact OG-NZ 2.94Å; S222-Q270 PolarHBondContact O-NE2 3.48Å; S222-A275 CarbonylContact O-C 3.56Å; S222-A275 VanDerWaalsContact O-CA 3.3Å; S222-A275 WeakPolarHBondContact O-CA 3.49Å; S222-V276 PolarHBondContact N-O 3.33Å; S222-V276 PolarHBondContact O-N 3.11Å; S222-N296 WeakPolarHBondContact CB-ND2 3.49Å; S222-N296 PolarHBondContact OG-ND2 3.29Å
223	T	98.7	Very high	97.3	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.2	172.7	-57.4	0	0	0	0	109.9	V57 W61 W221 I225 E274 A275 S294 V295	V57-T223 HydrophobicContact CB-CG2 4.22Å; V57-T223 HydrophobicContact CG1-CG2 4.01Å; W61-T223 HydrophobicContact CE3-CG2 4.48Å; W61-T223 HydrophobicContact CH2-CG2 3.77Å; W61-T223 HydrophobicContact CZ3-CG2 3.69Å; W221-T223 WeakPolarHBondContact CZ3-OG1 3.41Å; T223-I225 HydrophobicContact CG2-CD1 4.27Å; T223-E274 WeakPolarHBondContact CA-O 3.41Å; T223-A275 WeakPolarHBondContact OG1-CB 3.36Å; T223-S294 VanDerWaalsContact O-CA 3.26Å; T223-S294 WeakPolarHBondContact O-CA 3.38Å; T223-S294 VanDerWaalsContact O-CB 3.23Å; T223-S294 WeakPolarHBondContact O-CB 3.48Å; T223-V295 PolarHBondContact N-O 3.33Å; T223-V295 PolarHBondContact O-N 3.35Å
224	N	97.9	Very high	97.4	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	122.1	-179.2	-161.8	32.5	0	0	0	110.3	V226 G227 Q270 R271 A272 N273 E274 T292 I293	N224-V226 PolarHBondContact OD1-O 3.38Å; N224-G227 PolarHBondContact ND2-O 2.79Å; N224-Q270 HydrophobicContact CB-CG 4Å; N224-Q270 PolarHBondContact ND2-O 2.89Å; N224-R271 WeakPolarHBondContact CB-O 3.48Å; N224-A272 CarbonylContact O-C 3.52Å; N224-N273 PolarHBondContact O-N 2.87Å; N224-E274 PolarHBondContact N-O 2.91Å; N224-T292 VanDerWaalsContact OD1-CG2 3.27Å; N224-T292 WeakPolarHBondContact OD1-CG2 3.03Å; N224-I293 PolarHBondContact OD1-O 2.98Å
225	I	97.5	Very high	97.4	Very high	3 Å²	3	8.8 Å²	8.8	2%	0.015	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-40.7	-178.3	-53.1	-51.3	0	0	0	110.3	W61 T67 T223 I293 V295	W61-I225 HydrophobicContact CE3-CD1 3.76Å; W61-I225 HydrophobicContact CZ3-CD1 3.93Å; T67-I225 HydrophobicContact CG2-CG2 4.36Å; T223-I225 HydrophobicContact CG2-CD1 4.27Å; I225-I293 WeakPolarHBondContact CB-O 3.38Å; I225-I293 PolarHBondContact N-O 2.75Å; I225-V295 HydrophobicContact CD1-CG2 4.35Å; I225-V295 HydrophobicContact CG1-CG2 4.29Å
226	V	95.9	Very high	97.6	Very high	3 Å²	3	9.3 Å²	9.3	2%	0.018	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	151.1	-178.9	64.9	0	0	0	0	110.1	T67 S85 I87 N224 T292 I293	T67-V226 HydrophobicContact CG2-CB 3.62Å; T67-V226 HydrophobicContact CG2-CG1 4.31Å; T67-V226 HydrophobicContact CG2-CG2 3.87Å; S85-V226 WeakPolarHBondContact O-CG2 3.49Å; I87-V226 HydrophobicContact CD1-CB 4.41Å; I87-V226 HydrophobicContact CD1-CG1 3.35Å; I87-V226 HydrophobicContact CD1-CG2 4.21Å; N224-V226 PolarHBondContact OD1-O 3.38Å; V226-T292 VanDerWaalsContact O-CA 3.32Å; V226-T292 WeakPolarHBondContact O-CA 3.33Å; V226-I293 HydrophobicContact CG1-CB 3.75Å; V226-I293 HydrophobicContact CG1-CD1 4.26Å; V226-I293 HydrophobicContact CG1-CG1 3.85Å; V226-I293 PolarHBondContact N-O 2.91Å; V226-I293 PolarHBondContact O-N 3.17Å
227	G	95.4	Very high	97.6	Very high	20 Å²	20	10.7 Å²	10.7	21%	0.206	7%	0.074	C	C	.	.	S	Bend	trans	89	-166.4	178.5	0	0	0	0	0	114.2	N224 A272 T290 D291	N224-G227 PolarHBondContact ND2-O 2.79Å; G227-A272 PolarHBondContact O-N 3.28Å; G227-T290 WeakPolarHBondContact CA-OG1 3.46Å; G227-D291 VanDerWaalsContact CA-O 3.32Å; G227-D291 WeakPolarHBondContact CA-O 3.47Å
228	L	96.4	Very high	97.8	Very high	47 Å²	47	12 Å²	12	25%	0.246	8%	0.078	C	C	.	.			trans	-133	124.7	-177.1	-177.7	69.4	0	0	0	109.5	N269 R271 L289 T290	L228-N269 HydrophobicContact CD1-CB 4.39Å; L228-R271 HydrophobicContact CD1-CG 4.13Å; L228-L289 HydrophobicContact CB-CB 4.29Å; L228-L289 HydrophobicContact CD2-CB 4.13Å; L228-L289 HydrophobicContact CD2-CD1 3.69Å; L228-L289 HydrophobicContact CD2-CG 4.47Å; L228-L289 HydrophobicContact CG-CB 4.23Å; L228-L289 HydrophobicContact CG-CD1 4.05Å; L228-L289 WeakPolarHBondContact O-CB 3.06Å; L228-L289 PolarHBondContact O-N 2.71Å; L228-T290 HydrophobicContact CB-CG2 4.33Å; L228-T290 PolarHBondContact N-OG1 3.47Å
229	K	97.9	Very high	97.7	Very high	3 Å²	3	13.2 Å²	13.2	1%	0.013	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.4	173.8	-62.3	-174.4	174	-170.1	0	111	S222 W231 N269 Q270 V286 W287 N288 T292 S294	S222-K229 PolarHBondContact OG-NZ 2.94Å; K229-W231 HydrophobicContact CD-CZ2 4.38Å; K229-N269 CarbonylContact O-C 3.55Å; K229-N269 WeakPolarHBondContact O-CA 3.21Å; K229-Q270 HydrophobicContact CB-CB 4.23Å; K229-Q270 PolarHBondContact N-O 3.35Å; K229-Q270 PolarHBondContact O-N 3.21Å; K229-V286 HydrophobicContact CB-CG1 4.01Å; K229-V286 HydrophobicContact CD-CG1 3.98Å; K229-V286 HydrophobicContact CG-CG1 4.37Å; K229-W287 CarbonylContact C-O 3.57Å; K229-W287 VanDerWaalsContact CA-O 3.32Å; K229-W287 WeakPolarHBondContact CA-O 3.37Å; K229-N288 WeakPolarHBondContact CG-OD1 3.24Å; K229-T292 HydrophobicContact CD-CG2 4.17Å; K229-T292 HydrophobicContact CG-CG2 3.84Å; K229-S294 VanDerWaalsContact NZ-CB 3.25Å; K229-S294 PolarHBondContact NZ-OG 2.64Å
230	K	98.3	Very high	97.6	Very high	26 Å²	26	18.2 Å²	18.2	11%	0.113	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	124.9	168	-178.8	-179.4	-179.9	-178.2	0	109.1	N146 E255 T267 I268 V286 W287 L289	N146-K230 PolarHBondContact ND2-NZ 3.38Å; K230-E255 WeakPolarHBondContact CE-OE1 3.16Å; K230-E255 IonicContact NZ-OE1 3.87Å; K230-E255 PolarHBondContact NZ-OE1 3.11Å; K230-E255 IonicContact NZ-OE2 2.87Å; K230-T267 HydrophobicContact CG-CG2 4.22Å; K230-I268 CarbonylContact C-O 3.5Å; K230-I268 VanDerWaalsContact CA-O 3.28Å; K230-I268 WeakPolarHBondContact CA-O 3.45Å; K230-V286 CarbonylContact O-C 3.55Å; K230-V286 WeakPolarHBondContact O-CA 3.45Å; K230-W287 HydrophobicContact CB-CB 4.4Å; K230-W287 PolarHBondContact N-O 3.21Å; K230-W287 PolarHBondContact O-N 2.89Å; K230-L289 HydrophobicContact CB-CD1 3.87Å; K230-L289 HydrophobicContact CB-CD2 3.9Å; K230-L289 HydrophobicContact CB-CG 3.84Å; K230-L289 HydrophobicContact CD-CD2 4.36Å
231	W	98.6	Very high	97.6	Very high	6 Å²	6	22 Å²	22	2%	0.023	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.6	174.5	-54.5	65.3	0	0	0	108.8	K229 T267 I268 V276 V278 H284 Q285 V286	K229-W231 HydrophobicContact CD-CZ2 4.38Å; W231-T267 CarbonylContact O-C 3.46Å; W231-T267 VanDerWaalsContact O-CA 3.29Å; W231-T267 WeakPolarHBondContact O-CA 3.37Å; W231-I268 HydrophobicContact CB-CB 3.92Å; W231-I268 HydrophobicContact CB-CD1 4.39Å; W231-I268 HydrophobicContact CB-CG1 4.39Å; W231-I268 HydrophobicContact CG-CB 4.14Å; W231-I268 PolarHBondContact N-O 2.8Å; W231-I268 PolarHBondContact O-N 2.89Å; W231-V276 HydrophobicContact CZ2-CB 4.43Å; W231-V276 HydrophobicContact CZ2-CG2 4.45Å; W231-V278 HydrophobicContact CH2-CG2 4.39Å; W231-V278 HydrophobicContact CZ3-CG2 3.87Å; W231-H284 AromaticContact CE3-CD2 3.91Å; W231-H284 AromaticContact CZ3-CD2 3.68Å; W231-H284 AromaticContact CZ3-NE2 3.93Å; W231-Q285 WeakPolarHBondContact CA-O 3.41Å; W231-V286 HydrophobicContact CD2-CB 4.42Å; W231-V286 HydrophobicContact CD2-CG1 4Å; W231-V286 HydrophobicContact CD2-CG2 3.6Å; W231-V286 HydrophobicContact CE3-CG2 3.28Å; W231-V286 HydrophobicContact CG-CG1 4.29Å; W231-V286 HydrophobicContact CG-CG2 4.33Å; W231-V286 HydrophobicContact CH2-CG2 3.81Å; W231-V286 HydrophobicContact CZ2-CG1 4.11Å; W231-V286 HydrophobicContact CZ2-CG2 4.11Å; W231-V286 HydrophobicContact CZ3-CG2 3.4Å
232	L	98.6	Very high	97.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117	155.6	-59.5	-179.9	0	0	0	105.8	I253 E255 L258 Y265 T267 H284 Q285	L232-I253 HydrophobicContact CB-CD1 4.01Å; L232-I253 HydrophobicContact CD1-CD1 4.33Å; L232-I253 HydrophobicContact CD1-CG1 4.39Å; L232-E255 HydrophobicContact CD1-CG 4.4Å; L232-E255 HydrophobicContact CD2-CG 3.87Å; L232-L258 HydrophobicContact CB-CD1 4.4Å; L232-L258 HydrophobicContact CD1-CD1 4.2Å; L232-Y265 HydrophobicContact CD2-CD2 4.21Å; L232-Y265 HydrophobicContact CD2-CE2 4.25Å; L232-T267 HydrophobicContact CD2-CG2 4.41Å; L232-H284 CarbonylContact O-C 3.59Å; L232-H284 WeakPolarHBondContact O-CA 3.39Å; L232-H284 VanDerWaalsContact O-CB 3.28Å; L232-H284 WeakPolarHBondContact O-CB 3.31Å; L232-Q285 PolarHBondContact N-O 3.04Å; L232-Q285 PolarHBondContact O-N 2.78Å
233	I	98.6	Very high	97.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	138.7	-174	-178.7	162.6	0	0	0	109.8	I30 Y265 Y266 I268 V278 W282 F283 H284	I30-I233 HydrophobicContact CD1-CG2 3.72Å; I233-Y265 CarbonylContact O-C 3.53Å; I233-Y265 WeakPolarHBondContact O-CA 3.47Å; I233-Y266 PolarHBondContact N-O 2.89Å; I233-Y266 PolarHBondContact O-N 3.31Å; I233-I268 HydrophobicContact CG2-CD1 3.98Å; I233-I268 HydrophobicContact CG2-CG1 4.25Å; I233-V278 HydrophobicContact CD1-CG1 4.02Å; I233-V278 HydrophobicContact CD1-CG2 4.35Å; I233-W282 HydrophobicContact CD1-CB 4.09Å; I233-W282 HydrophobicContact CD1-CE3 4.32Å; I233-W282 HydrophobicContact CG1-CB 4.15Å; I233-W282 HydrophobicContact CG1-CE3 3.84Å; I233-F283 WeakPolarHBondContact CA-O 3.42Å; I233-H284 HydrophobicContact CB-CB 3.83Å; I233-H284 HydrophobicContact CD1-CB 4.28Å; I233-H284 HydrophobicContact CG1-CB 3.92Å
234	M	98.1	Very high	97.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.164	C	C	.	.			trans	-134.5	148.1	-174.7	65.4	-163.3	73.2	0	0	113.3	Y211 E238 L242 I253 L258 V263 R264 W282 F283	Y211-M234 HydrophobicContact CE2-CE 3.56Å; Y211-M234 HydrophobicContact CE2-SD 4.15Å; Y211-M234 PolarHBondContact OH-SD 3.41Å; M234-E238 HydrophobicContact CB-CB 4.02Å; M234-E238 HydrophobicContact CG-CB 4.03Å; M234-E238 HydrophobicContact SD-CB 4.13Å; M234-L242 HydrophobicContact CE-CD1 4.32Å; M234-L242 HydrophobicContact SD-CD1 4.33Å; M234-I253 HydrophobicContact CE-CD1 3.82Å; M234-L258 HydrophobicContact CE-CD1 4.41Å; M234-L258 HydrophobicContact CE-CD2 3.8Å; M234-V263 HydrophobicContact CB-CG1 4.42Å; M234-V263 HydrophobicContact CE-CG1 4.11Å; M234-V263 HydrophobicContact SD-CG1 3.68Å; M234-R264 VanDerWaalsContact CB-O 3.31Å; M234-R264 WeakPolarHBondContact CB-O 3.36Å; M234-W282 WeakPolarHBondContact O-CA 3.48Å; M234-F283 HydrophobicContact CG-CB 4.13Å; M234-F283 PolarHBondContact N-O 3.47Å
235	P	97.5	Very high	96.7	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.039	21%	0.21	C	C	.	.			trans	-57.5	149.5	174.7	-21.4	30.6	0	0	0	112.6	L26 G237 E238 R264 Y266 W282	L26-P235 HydrophobicContact CD1-CB 3.81Å; L26-P235 HydrophobicContact CD1-CG 3.55Å; L26-P235 HydrophobicContact CD2-CB 4.03Å; L26-P235 HydrophobicContact CD2-CG 3.92Å; L26-P235 HydrophobicContact CG-CG 4.37Å; P235-G237 PolarHBondContact O-N 3.21Å; P235-E238 HydrophobicContact CB-CG 4.4Å; P235-E238 HydrophobicContact CG-CG 4.49Å; P235-E238 VanDerWaalsContact O-CB 3.3Å; P235-E238 WeakPolarHBondContact O-CB 3.5Å; P235-E238 PolarHBondContact O-N 2.73Å; P235-R264 WeakPolarHBondContact CD-O 3.25Å; P235-Y266 HydrophobicContact CG-CE2 4.02Å; P235-W282 HydrophobicContact CB-CH2 4.09Å; P235-W282 HydrophobicContact CB-CZ2 4.3Å; P235-W282 HydrophobicContact CB-CZ3 4.24Å; P235-W282 HydrophobicContact CG-CH2 3.79Å; P235-W282 HydrophobicContact CG-CZ2 4.47Å; P235-W282 HydrophobicContact CG-CZ3 3.81Å
236	P	96.8	Very high	96.4	Very high	63 Å²	63	48.2 Å²	48.2	41%	0.409	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	137.6	173.5	-22.5	30	0	0	0	112.6
237	G	96.2	Very high	96.1	Very high	34 Å²	34	50.1 Å²	50.1	35%	0.351	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	-22.2	-175.9	0	0	0	0	0	114	P235 E239 L240	P235-G237 PolarHBondContact O-N 3.21Å; G237-E239 VanDerWaalsContact C-N 3.33Å; G237-E239 WeakPolarHBondContact CA-OE2 3.33Å; G237-E239 PolarHBondContact N-OE1 3.09Å; G237-E239 PolarHBondContact N-OE2 2.77Å; G237-L240 WeakPolarHBondContact O-CB 3.44Å; G237-L240 PolarHBondContact O-N 2.68Å
238	E	97.8	Very high	95.9	Very high	36 Å²	36	53 Å²	53	17%	0.168	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-72	-29.3	176.7	-72.6	-66.7	136.7	0	0	112.2	M234 P235 L240 K241 V263 R264	M234-E238 HydrophobicContact CB-CB 4.02Å; M234-E238 HydrophobicContact CG-CB 4.03Å; M234-E238 HydrophobicContact SD-CB 4.13Å; P235-E238 HydrophobicContact CB-CG 4.4Å; P235-E238 HydrophobicContact CG-CG 4.49Å; P235-E238 VanDerWaalsContact O-CB 3.3Å; P235-E238 WeakPolarHBondContact O-CB 3.5Å; P235-E238 PolarHBondContact O-N 2.73Å; E238-L240 PolarHBondContact O-N 3.5Å; E238-K241 WeakPolarHBondContact O-CB 2.97Å; E238-K241 PolarHBondContact O-N 3.01Å; E238-K241 IonicContact OE1-NZ 3.28Å; E238-K241 PolarHBondContact OE1-NZ 2.63Å; E238-K241 WeakPolarHBondContact OE2-CD 3.37Å; E238-K241 WeakPolarHBondContact OE2-CE 3.22Å; E238-K241 IonicContact OE2-NZ 3.45Å; E238-K241 PolarHBondContact OE2-NZ 3.48Å; E238-V263 HydrophobicContact CB-CG1 4.17Å; E238-V263 WeakPolarHBondContact OE2-CA 3.37Å; E238-R264 HydrophobicContact CG-CB 4.23Å; E238-R264 PolarHBondContact OE2-N 3.05Å
239	E	97.3	Very high	95.8	Very high	24 Å²	24	53.3 Å²	53.3	11%	0.112	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-58.9	-30	175.3	73.6	-74.1	170.2	0	0	112.7	Y211 G237 K241 L242 L249 F283	Y211-E239 WeakPolarHBondContact OH-CA 3.03Å; Y211-E239 WeakPolarHBondContact OH-CB 3.48Å; G237-E239 VanDerWaalsContact C-N 3.33Å; G237-E239 WeakPolarHBondContact CA-OE2 3.33Å; G237-E239 PolarHBondContact N-OE1 3.09Å; G237-E239 PolarHBondContact N-OE2 2.77Å; E239-K241 PolarHBondContact O-N 2.77Å; E239-L242 WeakPolarHBondContact O-CB 3.16Å; E239-L242 PolarHBondContact O-N 2.85Å; E239-L249 HydrophobicContact CB-CD2 4.07Å; E239-L249 HydrophobicContact CG-CD2 4.33Å; E239-L249 WeakPolarHBondContact O-CD2 3.27Å; E239-F283 HydrophobicContact CB-CB 4.1Å; E239-F283 HydrophobicContact CB-CD1 4.26Å; E239-F283 HydrophobicContact CB-CD2 3.69Å; E239-F283 HydrophobicContact CB-CE2 4.18Å; E239-F283 HydrophobicContact CB-CG 3.75Å; E239-F283 HydrophobicContact CG-CD2 3.53Å; E239-F283 HydrophobicContact CG-CE2 3.57Å; E239-F283 HydrophobicContact CG-CG 4.09Å; E239-F283 HydrophobicContact CG-CZ 4.14Å
240	L	97	Very high	95.7	Very high	106 Å²	106	54.5 Å²	54.5	56%	0.555	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-65.4	-22.9	-176.8	-58.7	177.6	0	0	0	112.2	G237 E238 L242 N243	G237-L240 WeakPolarHBondContact O-CB 3.44Å; G237-L240 PolarHBondContact O-N 2.68Å; E238-L240 PolarHBondContact O-N 3.5Å; L240-L242 PolarHBondContact O-N 2.78Å; L240-N243 PolarHBondContact O-N 3.17Å
241	K	98	Very high	95.4	Very high	85 Å²	85	55.3 Å²	55.3	37%	0.37	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-70.1	-17.5	175.4	-62.1	175.7	179.5	172.5	0	112.7	E238 E239 H261 N262 V263	E238-K241 WeakPolarHBondContact O-CB 2.97Å; E238-K241 PolarHBondContact O-N 3.01Å; E238-K241 IonicContact OE1-NZ 3.28Å; E238-K241 PolarHBondContact OE1-NZ 2.63Å; E238-K241 WeakPolarHBondContact OE2-CD 3.37Å; E238-K241 WeakPolarHBondContact OE2-CE 3.22Å; E238-K241 IonicContact OE2-NZ 3.45Å; E238-K241 PolarHBondContact OE2-NZ 3.48Å; E239-K241 PolarHBondContact O-N 2.77Å; K241-H261 PolarHBondContact O-CD2 3.14Å; K241-N262 PolarHBondContact NZ-O 2.93Å; K241-V263 HydrophobicContact CB-CG2 3.92Å; K241-V263 HydrophobicContact CD-CG2 4.11Å
242	L	97.5	Very high	95.2	Very high	14 Å²	14	55.9 Å²	55.9	7%	0.073	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-98.6	-2.3	-178.9	-60.2	175.1	0	0	0	113.1	Y211 M234 E239 L240 D244 P250 I253 M257 L258 H261 V263	Y211-L242 HydrophobicContact CE1-CD1 4.04Å; M234-L242 HydrophobicContact CE-CD1 4.32Å; M234-L242 HydrophobicContact SD-CD1 4.33Å; E239-L242 WeakPolarHBondContact O-CB 3.16Å; E239-L242 PolarHBondContact O-N 2.85Å; L240-L242 PolarHBondContact O-N 2.78Å; L242-D244 PolarHBondContact O-N 3.12Å; L242-P250 HydrophobicContact CB-CG 4.09Å; L242-P250 HydrophobicContact CD1-CG 4.42Å; L242-I253 HydrophobicContact CD1-CG2 4.05Å; L242-M257 HydrophobicContact CD2-CG 4.06Å; L242-M257 HydrophobicContact CD2-SD 4.36Å; L242-L258 HydrophobicContact CD1-CD2 3.75Å; L242-L258 HydrophobicContact CD2-CD2 4.3Å; L242-H261 HydrophobicContact CD2-CB 3.9Å; L242-V263 HydrophobicContact CD1-CG2 4.43Å; L242-V263 HydrophobicContact CD2-CG2 3.85Å; L242-V263 HydrophobicContact CG-CG2 3.96Å
243	N	94.8	Very high	95.1	Very high	59 Å²	59	56 Å²	56	32%	0.316	30%	0.296	S	S	.	.			trans	-60	134.7	178.6	-80.4	-18.8	0	0	0	111.5	L240 G247 N248 L249	L240-N243 PolarHBondContact O-N 3.17Å; N243-G247 PolarHBondContact OD1-O 2.91Å; N243-N248 WeakPolarHBondContact CA-O 3.41Å; N243-L249 WeakPolarHBondContact OD1-CD2 3.44Å
244	D	92.8	Very high	95	Very high	78 Å²	78	57.6 Å²	57.6	42%	0.417	30%	0.304	S	S	.	.			trans	-70.4	-178.9	165.4	78.4	7.4	0	0	0	111.3	L242 L246 G247 N248	L242-D244 PolarHBondContact O-N 3.12Å; D244-L246 PolarHBondContact O-N 3.03Å; D244-L246 VanDerWaalsContact O-N 3.14Å; D244-L246 VanDerWaalsContact OD1-CA 3.29Å; D244-L246 WeakPolarHBondContact OD1-CA 3.43Å; D244-L246 WeakPolarHBondContact OD1-CB 3.3Å; D244-L246 PolarHBondContact OD1-N 3.48Å; D244-G247 PolarHBondContact O-N 3.22Å; D244-G247 PolarHBondContact OD1-N 3.3Å; D244-N248 PolarHBondContact N-O 3.22Å; D244-N248 PolarHBondContact OD1-N 2.95Å; D244-N248 PolarHBondContact OD1-ND2 3.47Å; D244-N248 WeakPolarHBondContact OD2-CB 3.39Å; D244-N248 PolarHBondContact OD2-ND2 3.41Å
245	R	90.2	Very high	94.9	Very high	255 Å²	255	59.8 Å²	59.8	96%	0.962	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.8	-179.5	-64.3	-177.4	-178.7	179.6	0.8	114.2
246	L	90.3	Very high	94.9	Very high	147 Å²	147	66.1 Å²	66.1	77%	0.77	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-1.2	178.8	-59.9	177.4	0	0	0	111.7	D244 N248	D244-L246 PolarHBondContact O-N 3.03Å; D244-L246 VanDerWaalsContact O-N 3.14Å; D244-L246 VanDerWaalsContact OD1-CA 3.29Å; D244-L246 WeakPolarHBondContact OD1-CA 3.43Å; D244-L246 WeakPolarHBondContact OD1-CB 3.3Å; D244-L246 PolarHBondContact OD1-N 3.48Å; L246-N248 WeakPolarHBondContact CB-ND2 3.49Å
247	G	89.7	Confident	95	Very high	44 Å²	44	65.9 Å²	65.9	45%	0.454	34%	0.336	S	S	.	.	S	Bend	trans	83.4	14	-177.7	0	0	0	0	0	114.1	N243 D244	N243-G247 PolarHBondContact OD1-O 2.91Å; D244-G247 PolarHBondContact O-N 3.22Å; D244-G247 PolarHBondContact OD1-N 3.3Å
248	N	91.7	Very high	95.1	Very high	80 Å²	80	64.3 Å²	64.3	43%	0.428	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-83.8	141.4	175.5	-52.2	-63.1	0	0	0	110.7	N243 D244 L246	N243-N248 WeakPolarHBondContact CA-O 3.41Å; D244-N248 PolarHBondContact N-O 3.22Å; D244-N248 PolarHBondContact OD1-N 2.95Å; D244-N248 PolarHBondContact OD1-ND2 3.47Å; D244-N248 WeakPolarHBondContact OD2-CB 3.39Å; D244-N248 PolarHBondContact OD2-ND2 3.41Å; L246-N248 WeakPolarHBondContact CB-ND2 3.49Å
249	L	94.2	Very high	95.1	Very high	53 Å²	53	67.3 Å²	67.3	28%	0.277	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-80.7	150.3	170.9	-64.9	170.5	0	0	0	110.9	Y211 E239 N243 F283	Y211-L249 HydrophobicContact CD1-CB 4.28Å; Y211-L249 HydrophobicContact CE1-CB 4.24Å; Y211-L249 HydrophobicContact CE1-CD1 4.43Å; Y211-L249 HydrophobicContact CE1-CD2 4.12Å; E239-L249 HydrophobicContact CB-CD2 4.07Å; E239-L249 HydrophobicContact CG-CD2 4.33Å; E239-L249 WeakPolarHBondContact O-CD2 3.27Å; N243-L249 WeakPolarHBondContact OD1-CD2 3.44Å; L249-F283 HydrophobicContact CD1-CD1 3.93Å; L249-F283 HydrophobicContact CD1-CE1 3.21Å; L249-F283 HydrophobicContact CD1-CZ 3.69Å
250	P	94.8	Very high	95.1	Very high	28 Å²	28	72.6 Å²	72.6	18%	0.182	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-65.9	148.5	175.9	28.8	-35.6	0	0	0	111.2	Y211 L242 I253 M257	Y211-P250 HydrophobicContact CD1-CG 3.95Å; Y211-P250 WeakPolarHBondContact CD1-O 3.35Å; Y211-P250 HydrophobicContact CE1-CG 4.29Å; L242-P250 HydrophobicContact CB-CG 4.09Å; L242-P250 HydrophobicContact CD1-CG 4.42Å; P250-I253 HydrophobicContact CB-CG2 4.39Å; P250-I253 HydrophobicContact CG-CG2 3.65Å; P250-M257 HydrophobicContact CB-SD 4.36Å; P250-M257 HydrophobicContact CG-SD 4.27Å
251	F	92.4	Very high	95.1	Very high	43 Å²	43	71.7 Å²	71.7	19%	0.189	35%	0.354	C	S	.	.	S	Bend	trans	-71	-35.6	176.2	177.1	-120	0	0	0	113	N112 H114 W208 S210 Y211	N112-F251 HydrophobicContact CB-CD2 4.32Å; N112-F251 WeakPolarHBondContact O-CD2 3.19Å; N112-F251 WeakPolarHBondContact O-CE2 3.31Å; H114-F251 AromaticContact CD2-CZ 3.72Å; H114-F251 AromaticContact NE2-CZ 3.68Å; W208-F251 AromaticContact CH2-CD1 3.67Å; W208-F251 HydrophobicContact CH2-CD1 3.67Å; W208-F251 AromaticContact CH2-CE1 3.22Å; W208-F251 HydrophobicContact CH2-CE1 3.22Å; W208-F251 HydrophobicContact CH2-CG 4.49Å; W208-F251 AromaticContact CH2-CZ 3.7Å; W208-F251 HydrophobicContact CH2-CZ 3.7Å; W208-F251 HydrophobicContact CZ2-CD1 4.47Å; W208-F251 AromaticContact CZ2-CE1 3.72Å; W208-F251 HydrophobicContact CZ2-CE1 3.72Å; W208-F251 HydrophobicContact CZ2-CZ 4.23Å; W208-F251 HydrophobicContact CZ3-CE1 4.25Å; W208-F251 HydrophobicContact CZ3-CZ 4.42Å; S210-F251 WeakPolarHBondContact CA-O 3.45Å; Y211-F251 PolarHBondContact N-O 2.94Å
252	S	94.6	Very high	95.1	Very high	18 Å²	18	73.9 Å²	73.9	13%	0.126	37%	0.37	C	S	.	.			trans	-136	142.7	-179.4	-172.6	0	0	0	0	109.3	N148 Q285	N148-S252 PolarHBondContact OD1-OG 2.98Å; S252-Q285 PolarHBondContact OG-NE2 2.84Å; S252-Q285 VanDerWaalsContact OG-NE2 3.12Å
253	I	96.1	Very high	95.1	Very high	2 Å²	2	73.7 Å²	73.7	1%	0.01	37%	0.369	C	S	.	.			trans	-125.5	152.8	177.2	58.4	161.5	0	0	0	110	Y211 L232 M234 L242 P250 M257 L258 Q285	Y211-I253 HydrophobicContact CD1-CG2 4.04Å; Y211-I253 HydrophobicContact CD2-CD1 3.49Å; Y211-I253 VanDerWaalsContact CD2-CD1 3.49Å; Y211-I253 HydrophobicContact CD2-CG1 3.92Å; Y211-I253 HydrophobicContact CD2-CG2 4.17Å; Y211-I253 HydrophobicContact CE1-CG2 4.47Å; Y211-I253 HydrophobicContact CE2-CD1 3.75Å; Y211-I253 HydrophobicContact CG-CD1 4.25Å; Y211-I253 HydrophobicContact CG-CG1 4.23Å; Y211-I253 HydrophobicContact CG-CG2 3.87Å; L232-I253 HydrophobicContact CB-CD1 4.01Å; L232-I253 HydrophobicContact CD1-CD1 4.33Å; L232-I253 HydrophobicContact CD1-CG1 4.39Å; M234-I253 HydrophobicContact CE-CD1 3.82Å; L242-I253 HydrophobicContact CD1-CG2 4.05Å; P250-I253 HydrophobicContact CB-CG2 4.39Å; P250-I253 HydrophobicContact CG-CG2 3.65Å; I253-M257 HydrophobicContact CB-SD 4.48Å; I253-M257 HydrophobicContact CG2-SD 4.02Å; I253-L258 HydrophobicContact CB-CD2 4.33Å; I253-L258 HydrophobicContact CD1-CD1 4.25Å; I253-L258 HydrophobicContact CD1-CD2 4.11Å; I253-Q285 HydrophobicContact CD1-CB 4.09Å; I253-Q285 HydrophobicContact CG1-CB 3.8Å; I253-Q285 HydrophobicContact CG1-CG 4.4Å; I253-Q285 PolarHBondContact O-OE1 3.31Å
254	D	96.4	Very high	95.3	Very high	35 Å²	35	75.7 Å²	75.7	19%	0.187	37%	0.372	C	S	.	.			trans	-139.1	164.3	169.4	60.9	38.9	0	0	0	109.6	N148 K256 M257 L258	N148-D254 PolarHBondContact ND2-OD2 3.09Å; D254-K256 PolarHBondContact O-N 3.43Å; D254-K256 WeakPolarHBondContact OD1-CB 3.43Å; D254-K256 PolarHBondContact OD1-N 3.35Å; D254-M257 PolarHBondContact O-N 2.94Å; D254-M257 VanDerWaalsContact O-N 3.14Å; D254-M257 PolarHBondContact OD1-N 3.1Å; D254-L258 WeakPolarHBondContact O-CG 3.26Å; D254-L258 PolarHBondContact O-N 3.33Å; D254-L258 VanDerWaalsContact O-N 3.09Å
255	E	97.5	Very high	95.5	Very high	45 Å²	45	74.4 Å²	74.4	21%	0.21	36%	0.362	C	S	.	.	H	α-helix	trans	-58.2	-33.9	-177.1	-67.8	99	135.1	0	0	113.2	N146 K230 L232 L258 D259 Y265	N146-E255 PolarHBondContact ND2-OE2 2.81Å; K230-E255 WeakPolarHBondContact CE-OE1 3.16Å; K230-E255 IonicContact NZ-OE1 3.87Å; K230-E255 PolarHBondContact NZ-OE1 3.11Å; K230-E255 IonicContact NZ-OE2 2.87Å; L232-E255 HydrophobicContact CD1-CG 4.4Å; L232-E255 HydrophobicContact CD2-CG 3.87Å; E255-L258 PolarHBondContact O-N 3.36Å; E255-D259 WeakPolarHBondContact O-CB 3.47Å; E255-D259 PolarHBondContact O-N 2.97Å; E255-Y265 HydrophobicContact CG-CE2 3.85Å
256	K	97.7	Very high	95.9	Very high	140 Å²	140	63.1 Å²	63.1	61%	0.609	32%	0.319	S	S	*	.	H	α-helix	trans	-62.2	-47.6	177.6	179.8	-173.9	169.2	-171.7	0	110.7	D254 L258 D259 E260	D254-K256 PolarHBondContact O-N 3.43Å; D254-K256 WeakPolarHBondContact OD1-CB 3.43Å; D254-K256 PolarHBondContact OD1-N 3.35Å; K256-L258 VanDerWaalsContact C-N 3.32Å; K256-L258 PolarHBondContact O-N 3Å; K256-D259 PolarHBondContact O-N 2.87Å; K256-E260 WeakPolarHBondContact CE-OE1 3.43Å; K256-E260 IonicContact NZ-OE1 2.68Å; K256-E260 WeakPolarHBondContact O-CB 3.01Å; K256-E260 VanDerWaalsContact O-CG 3.28Å; K256-E260 WeakPolarHBondContact O-CG 3.31Å; K256-E260 PolarHBondContact O-N 2.82Å
257	M	97.3	Very high	96.3	Very high	58 Å²	58	59.1 Å²	59.1	29%	0.286	30%	0.301	S	S	.	.	H	α-helix	trans	-59.6	-44.3	175.3	172.7	179.6	-95.3	0	0	111.1	L242 P250 I253 D254 E260 H261	L242-M257 HydrophobicContact CD2-CG 4.06Å; L242-M257 HydrophobicContact CD2-SD 4.36Å; P250-M257 HydrophobicContact CB-SD 4.36Å; P250-M257 HydrophobicContact CG-SD 4.27Å; I253-M257 HydrophobicContact CB-SD 4.48Å; I253-M257 HydrophobicContact CG2-SD 4.02Å; D254-M257 PolarHBondContact O-N 2.94Å; D254-M257 VanDerWaalsContact O-N 3.14Å; D254-M257 PolarHBondContact OD1-N 3.1Å; M257-E260 PolarHBondContact O-N 3.16Å; M257-H261 PolarHBondContact O-N 2.79Å; M257-H261 VanDerWaalsContact O-N 3.11Å; M257-H261 PolarHBondContact O-ND1 2.9Å
258	L	98.2	Very high	96.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-45.2	-179.6	-60.2	-178.2	0	0	0	111.7	L232 M234 L242 I253 D254 E255 K256 H261 N262 V263 Y265	L232-L258 HydrophobicContact CB-CD1 4.4Å; L232-L258 HydrophobicContact CD1-CD1 4.2Å; M234-L258 HydrophobicContact CE-CD1 4.41Å; M234-L258 HydrophobicContact CE-CD2 3.8Å; L242-L258 HydrophobicContact CD1-CD2 3.75Å; L242-L258 HydrophobicContact CD2-CD2 4.3Å; I253-L258 HydrophobicContact CB-CD2 4.33Å; I253-L258 HydrophobicContact CD1-CD1 4.25Å; I253-L258 HydrophobicContact CD1-CD2 4.11Å; D254-L258 WeakPolarHBondContact O-CG 3.26Å; D254-L258 PolarHBondContact O-N 3.33Å; D254-L258 VanDerWaalsContact O-N 3.09Å; E255-L258 PolarHBondContact O-N 3.36Å; K256-L258 VanDerWaalsContact C-N 3.32Å; K256-L258 PolarHBondContact O-N 3Å; L258-H261 CarbonylContact O-C 3.51Å; L258-H261 PolarHBondContact O-N 2.94Å; L258-N262 PolarHBondContact O-N 3.41Å; L258-N262 VanDerWaalsContact O-N 3.09Å; L258-V263 HydrophobicContact CB-CB 4.13Å; L258-V263 HydrophobicContact CD2-CB 4.15Å; L258-V263 HydrophobicContact CD2-CG1 4Å; L258-V263 HydrophobicContact CD2-CG2 4.35Å; L258-V263 PolarHBondContact O-N 2.95Å; L258-Y265 HydrophobicContact CB-CD1 3.64Å; L258-Y265 HydrophobicContact CB-CE1 3.61Å; L258-Y265 HydrophobicContact CB-CG 4.39Å; L258-Y265 HydrophobicContact CD1-CD1 3.61Å; L258-Y265 HydrophobicContact CD1-CD2 3.73Å; L258-Y265 HydrophobicContact CD1-CE1 4.02Å; L258-Y265 HydrophobicContact CD1-CE2 4.13Å; L258-Y265 HydrophobicContact CD1-CG 3.46Å; L258-Y265 VanDerWaalsContact CD1-CG 3.46Å; L258-Y265 HydrophobicContact CG-CD1 4.24Å; L258-Y265 HydrophobicContact CG-CE1 4.48Å
259	D	97.9	Very high	97	Very high	100 Å²	100	56.7 Å²	56.7	54%	0.535	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-43.2	178	-66.2	-13.5	0	0	0	111.2	E255 K256 H261 N262 Y265	E255-D259 WeakPolarHBondContact O-CB 3.47Å; E255-D259 PolarHBondContact O-N 2.97Å; K256-D259 PolarHBondContact O-N 2.87Å; D259-H261 VanDerWaalsContact C-N 3.26Å; D259-H261 PolarHBondContact O-N 3.36Å; D259-N262 PolarHBondContact O-N 3.36Å; D259-N262 VanDerWaalsContact O-N 3.1Å; D259-Y265 VanDerWaalsContact OD1-CE1 3.27Å; D259-Y265 WeakPolarHBondContact OD1-CE1 2.97Å; D259-Y265 PolarHBondContact OD1-OH 2.89Å
260	E	97.8	Very high	97.2	Very high	135 Å²	135	54.1 Å²	54.1	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-61.2	-33.2	177.1	-78	177.2	176.6	0	0	112.7	K256 M257	K256-E260 WeakPolarHBondContact CE-OE1 3.43Å; K256-E260 IonicContact NZ-OE1 2.68Å; K256-E260 WeakPolarHBondContact O-CB 3.01Å; K256-E260 VanDerWaalsContact O-CG 3.28Å; K256-E260 WeakPolarHBondContact O-CG 3.31Å; K256-E260 PolarHBondContact O-N 2.82Å; M257-E260 PolarHBondContact O-N 3.16Å
261	H	97.7	Very high	97.2	Very high	87 Å²	87	57.8 Å²	57.8	40%	0.403	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	4.5	178	-66.2	76.7	0	0	0	113.2	K241 L242 M257 L258 D259 V263	K241-H261 PolarHBondContact O-CD2 3.14Å; L242-H261 HydrophobicContact CD2-CB 3.9Å; M257-H261 PolarHBondContact O-N 2.79Å; M257-H261 VanDerWaalsContact O-N 3.11Å; M257-H261 PolarHBondContact O-ND1 2.9Å; L258-H261 CarbonylContact O-C 3.51Å; L258-H261 PolarHBondContact O-N 2.94Å; D259-H261 VanDerWaalsContact C-N 3.26Å; D259-H261 PolarHBondContact O-N 3.36Å; H261-V263 HydrophobicContact CB-CG2 3.96Å; H261-V263 PolarHBondContact O-N 2.88Å
262	N	97.9	Very high	97.4	Very high	131 Å²	131	57.5 Å²	57.5	70%	0.701	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	44.3	-177.3	-170.2	47.2	0	0	0	112.2	K241 L258 D259	K241-N262 PolarHBondContact NZ-O 2.93Å; L258-N262 PolarHBondContact O-N 3.41Å; L258-N262 VanDerWaalsContact O-N 3.09Å; D259-N262 PolarHBondContact O-N 3.36Å; D259-N262 VanDerWaalsContact O-N 3.1Å
263	V	98.1	Very high	97.5	Very high	9 Å²	9	57.8 Å²	57.8	6%	0.055	28%	0.28	C	S	.	.			trans	-80.8	131.7	174.6	172.8	0	0	0	0	108.7	M234 E238 K241 L242 L258 H261 Y265	M234-V263 HydrophobicContact CB-CG1 4.42Å; M234-V263 HydrophobicContact CE-CG1 4.11Å; M234-V263 HydrophobicContact SD-CG1 3.68Å; E238-V263 HydrophobicContact CB-CG1 4.17Å; E238-V263 WeakPolarHBondContact OE2-CA 3.37Å; K241-V263 HydrophobicContact CB-CG2 3.92Å; K241-V263 HydrophobicContact CD-CG2 4.11Å; L242-V263 HydrophobicContact CD1-CG2 4.43Å; L242-V263 HydrophobicContact CD2-CG2 3.85Å; L242-V263 HydrophobicContact CG-CG2 3.96Å; L258-V263 HydrophobicContact CB-CB 4.13Å; L258-V263 HydrophobicContact CD2-CB 4.15Å; L258-V263 HydrophobicContact CD2-CG1 4Å; L258-V263 HydrophobicContact CD2-CG2 4.35Å; L258-V263 PolarHBondContact O-N 2.95Å; H261-V263 HydrophobicContact CB-CG2 3.96Å; H261-V263 PolarHBondContact O-N 2.88Å; V263-Y265 WeakPolarHBondContact O-CD1 3.46Å
264	R	97.5	Very high	97.6	Very high	101 Å²	101	58.5 Å²	58.5	38%	0.381	28%	0.284	S	S	.	.			trans	-81.4	117.9	167.6	-179.3	177	179.5	169.4	0.7	108.3	L26 P27 M234 P235 E238 Y266	L26-R264 VanDerWaalsContact CB-CZ 3.46Å; L26-R264 VanDerWaalsContact CB-NH2 3.26Å; L26-R264 PolarHBondContact O-NH2 2.93Å; P27-R264 PolarHBondContact O-NH2 2.86Å; M234-R264 VanDerWaalsContact CB-O 3.31Å; M234-R264 WeakPolarHBondContact CB-O 3.36Å; P235-R264 WeakPolarHBondContact CD-O 3.25Å; E238-R264 HydrophobicContact CG-CB 4.23Å; E238-R264 PolarHBondContact OE2-N 3.05Å; R264-Y266 PolarHBondContact NE-OH 3.38Å; R264-Y266 PolarHBondContact NH2-OH 3.47Å
265	Y	98	Very high	97.7	Very high	52 Å²	52	56.9 Å²	56.9	20%	0.204	28%	0.275	C	S	.	.			trans	-137.3	166.7	177.5	66.3	-81.2	0	0	0	110.9	L232 I233 E255 L258 D259 V263	L232-Y265 HydrophobicContact CD2-CD2 4.21Å; L232-Y265 HydrophobicContact CD2-CE2 4.25Å; I233-Y265 CarbonylContact O-C 3.53Å; I233-Y265 WeakPolarHBondContact O-CA 3.47Å; E255-Y265 HydrophobicContact CG-CE2 3.85Å; L258-Y265 HydrophobicContact CB-CD1 3.64Å; L258-Y265 HydrophobicContact CB-CE1 3.61Å; L258-Y265 HydrophobicContact CB-CG 4.39Å; L258-Y265 HydrophobicContact CD1-CD1 3.61Å; L258-Y265 HydrophobicContact CD1-CD2 3.73Å; L258-Y265 HydrophobicContact CD1-CE1 4.02Å; L258-Y265 HydrophobicContact CD1-CE2 4.13Å; L258-Y265 HydrophobicContact CD1-CG 3.46Å; L258-Y265 VanDerWaalsContact CD1-CG 3.46Å; L258-Y265 HydrophobicContact CG-CD1 4.24Å; L258-Y265 HydrophobicContact CG-CE1 4.48Å; D259-Y265 VanDerWaalsContact OD1-CE1 3.27Å; D259-Y265 WeakPolarHBondContact OD1-CE1 2.97Å; D259-Y265 PolarHBondContact OD1-OH 2.89Å; V263-Y265 WeakPolarHBondContact O-CD1 3.46Å
266	Y	98.3	Very high	97.7	Very high	17 Å²	17	54.7 Å²	54.7	7%	0.067	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.2	170.8	-53.7	-89.1	0	0	0	109.4	P27 I30 I233 P235 R264 W282	P27-Y266 VanDerWaalsContact O-CE1 3.3Å; P27-Y266 WeakPolarHBondContact O-CE1 3.28Å; P27-Y266 PolarHBondContact O-OH 2.71Å; I30-Y266 HydrophobicContact CD1-CD1 4.44Å; I30-Y266 HydrophobicContact CD1-CD2 4.04Å; I30-Y266 HydrophobicContact CD1-CG 3.75Å; I30-Y266 HydrophobicContact CG1-CD1 3.92Å; I30-Y266 HydrophobicContact CG1-CD2 4.24Å; I30-Y266 HydrophobicContact CG1-CG 3.73Å; I233-Y266 PolarHBondContact N-O 2.89Å; I233-Y266 PolarHBondContact O-N 3.31Å; P235-Y266 HydrophobicContact CG-CE2 4.02Å; R264-Y266 PolarHBondContact NE-OH 3.38Å; R264-Y266 PolarHBondContact NH2-OH 3.47Å; Y266-W282 HydrophobicContact CD2-CH2 4.5Å; Y266-W282 AromaticContact CD2-CZ3 3.83Å; Y266-W282 HydrophobicContact CD2-CZ3 3.83Å; Y266-W282 AromaticContact CE2-CH2 3.89Å; Y266-W282 HydrophobicContact CE2-CH2 3.89Å; Y266-W282 AromaticContact CE2-CZ3 3.62Å; Y266-W282 HydrophobicContact CE2-CZ3 3.62Å
267	T	98.1	Very high	97.8	Very high	63 Å²	63	48 Å²	48	39%	0.387	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.1	172.8	-60.6	0	0	0	0	109.6	K230 W231 L232	K230-T267 HydrophobicContact CG-CG2 4.22Å; W231-T267 CarbonylContact O-C 3.46Å; W231-T267 VanDerWaalsContact O-CA 3.29Å; W231-T267 WeakPolarHBondContact O-CA 3.37Å; L232-T267 HydrophobicContact CD2-CG2 4.41Å
268	I	98.1	Very high	97.8	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.6	174.7	-52.9	171.5	0	0	0	109.6	I30 I53 K230 W231 I233 Q270 V276	I30-I268 HydrophobicContact CD1-CD1 3.62Å; I30-I268 HydrophobicContact CD1-CG1 3.81Å; I30-I268 HydrophobicContact CG2-CD1 4.28Å; I53-I268 HydrophobicContact CD1-CB 4.49Å; I53-I268 HydrophobicContact CD1-CD1 4.48Å; I53-I268 HydrophobicContact CD1-CG1 4.36Å; I53-I268 HydrophobicContact CD1-CG2 3.48Å; I53-I268 VanDerWaalsContact CD1-CG2 3.48Å; I53-I268 HydrophobicContact CG1-CD1 4.47Å; I53-I268 HydrophobicContact CG1-CG2 4.06Å; K230-I268 CarbonylContact C-O 3.5Å; K230-I268 VanDerWaalsContact CA-O 3.28Å; K230-I268 WeakPolarHBondContact CA-O 3.45Å; W231-I268 HydrophobicContact CB-CB 3.92Å; W231-I268 HydrophobicContact CB-CD1 4.39Å; W231-I268 HydrophobicContact CB-CG1 4.39Å; W231-I268 HydrophobicContact CG-CB 4.14Å; W231-I268 PolarHBondContact N-O 2.8Å; W231-I268 PolarHBondContact O-N 2.89Å; I233-I268 HydrophobicContact CG2-CD1 3.98Å; I233-I268 HydrophobicContact CG2-CG1 4.25Å; I268-Q270 HydrophobicContact CG2-CB 4.17Å; I268-V276 HydrophobicContact CD1-CG1 3.92Å; I268-V276 HydrophobicContact CD1-CG2 4.48Å; I268-V276 HydrophobicContact CG2-CG2 4.33Å
269	N	97.7	Very high	97.8	Very high	70 Å²	70	45.3 Å²	45.3	37%	0.374	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	87.9	164.7	-66.9	-53.9	0	0	0	109.3	R32 L228 K229	R32-N269 PolarHBondContact NH1-O 2.82Å; R32-N269 PolarHBondContact NH2-O 3.25Å; L228-N269 HydrophobicContact CD1-CB 4.39Å; K229-N269 CarbonylContact O-C 3.55Å; K229-N269 WeakPolarHBondContact O-CA 3.21Å
270	Q	98.1	Very high	97.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	119.7	-176.6	178.5	-170.1	21.5	0	0	110.7	S222 N224 K229 I268 E274 V276	S222-Q270 PolarHBondContact O-NE2 3.48Å; N224-Q270 HydrophobicContact CB-CG 4Å; N224-Q270 PolarHBondContact ND2-O 2.89Å; K229-Q270 HydrophobicContact CB-CB 4.23Å; K229-Q270 PolarHBondContact N-O 3.35Å; K229-Q270 PolarHBondContact O-N 3.21Å; I268-Q270 HydrophobicContact CG2-CB 4.17Å; Q270-E274 WeakPolarHBondContact CA-OE2 3.36Å; Q270-E274 HydrophobicContact CG-CB 4.06Å; Q270-E274 PolarHBondContact NE2-O 3Å; Q270-V276 HydrophobicContact CB-CG2 4.08Å; Q270-V276 HydrophobicContact CG-CG2 3.87Å
271	R	96.8	Very high	97.8	Very high	104 Å²	104	35 Å²	35	39%	0.392	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-90.8	167.4	-179.5	-57.8	173.8	-178.5	-174.9	-2.8	110.8	L78 N224 L228 E274	L78-R271 PolarHBondContact O-NH1 3.02Å; N224-R271 WeakPolarHBondContact CB-O 3.48Å; L228-R271 HydrophobicContact CD1-CG 4.13Å; R271-E274 HydrophobicContact CB-CG 4.36Å; R271-E274 PolarHBondContact N-OE2 3.37Å; R271-E274 WeakPolarHBondContact O-CB 3.47Å; R271-E274 PolarHBondContact O-N 2.87Å
272	A	95.5	Very high	97.9	Very high	37 Å²	37	31 Å²	31	31%	0.306	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	145.4	168.7	0	0	0	0	0	110.7	N224 G227 E274	N224-A272 CarbonylContact O-C 3.52Å; G227-A272 PolarHBondContact O-N 3.28Å; A272-E274 PolarHBondContact O-N 2.91Å
273	N	96.1	Very high	97.9	Very high	25 Å²	25	26.5 Å²	26.5	13%	0.134	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	8.8	-178.7	-158.1	16.9	0	0	0	115.7	A55 N56 V57 S58 N59 N224	A55-N273 CarbonylContact C-O 3.55Å; N56-N273 VanDerWaalsContact C-OD1 3.3Å; N56-N273 WeakPolarHBondContact CA-OD1 3.07Å; N56-N273 PolarHBondContact N-O 2.85Å; V57-N273 PolarHBondContact N-O 2.69Å; V57-N273 VanDerWaalsContact N-O 3.16Å; V57-N273 PolarHBondContact N-OD1 3.48Å; V57-N273 VanDerWaalsContact N-OD1 3.13Å; S58-N273 PolarHBondContact N-OD1 3.24Å; S58-N273 PolarHBondContact OG-OD1 3.4Å; N59-N273 VanDerWaalsContact CG-ND2 3.3Å; N59-N273 PolarHBondContact N-OD1 2.97Å; N59-N273 PolarHBondContact ND2-ND2 3.35Å; N59-N273 PolarHBondContact OD1-ND2 3.46Å; N224-N273 PolarHBondContact O-N 2.87Å
274	E	98	Very high	97.9	Very high	17 Å²	17	26.3 Å²	26.3	8%	0.079	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	137.4	172.6	-62.8	-176.5	146.6	0	0	110.6	R32 I53 I54 A55 T223 N224 Q270 R271 A272	R32-E274 IonicContact CZ-OE1 3.56Å; R32-E274 IonicContact CZ-OE2 3.29Å; R32-E274 IonicContact NH1-OE1 2.89Å; R32-E274 PolarHBondContact NH1-OE1 3.33Å; R32-E274 IonicContact NH1-OE2 2.91Å; R32-E274 PolarHBondContact NH1-OE2 3Å; I53-E274 HydrophobicContact CG2-CB 3.9Å; I53-E274 HydrophobicContact CG2-CG 4.16Å; I54-E274 CarbonylContact O-C 3.6Å; I54-E274 WeakPolarHBondContact O-CA 3.36Å; A55-E274 HydrophobicContact CB-CG 4.47Å; T223-E274 WeakPolarHBondContact CA-O 3.41Å; N224-E274 PolarHBondContact N-O 2.91Å; Q270-E274 WeakPolarHBondContact CA-OE2 3.36Å; Q270-E274 HydrophobicContact CG-CB 4.06Å; Q270-E274 PolarHBondContact NE2-O 3Å; R271-E274 HydrophobicContact CB-CG 4.36Å; R271-E274 PolarHBondContact N-OE2 3.37Å; R271-E274 WeakPolarHBondContact O-CB 3.47Å; R271-E274 PolarHBondContact O-N 2.87Å; A272-E274 PolarHBondContact O-N 2.91Å
275	A	98.5	Very high	97.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.8	164.7	0	0	0	0	0	110.2	I53 I54 V57 F180 S222 T223	I53-A275 CarbonylContact C-O 3.56Å; I53-A275 WeakPolarHBondContact CA-O 3.42Å; I54-A275 HydrophobicContact CB-CB 4.49Å; I54-A275 PolarHBondContact N-O 3.21Å; I54-A275 PolarHBondContact O-N 3.16Å; V57-A275 HydrophobicContact CB-CB 4.24Å; V57-A275 HydrophobicContact CG1-CB 4.19Å; V57-A275 HydrophobicContact CG2-CB 3.82Å; F180-A275 HydrophobicContact CE2-CB 4.21Å; F180-A275 HydrophobicContact CZ-CB 4.44Å; S222-A275 CarbonylContact O-C 3.56Å; S222-A275 VanDerWaalsContact O-CA 3.3Å; S222-A275 WeakPolarHBondContact O-CA 3.49Å; T223-A275 WeakPolarHBondContact OG1-CB 3.36Å
276	V	98.8	Very high	98	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.2	168.1	177.9	0	0	0	0	107.4	I53 W221 S222 W231 I268 Q270 V278	I53-V276 HydrophobicContact CG1-CG2 4.29Å; W221-V276 CarbonylContact C-O 3.53Å; W221-V276 WeakPolarHBondContact CA-O 3.17Å; S222-V276 PolarHBondContact N-O 3.33Å; S222-V276 PolarHBondContact O-N 3.11Å; W231-V276 HydrophobicContact CZ2-CB 4.43Å; W231-V276 HydrophobicContact CZ2-CG2 4.45Å; I268-V276 HydrophobicContact CD1-CG1 3.92Å; I268-V276 HydrophobicContact CD1-CG2 4.48Å; I268-V276 HydrophobicContact CG2-CG2 4.33Å; Q270-V276 HydrophobicContact CB-CG2 4.08Å; Q270-V276 HydrophobicContact CG-CG2 3.87Å; V276-V278 HydrophobicContact CG1-CG2 3.91Å
277	F	98.8	Very high	97.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.2	164.5	172	-117.8	0	0	0	108.8	F41 M46 I50 P51 V52 F180 F219 P279 W299	F41-F277 HydrophobicContact CE2-CB 4.24Å; F41-F277 HydrophobicContact CE2-CD1 4.1Å; F41-F277 HydrophobicContact CE2-CG 4.06Å; F41-F277 HydrophobicContact CZ-CB 4.33Å; F41-F277 HydrophobicContact CZ-CD1 4.06Å; F41-F277 AromaticContact CZ-CD2 3.91Å; F41-F277 HydrophobicContact CZ-CD2 3.91Å; F41-F277 HydrophobicContact CZ-CE1 4.34Å; F41-F277 HydrophobicContact CZ-CE2 4.2Å; F41-F277 AromaticContact CZ-CG 3.83Å; F41-F277 HydrophobicContact CZ-CG 3.83Å; F41-F277 HydrophobicContact CZ-CZ 4.42Å; M46-F277 HydrophobicContact CB-CZ 4.33Å; M46-F277 HydrophobicContact CG-CZ 4.28Å; I50-F277 WeakPolarHBondContact O-CD1 3.35Å; I50-F277 WeakPolarHBondContact O-CE1 3.4Å; P51-F277 WeakPolarHBondContact CA-O 3.45Å; P51-F277 WeakPolarHBondContact CB-O 3.27Å; V52-F277 HydrophobicContact CG1-CB 3.96Å; V52-F277 HydrophobicContact CG1-CD1 4.25Å; V52-F277 PolarHBondContact O-N 3.24Å; F180-F277 HydrophobicContact CD1-CD2 4.45Å; F180-F277 HydrophobicContact CE1-CB 4.09Å; F180-F277 AromaticContact CE1-CD2 3.96Å; F180-F277 HydrophobicContact CE1-CD2 3.96Å; F180-F277 HydrophobicContact CE1-CG 4.34Å; F180-F277 HydrophobicContact CZ-CB 4.42Å; F219-F277 HydrophobicContact CB-CE2 3.87Å; F219-F277 AromaticContact CD1-CE2 3.99Å; F219-F277 HydrophobicContact CD1-CE2 3.99Å; F219-F277 AromaticContact CD1-CZ 3.82Å; F219-F277 HydrophobicContact CD1-CZ 3.82Å; F219-F277 HydrophobicContact CD2-CE2 4.17Å; F219-F277 HydrophobicContact CD2-CZ 4.36Å; F219-F277 AromaticContact CE1-CZ 3.98Å; F219-F277 HydrophobicContact CE1-CZ 3.98Å; F219-F277 AromaticContact CG-CE2 3.76Å; F219-F277 HydrophobicContact CG-CE2 3.76Å; F219-F277 HydrophobicContact CG-CZ 4Å; F219-F277 HydrophobicContact CZ-CZ 4.31Å; F277-P279 HydrophobicContact CD1-CG 4.07Å; F277-P279 HydrophobicContact CE1-CB 4.01Å; F277-P279 HydrophobicContact CE1-CG 3.7Å; F277-P279 HydrophobicContact CZ-CB 4.17Å; F277-P279 HydrophobicContact CZ-CG 4.31Å; F277-W299 HydrophobicContact CE2-CZ2 4.05Å
278	V	98.7	Very high	97.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	110.2	177.3	-178.1	0	0	0	0	107.7	F219 S220 W231 I233 V276 W282	F219-V278 WeakPolarHBondContact CA-O 3.37Å; S220-V278 PolarHBondContact N-O 3.45Å; S220-V278 PolarHBondContact O-N 2.87Å; W231-V278 HydrophobicContact CH2-CG2 4.39Å; W231-V278 HydrophobicContact CZ3-CG2 3.87Å; I233-V278 HydrophobicContact CD1-CG1 4.02Å; I233-V278 HydrophobicContact CD1-CG2 4.35Å; V276-V278 HydrophobicContact CG1-CG2 3.91Å; V278-W282 HydrophobicContact CG1-CB 4.29Å
279	P	98.2	Very high	97.7	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	9%	0.094	C	C	.	.			trans	-76.3	170.1	-179.3	-8.6	23.6	0	0	0	112.5	N49 P51 F219 F277 G281 W282	N49-P279 HydrophobicContact CB-CB 4.26Å; N49-P279 WeakPolarHBondContact OD1-CB 3.39Å; P51-P279 HydrophobicContact CB-CG 4.15Å; P51-P279 VanDerWaalsContact N-CG 3.28Å; F219-P279 HydrophobicContact CD1-CB 4.41Å; F219-P279 HydrophobicContact CE1-CB 4.37Å; F277-P279 HydrophobicContact CD1-CG 4.07Å; F277-P279 HydrophobicContact CE1-CB 4.01Å; F277-P279 HydrophobicContact CE1-CG 3.7Å; F277-P279 HydrophobicContact CZ-CB 4.17Å; F277-P279 HydrophobicContact CZ-CG 4.31Å; P279-G281 PolarHBondContact O-N 2.89Å; P279-W282 HydrophobicContact CB-CG 4.43Å; P279-W282 HydrophobicContact CG-CG 4.33Å; P279-W282 PolarHBondContact O-N 3.29Å
280	S	98.3	Very high	97.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	132.2	-176.4	-73	0	0	0	0	111.9	N49 G217 F219 W282 N304 M307	N49-S280 PolarHBondContact ND2-O 3.44Å; N49-S280 PolarHBondContact OD1-N 3Å; G217-S280 VanDerWaalsContact O-CB 3.23Å; G217-S280 WeakPolarHBondContact O-CB 3.46Å; G217-S280 PolarHBondContact O-OG 3.1Å; F219-S280 WeakPolarHBondContact CD1-OG 3.22Å; S280-W282 VanDerWaalsContact C-N 3.25Å; S280-W282 PolarHBondContact O-N 3.45Å; S280-N304 WeakPolarHBondContact OG-CB 3.32Å; S280-N304 PolarHBondContact OG-ND2 2.8Å; S280-M307 VanDerWaalsContact CB-CE 3.49Å
281	G	97.6	Very high	97.4	Very high	17 Å²	17	19 Å²	19	18%	0.175	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	2.7	176.7	0	0	0	0	0	115.1	P279 F283	P279-G281 PolarHBondContact O-N 2.89Å; G281-F283 PolarHBondContact O-N 2.94Å; G281-F283 VanDerWaalsContact O-N 3.13Å
282	W	98.2	Very high	97.4	Very high	3 Å²	3	14 Å²	14	1%	0.011	8%	0.082	C	C	.	.			trans	-78.6	97.8	175.5	-74.7	73	0	0	0	110.3	L26 N49 P51 I233 M234 P235 Y266 V278 P279 S280 H284	L26-W282 HydrophobicContact CD2-CH2 3.82Å; L26-W282 HydrophobicContact CD2-CZ2 3.88Å; N49-W282 PolarHBondContact O-NE1 3.33Å; P51-W282 HydrophobicContact CG-CD2 4.42Å; P51-W282 HydrophobicContact CG-CE3 4.1Å; P51-W282 HydrophobicContact CG-CH2 3.69Å; P51-W282 HydrophobicContact CG-CZ2 4.08Å; P51-W282 HydrophobicContact CG-CZ3 3.71Å; I233-W282 HydrophobicContact CD1-CB 4.09Å; I233-W282 HydrophobicContact CD1-CE3 4.32Å; I233-W282 HydrophobicContact CG1-CB 4.15Å; I233-W282 HydrophobicContact CG1-CE3 3.84Å; M234-W282 WeakPolarHBondContact O-CA 3.48Å; P235-W282 HydrophobicContact CB-CH2 4.09Å; P235-W282 HydrophobicContact CB-CZ2 4.3Å; P235-W282 HydrophobicContact CB-CZ3 4.24Å; P235-W282 HydrophobicContact CG-CH2 3.79Å; P235-W282 HydrophobicContact CG-CZ2 4.47Å; P235-W282 HydrophobicContact CG-CZ3 3.81Å; Y266-W282 HydrophobicContact CD2-CH2 4.5Å; Y266-W282 AromaticContact CD2-CZ3 3.83Å; Y266-W282 HydrophobicContact CD2-CZ3 3.83Å; Y266-W282 AromaticContact CE2-CH2 3.89Å; Y266-W282 HydrophobicContact CE2-CH2 3.89Å; Y266-W282 AromaticContact CE2-CZ3 3.62Å; Y266-W282 HydrophobicContact CE2-CZ3 3.62Å; V278-W282 HydrophobicContact CG1-CB 4.29Å; P279-W282 HydrophobicContact CB-CG 4.43Å; P279-W282 HydrophobicContact CG-CG 4.33Å; P279-W282 PolarHBondContact O-N 3.29Å; S280-W282 VanDerWaalsContact C-N 3.25Å; S280-W282 PolarHBondContact O-N 3.45Å; W282-H284 PolarHBondContact O-ND1 3.22Å
283	F	98.4	Very high	97.5	Very high	37 Å²	37	12.3 Å²	12.3	16%	0.162	7%	0.067	C	C	.	.			trans	-65.4	139.8	175.6	-83.8	-98.1	0	0	0	111.1	Y211 H212 A213 I233 M234 E239 L249 G281	Y211-F283 HydrophobicContact CE1-CD1 4.11Å; Y211-F283 HydrophobicContact CE2-CB 3.57Å; Y211-F283 HydrophobicContact CE2-CD1 4.24Å; Y211-F283 HydrophobicContact CE2-CG 4.37Å; Y211-F283 AromaticContact CZ-CD1 3.87Å; Y211-F283 VanDerWaalsContact OH-CB 3.28Å; Y211-F283 WeakPolarHBondContact OH-CB 3.23Å; H212-F283 CarbonylContact O-C 3.57Å; H212-F283 VanDerWaalsContact O-CA 3.32Å; H212-F283 WeakPolarHBondContact O-CA 3.35Å; A213-F283 HydrophobicContact CB-CD1 3.99Å; A213-F283 HydrophobicContact CB-CD2 3.69Å; A213-F283 HydrophobicContact CB-CE1 3.89Å; A213-F283 HydrophobicContact CB-CE2 3.59Å; A213-F283 HydrophobicContact CB-CG 3.88Å; A213-F283 HydrophobicContact CB-CZ 3.7Å; A213-F283 VanDerWaalsContact N-CD1 3.35Å; I233-F283 WeakPolarHBondContact CA-O 3.42Å; M234-F283 HydrophobicContact CG-CB 4.13Å; M234-F283 PolarHBondContact N-O 3.47Å; E239-F283 HydrophobicContact CB-CB 4.1Å; E239-F283 HydrophobicContact CB-CD1 4.26Å; E239-F283 HydrophobicContact CB-CD2 3.69Å; E239-F283 HydrophobicContact CB-CE2 4.18Å; E239-F283 HydrophobicContact CB-CG 3.75Å; E239-F283 HydrophobicContact CG-CD2 3.53Å; E239-F283 HydrophobicContact CG-CE2 3.57Å; E239-F283 HydrophobicContact CG-CG 4.09Å; E239-F283 HydrophobicContact CG-CZ 4.14Å; L249-F283 HydrophobicContact CD1-CD1 3.93Å; L249-F283 HydrophobicContact CD1-CE1 3.21Å; L249-F283 HydrophobicContact CD1-CZ 3.69Å; G281-F283 PolarHBondContact O-N 2.94Å; G281-F283 VanDerWaalsContact O-N 3.13Å
284	H	98.6	Very high	97.6	Very high	6 Å²	6	11.1 Å²	11.1	3%	0.028	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	162.9	-175.6	60.1	-85.6	0	0	0	113.9	Y211 H212 D214 W231 L232 I233 W282	Y211-H284 WeakPolarHBondContact CA-O 3.3Å; H212-H284 AromaticContact CE1-NE2 3.57Å; H212-H284 PolarHBondContact N-O 3.3Å; H212-H284 AromaticContact NE2-NE2 3.74Å; H212-H284 PolarHBondContact O-N 2.8Å; D214-H284 IonicContact OD2-CE1 2.84Å; D214-H284 PolarHBondContact OD2-CE1 2.81Å; W231-H284 AromaticContact CE3-CD2 3.91Å; W231-H284 AromaticContact CZ3-CD2 3.68Å; W231-H284 AromaticContact CZ3-NE2 3.93Å; L232-H284 CarbonylContact O-C 3.59Å; L232-H284 WeakPolarHBondContact O-CA 3.39Å; L232-H284 VanDerWaalsContact O-CB 3.28Å; L232-H284 WeakPolarHBondContact O-CB 3.31Å; I233-H284 HydrophobicContact CB-CB 3.83Å; I233-H284 HydrophobicContact CD1-CB 4.28Å; I233-H284 HydrophobicContact CG1-CB 3.92Å; W282-H284 PolarHBondContact O-ND1 3.22Å
285	Q	98.3	Very high	97.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	137.7	169.5	167.9	158.9	1.9	0	0	109.6	W208 T209 W231 L232 S252 I253 W287	W208-Q285 VanDerWaalsContact CZ3-NE2 3.28Å; T209-Q285 VanDerWaalsContact O-CG 3.31Å; T209-Q285 WeakPolarHBondContact O-CG 3.18Å; W231-Q285 WeakPolarHBondContact CA-O 3.41Å; L232-Q285 PolarHBondContact N-O 3.04Å; L232-Q285 PolarHBondContact O-N 2.78Å; S252-Q285 PolarHBondContact OG-NE2 2.84Å; S252-Q285 VanDerWaalsContact OG-NE2 3.12Å; I253-Q285 HydrophobicContact CD1-CB 4.09Å; I253-Q285 HydrophobicContact CG1-CB 3.8Å; I253-Q285 HydrophobicContact CG1-CG 4.4Å; I253-Q285 PolarHBondContact O-OE1 3.31Å; Q285-W287 VanDerWaalsContact NE2-CZ2 3.29Å
286	V	98.4	Very high	97.7	Very high	6 Å²	6	11 Å²	11	4%	0.036	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.2	-174.3	-165.2	0	0	0	0	110.8	W208 T209 K229 K230 W231	W208-V286 CarbonylContact C-O 3.6Å; W208-V286 WeakPolarHBondContact CA-O 3.48Å; W208-V286 WeakPolarHBondContact CB-O 3.28Å; T209-V286 PolarHBondContact N-O 2.99Å; T209-V286 PolarHBondContact OG1-N 2.67Å; T209-V286 VanDerWaalsContact OG1-N 3.16Å; K229-V286 HydrophobicContact CB-CG1 4.01Å; K229-V286 HydrophobicContact CD-CG1 3.98Å; K229-V286 HydrophobicContact CG-CG1 4.37Å; K230-V286 CarbonylContact O-C 3.55Å; K230-V286 WeakPolarHBondContact O-CA 3.45Å; W231-V286 HydrophobicContact CD2-CB 4.42Å; W231-V286 HydrophobicContact CD2-CG1 4Å; W231-V286 HydrophobicContact CD2-CG2 3.6Å; W231-V286 HydrophobicContact CE3-CG2 3.28Å; W231-V286 HydrophobicContact CG-CG1 4.29Å; W231-V286 HydrophobicContact CG-CG2 4.33Å; W231-V286 HydrophobicContact CH2-CG2 3.81Å; W231-V286 HydrophobicContact CZ2-CG1 4.11Å; W231-V286 HydrophobicContact CZ2-CG2 4.11Å; W231-V286 HydrophobicContact CZ3-CG2 3.4Å
287	W	97.6	Very high	97.6	Very high	25 Å²	25	11 Å²	11	10%	0.095	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.2	175.1	-67.5	86.3	0	0	0	110.2	W208 K229 K230 Q285 L289	W208-W287 HydrophobicContact CB-CD2 3.67Å; W208-W287 HydrophobicContact CB-CE3 3.49Å; W208-W287 VanDerWaalsContact CB-CE3 3.49Å; W208-W287 HydrophobicContact CB-CG 4.22Å; W208-W287 HydrophobicContact CB-CH2 4.25Å; W208-W287 HydrophobicContact CB-CZ2 4.41Å; W208-W287 HydrophobicContact CB-CZ3 3.8Å; W208-W287 AromaticContact CD1-CH2 3.83Å; W208-W287 AromaticContact CD1-CZ3 3.48Å; W208-W287 VanDerWaalsContact CD1-CZ3 3.48Å; W208-W287 AromaticContact CD2-CH2 3.94Å; W208-W287 HydrophobicContact CD2-CH2 3.94Å; W208-W287 HydrophobicContact CD2-CZ2 4.16Å; W208-W287 HydrophobicContact CD2-CZ3 4.26Å; W208-W287 HydrophobicContact CE3-CZ2 4.29Å; W208-W287 HydrophobicContact CG-CD2 4.26Å; W208-W287 AromaticContact CG-CE3 3.85Å; W208-W287 HydrophobicContact CG-CE3 3.85Å; W208-W287 AromaticContact CG-CH2 3.77Å; W208-W287 HydrophobicContact CG-CH2 3.77Å; W208-W287 HydrophobicContact CG-CZ2 4.2Å; W208-W287 AromaticContact CG-CZ3 3.59Å; W208-W287 HydrophobicContact CG-CZ3 3.59Å; K229-W287 CarbonylContact C-O 3.57Å; K229-W287 VanDerWaalsContact CA-O 3.32Å; K229-W287 WeakPolarHBondContact CA-O 3.37Å; K230-W287 HydrophobicContact CB-CB 4.4Å; K230-W287 PolarHBondContact N-O 3.21Å; K230-W287 PolarHBondContact O-N 2.89Å; Q285-W287 VanDerWaalsContact NE2-CZ2 3.29Å; W287-L289 HydrophobicContact CB-CD2 4.35Å; W287-L289 PolarHBondContact O-N 3.18Å
288	N	96.6	Very high	97.6	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	103.9	168.9	-66.6	-17.4	0	0	0	108.1	N206 S207 K229 T290	N206-N288 WeakPolarHBondContact CA-O 3.49Å; N206-N288 PolarHBondContact N-O 3.28Å; S207-N288 WeakPolarHBondContact O-CB 3.48Å; S207-N288 PolarHBondContact O-N 2.91Å; S207-N288 PolarHBondContact OG-ND2 3.07Å; K229-N288 WeakPolarHBondContact CG-OD1 3.24Å; N288-T290 PolarHBondContact O-N 3.38Å
289	L	95.3	Very high	97.6	Very high	31 Å²	31	11.3 Å²	11.3	16%	0.162	6%	0.063	C	C	.	.	S	Bend	trans	-72.7	-18.2	-179.9	-60.9	-170.6	0	0	0	112.8	V145 K205 L228 K230 W287	V145-L289 HydrophobicContact CG1-CD2 3.55Å; K205-L289 WeakPolarHBondContact CE-O 3.4Å; K205-L289 WeakPolarHBondContact CG-O 3.49Å; L228-L289 HydrophobicContact CB-CB 4.29Å; L228-L289 HydrophobicContact CD2-CB 4.13Å; L228-L289 HydrophobicContact CD2-CD1 3.69Å; L228-L289 HydrophobicContact CD2-CG 4.47Å; L228-L289 HydrophobicContact CG-CB 4.23Å; L228-L289 HydrophobicContact CG-CD1 4.05Å; L228-L289 WeakPolarHBondContact O-CB 3.06Å; L228-L289 PolarHBondContact O-N 2.71Å; K230-L289 HydrophobicContact CB-CD1 3.87Å; K230-L289 HydrophobicContact CB-CD2 3.9Å; K230-L289 HydrophobicContact CB-CG 3.84Å; K230-L289 HydrophobicContact CD-CD2 4.36Å; W287-L289 HydrophobicContact CB-CD2 4.35Å; W287-L289 PolarHBondContact O-N 3.18Å
290	T	94	Very high	97.6	Very high	49 Å²	49	11.3 Å²	11.3	30%	0.301	6%	0.063	S	C	.	.	S	Bend	trans	-138.6	172	172.2	66	0	0	0	0	109.2	G227 L228 N288 T292	G227-T290 WeakPolarHBondContact CA-OG1 3.46Å; L228-T290 HydrophobicContact CB-CG2 4.33Å; L228-T290 PolarHBondContact N-OG1 3.47Å; N288-T290 PolarHBondContact O-N 3.38Å; T290-T292 PolarHBondContact O-N 3.27Å; T290-T292 PolarHBondContact O-OG1 3.12Å
291	D	94.8	Very high	97.6	Very high	39 Å²	39	11.3 Å²	11.3	21%	0.209	6%	0.063	C	C	.	.	S	Bend	trans	-50.8	129.5	164.5	-58.7	-77.7	0	0	0	110.3	I87 W128 I132 P204 K205 G227	I87-D291 HydrophobicContact CG1-CB 4.29Å; W128-D291 HydrophobicContact CZ2-CB 3.85Å; W128-D291 PolarHBondContact NE1-OD1 2.98Å; I132-D291 HydrophobicContact CD1-CB 4.48Å; P204-D291 VanDerWaalsContact CA-OD1 3.24Å; P204-D291 WeakPolarHBondContact CA-OD1 3.45Å; K205-D291 PolarHBondContact N-OD1 3.42Å; G227-D291 VanDerWaalsContact CA-O 3.32Å; G227-D291 WeakPolarHBondContact CA-O 3.47Å
292	T	96.1	Very high	97.7	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.006	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	140.6	-162.7	-67.8	0	0	0	0	111.7	G203 N224 V226 K229 T290	G203-T292 PolarHBondContact N-O 3.09Å; G203-T292 PolarHBondContact O-N 3.4Å; N224-T292 VanDerWaalsContact OD1-CG2 3.27Å; N224-T292 WeakPolarHBondContact OD1-CG2 3.03Å; V226-T292 VanDerWaalsContact O-CA 3.32Å; V226-T292 WeakPolarHBondContact O-CA 3.33Å; K229-T292 HydrophobicContact CD-CG2 4.17Å; K229-T292 HydrophobicContact CG-CG2 3.84Å; T290-T292 PolarHBondContact O-N 3.27Å; T290-T292 PolarHBondContact O-OG1 3.12Å
293	I	98.4	Very high	97.7	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.2	167.7	-55.2	175.6	0	0	0	108.8	W66 I87 L92 W128 V200 Y201 M202 N224 I225 V226	W66-I293 HydrophobicContact CB-CD1 4.34Å; W66-I293 HydrophobicContact CE3-CB 4.46Å; W66-I293 HydrophobicContact CE3-CD1 4.49Å; W66-I293 HydrophobicContact CE3-CG2 3.44Å; W66-I293 VanDerWaalsContact CE3-CG2 3.44Å; W66-I293 HydrophobicContact CZ3-CG2 3.53Å; I87-I293 HydrophobicContact CD1-CD1 3.83Å; I87-I293 HydrophobicContact CD1-CG1 3.94Å; I87-I293 HydrophobicContact CG2-CD1 4.02Å; L92-I293 HydrophobicContact CD1-CD1 4.01Å; W128-I293 HydrophobicContact CH2-CD1 4.26Å; W128-I293 HydrophobicContact CH2-CG1 3.82Å; W128-I293 HydrophobicContact CZ3-CD1 4.36Å; W128-I293 HydrophobicContact CZ3-CG1 4.27Å; V200-I293 HydrophobicContact CG1-CG2 4.37Å; Y201-I293 CarbonylContact O-C 3.59Å; Y201-I293 VanDerWaalsContact O-CA 3.25Å; Y201-I293 WeakPolarHBondContact O-CA 3.28Å; Y201-I293 WeakPolarHBondContact O-CG2 3.38Å; M202-I293 HydrophobicContact CB-CG1 4.3Å; M202-I293 HydrophobicContact CE-CD1 4.37Å; M202-I293 HydrophobicContact CE-CG2 4.15Å; M202-I293 HydrophobicContact CG-CB 4.43Å; M202-I293 HydrophobicContact CG-CD1 4.3Å; M202-I293 HydrophobicContact CG-CG1 3.96Å; M202-I293 HydrophobicContact CG-CG2 3.87Å; M202-I293 HydrophobicContact SD-CD1 4.27Å; N224-I293 PolarHBondContact OD1-O 2.98Å; I225-I293 WeakPolarHBondContact CB-O 3.38Å; I225-I293 PolarHBondContact N-O 2.75Å; V226-I293 HydrophobicContact CG1-CB 3.75Å; V226-I293 HydrophobicContact CG1-CD1 4.26Å; V226-I293 HydrophobicContact CG1-CG1 3.85Å; V226-I293 PolarHBondContact N-O 2.91Å; V226-I293 PolarHBondContact O-N 3.17Å
294	S	98.5	Very high	97.7	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	159.8	175.3	69	0	0	0	0	113	V200 Y201 T223 K229 N296	V200-S294 WeakPolarHBondContact CA-O 3.25Å; Y201-S294 PolarHBondContact N-O 2.82Å; Y201-S294 PolarHBondContact O-N 3.27Å; T223-S294 VanDerWaalsContact O-CA 3.26Å; T223-S294 WeakPolarHBondContact O-CA 3.38Å; T223-S294 VanDerWaalsContact O-CB 3.23Å; T223-S294 WeakPolarHBondContact O-CB 3.48Å; K229-S294 VanDerWaalsContact NZ-CB 3.25Å; K229-S294 PolarHBondContact NZ-OG 2.64Å; S294-N296 WeakPolarHBondContact CB-OD1 3.33Å; S294-N296 PolarHBondContact OG-OD1 2.93Å
295	V	98.7	Very high	97.7	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.006	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.7	168.8	-177.2	0	0	0	0	108.1	W61 W66 F173 Y174 F199 W221 T223 I225	W61-V295 HydrophobicContact CZ3-CB 4.13Å; W61-V295 HydrophobicContact CZ3-CG2 4.26Å; W66-V295 HydrophobicContact CZ3-CG2 4.44Å; F173-V295 HydrophobicContact CD2-CG2 4.39Å; F173-V295 HydrophobicContact CE2-CG1 4.4Å; F173-V295 HydrophobicContact CE2-CG2 3.94Å; Y174-V295 HydrophobicContact CD1-CG1 4.25Å; Y174-V295 HydrophobicContact CD2-CG1 3.86Å; Y174-V295 HydrophobicContact CE1-CG1 4.3Å; Y174-V295 HydrophobicContact CE2-CG1 3.93Å; Y174-V295 HydrophobicContact CG-CG1 4.03Å; F199-V295 WeakPolarHBondContact O-CA 3.34Å; W221-V295 HydrophobicContact CH2-CG1 3.96Å; W221-V295 HydrophobicContact CZ3-CB 4.38Å; W221-V295 HydrophobicContact CZ3-CG1 4.15Å; W221-V295 VanDerWaalsContact CZ3-O 3.31Å; W221-V295 WeakPolarHBondContact CZ3-O 3.35Å; T223-V295 PolarHBondContact N-O 3.33Å; T223-V295 PolarHBondContact O-N 3.35Å; I225-V295 HydrophobicContact CD1-CG2 4.35Å; I225-V295 HydrophobicContact CG1-CG2 4.29Å
296	N	98.6	Very high	97.6	Very high	13 Å²	13	13.2 Å²	13.2	7%	0.07	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	142.1	-172.6	-64.2	53	0	0	0	110.7	R198 F199 Y201 W221 S222 S294	R198-N296 CarbonylContact C-O 3.58Å; F199-N296 HydrophobicContact CB-CB 4.43Å; F199-N296 PolarHBondContact N-O 3.27Å; F199-N296 PolarHBondContact O-N 2.96Å; Y201-N296 HydrophobicContact CD2-CB 4.03Å; Y201-N296 WeakPolarHBondContact CD2-OD1 3.48Å; Y201-N296 HydrophobicContact CE2-CB 3.7Å; W221-N296 CarbonylContact O-C 3.59Å; W221-N296 WeakPolarHBondContact O-CA 3.28Å; S222-N296 WeakPolarHBondContact CB-ND2 3.49Å; S222-N296 PolarHBondContact OG-ND2 3.29Å; S294-N296 WeakPolarHBondContact CB-OD1 3.33Å; S294-N296 PolarHBondContact OG-OD1 2.93Å
297	H	98.5	Very high	97.6	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.1	166.3	-66.5	-162	0	0	0	110.7	Y174 Y197 R198 S220 W221	Y174-H297 AromaticContact CE2-CE1 3.94Å; Y174-H297 AromaticContact CE2-NE2 3.31Å; Y174-H297 VanDerWaalsContact CE2-NE2 3.31Å; Y174-H297 WeakPolarHBondContact CE2-NE2 3.43Å; Y174-H297 AromaticContact CZ-NE2 3.36Å; Y174-H297 PolarHBondContact OH-CE1 2.85Å; Y174-H297 PolarHBondContact OH-NE2 3.19Å; Y197-H297 CarbonylContact O-C 3.54Å; Y197-H297 WeakPolarHBondContact O-CA 3.47Å; Y197-H297 WeakPolarHBondContact O-CB 3.36Å; R198-H297 WeakPolarHBondContact CB-NE2 3.4Å; R198-H297 WeakPolarHBondContact CD-CE1 3.3Å; R198-H297 WeakPolarHBondContact CG-CE1 3.39Å; R198-H297 WeakPolarHBondContact CG-NE2 3.27Å; S220-H297 WeakPolarHBondContact CA-O 3.14Å; S220-H297 PolarHBondContact OG-O 3.43Å; W221-H297 HydrophobicContact CD2-CB 4.35Å; W221-H297 AromaticContact CE2-CD2 3.83Å; W221-H297 AromaticContact CE2-CG 3.49Å; W221-H297 VanDerWaalsContact CE2-CG 3.49Å; W221-H297 AromaticContact CE2-ND1 3.88Å; W221-H297 AromaticContact CH2-CD2 3.57Å; W221-H297 AromaticContact CH2-NE2 3.77Å; W221-H297 HydrophobicContact CZ2-CB 3.95Å; W221-H297 AromaticContact CZ2-CD2 3.19Å; W221-H297 WeakPolarHBondContact CZ2-CD2 3.32Å; W221-H297 AromaticContact CZ2-CE1 3.59Å; W221-H297 AromaticContact CZ2-CG 3.26Å; W221-H297 AromaticContact CZ2-ND1 3.5Å; W221-H297 AromaticContact CZ2-NE2 3.4Å; W221-H297 WeakPolarHBondContact CZ2-NE2 3.32Å; W221-H297 PolarHBondContact N-O 3.3Å; W221-H297 AromaticContact NE1-CG 3.59Å; W221-H297 AromaticContact NE1-ND1 3.78Å; W221-H297 PolarHBondContact O-N 2.88Å
298	N	98.6	Very high	97.6	Very high	8 Å²	8	14.8 Å²	14.8	4%	0.043	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.4	156	-67.9	104.8	0	0	0	109.1	N186 Y197 F199 D214 V215 S218 F219	N186-N298 PolarHBondContact ND2-O 2.76Å; N186-N298 VanDerWaalsContact ND2-O 3.11Å; Y197-N298 WeakPolarHBondContact CB-O 3.43Å; Y197-N298 HydrophobicContact CD1-CB 3.91Å; Y197-N298 HydrophobicContact CG-CB 4.4Å; Y197-N298 PolarHBondContact O-N 3.18Å; F199-N298 VanDerWaalsContact CE2-OD1 3.28Å; F199-N298 WeakPolarHBondContact CE2-OD1 3.43Å; D214-N298 VanDerWaalsContact CB-ND2 3.32Å; D214-N298 WeakPolarHBondContact CB-ND2 3.2Å; D214-N298 PolarHBondContact OD1-ND2 2.88Å; V215-N298 HydrophobicContact CG1-CB 4.38Å; S218-N298 PolarHBondContact OG-ND2 2.97Å; F219-N298 WeakPolarHBondContact O-CA 3.16Å
299	W	98.5	Very high	97.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	161.5	-174.9	69	-74.1	0	0	0	112.4	M46 F180 S182 D183 S218 F219 W221 F277 N301	M46-W299 HydrophobicContact CE-CH2 3.86Å; M46-W299 HydrophobicContact CG-CH2 4.07Å; M46-W299 HydrophobicContact SD-CH2 3.71Å; M46-W299 HydrophobicContact SD-CZ3 4.37Å; F180-W299 HydrophobicContact CB-CZ2 4.4Å; F180-W299 HydrophobicContact CD1-CZ2 4Å; S182-W299 WeakPolarHBondContact O-CZ3 3.4Å; D183-W299 HydrophobicContact CB-CB 4.05Å; D183-W299 HydrophobicContact CB-CE3 4.35Å; D183-W299 VanDerWaalsContact OD1-CB 3.24Å; D183-W299 WeakPolarHBondContact OD1-CB 3.13Å; D183-W299 WeakPolarHBondContact OD2-CB 3.44Å; S218-W299 CarbonylContact C-O 3.58Å; S218-W299 VanDerWaalsContact CB-O 3.27Å; S218-W299 WeakPolarHBondContact CB-O 3.4Å; F219-W299 WeakPolarHBondContact CA-O 3.07Å; F219-W299 HydrophobicContact CB-CD2 4.14Å; F219-W299 HydrophobicContact CB-CG 4.27Å; F219-W299 HydrophobicContact CB-CZ2 4.15Å; F219-W299 WeakPolarHBondContact CB-O 3.43Å; F219-W299 HydrophobicContact CD2-CD2 4.17Å; F219-W299 AromaticContact CD2-CE2 3.86Å; F219-W299 HydrophobicContact CD2-CE3 4.18Å; F219-W299 AromaticContact CD2-CH2 3.69Å; F219-W299 HydrophobicContact CD2-CH2 3.69Å; F219-W299 AromaticContact CD2-CZ2 3.64Å; F219-W299 HydrophobicContact CD2-CZ2 3.64Å; F219-W299 AromaticContact CD2-CZ3 3.95Å; F219-W299 HydrophobicContact CD2-CZ3 3.95Å; F219-W299 HydrophobicContact CE2-CH2 4.18Å; F219-W299 HydrophobicContact CE2-CZ2 4.47Å; F219-W299 HydrophobicContact CE2-CZ3 4.47Å; F219-W299 HydrophobicContact CG-CZ2 4.26Å; F219-W299 PolarHBondContact N-O 3.04Å; F219-W299 PolarHBondContact O-N 3.23Å; W221-W299 AromaticContact CD1-CD1 3.72Å; W221-W299 AromaticContact CD1-NE1 3.59Å; F277-W299 HydrophobicContact CE2-CZ2 4.05Å; W299-N301 HydrophobicContact CE3-CB 4.44Å; W299-N301 HydrophobicContact CZ3-CB 4.04Å; W299-N301 WeakPolarHBondContact CZ3-ND2 3.23Å
300	F	98.5	Very high	97.8	Very high	1 Å²	1	17.8 Å²	17.8	0%	0.004	10%	0.101	C	C	.	.			trans	-149.3	163.4	172	46	-114.8	0	0	0	109.9	W184 L185 F216 N304 I305 V308 L354	W184-F300 HydrophobicContact CB-CD2 4.32Å; W184-F300 HydrophobicContact CB-CE2 4.42Å; W184-F300 WeakPolarHBondContact CB-O 3.49Å; W184-F300 PolarHBondContact N-O 3.19Å; L185-F300 HydrophobicContact CB-CD1 4.43Å; L185-F300 HydrophobicContact CB-CD2 4.27Å; L185-F300 HydrophobicContact CB-CE1 4Å; L185-F300 HydrophobicContact CB-CE2 3.73Å; L185-F300 HydrophobicContact CB-CZ 3.63Å; L185-F300 HydrophobicContact CD1-CE1 4.1Å; L185-F300 HydrophobicContact CD1-CZ 3.71Å; L185-F300 HydrophobicContact CD2-CD1 4.36Å; L185-F300 HydrophobicContact CD2-CE1 3.82Å; L185-F300 HydrophobicContact CD2-CZ 4.19Å; L185-F300 HydrophobicContact CG-CE1 4.19Å; L185-F300 HydrophobicContact CG-CZ 4.03Å; F216-F300 HydrophobicContact CB-CE1 4.35Å; F216-F300 HydrophobicContact CD2-CD1 4.48Å; F216-F300 AromaticContact CD2-CE1 3.79Å; F216-F300 HydrophobicContact CD2-CE1 3.79Å; F216-F300 HydrophobicContact CG-CE1 4.37Å; F300-N304 VanDerWaalsContact CA-OD1 3.32Å; F300-N304 WeakPolarHBondContact CA-OD1 3.4Å; F300-N304 WeakPolarHBondContact CB-OD1 3.36Å; F300-I305 HydrophobicContact CD2-CD1 4.18Å; F300-I305 HydrophobicContact CE2-CD1 4.49Å; F300-V308 HydrophobicContact CB-CG2 3.89Å; F300-V308 HydrophobicContact CD1-CG1 4.32Å; F300-V308 HydrophobicContact CD1-CG2 3.79Å; F300-V308 HydrophobicContact CE1-CG1 4.29Å; F300-V308 HydrophobicContact CG-CG2 3.93Å; F300-L354 HydrophobicContact CD2-CD2 4.44Å; F300-L354 HydrophobicContact CE2-CD1 4.38Å; F300-L354 HydrophobicContact CE2-CD2 3.29Å; F300-L354 HydrophobicContact CE2-CG 4.39Å; F300-L354 HydrophobicContact CZ-CD2 3.58Å
301	N	98.5	Very high	97.9	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.			trans	-155.8	-163	179.2	72.4	-4	0	0	0	111.2	M46 S182 W184 W299 C303 N304 I305	M46-N301 PolarHBondContact SD-ND2 3.24Å; M46-N301 VanDerWaalsContact SD-ND2 3.41Å; S182-N301 VanDerWaalsContact O-CB 3.25Å; S182-N301 WeakPolarHBondContact O-CB 3.19Å; S182-N301 PolarHBondContact OG-ND2 2.79Å; W184-N301 HydrophobicContact CD2-CB 4.24Å; W184-N301 HydrophobicContact CG-CB 4.17Å; W299-N301 HydrophobicContact CE3-CB 4.44Å; W299-N301 HydrophobicContact CZ3-CB 4.04Å; W299-N301 WeakPolarHBondContact CZ3-ND2 3.23Å; N301-C303 PolarHBondContact O-N 3.36Å; N301-C303 VanDerWaalsContact OD1-CB 3.27Å; N301-C303 WeakPolarHBondContact OD1-CB 3.42Å; N301-C303 PolarHBondContact OD1-N 2.63Å; N301-N304 PolarHBondContact N-OD1 3.18Å; N301-N304 PolarHBondContact O-N 2.97Å; N301-N304 PolarHBondContact O-OD1 2.86Å; N301-I305 WeakPolarHBondContact O-CB 3.41Å; N301-I305 PolarHBondContact O-N 3.32Å
302	G	98	Very high	98	Very high	7 Å²	7	15.8 Å²	15.8	7%	0.072	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-25	178.6	0	0	0	0	0	115.1	C391	G302-C391 PolarHBondContact O-SG 3.49Å
303	C	98.2	Very high	98	Very high	22 Å²	22	19 Å²	19	15%	0.149	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-33.4	-179	-64.1	0	0	0	0	113.4	F42 M46 F219 N301	F42-C303 WeakPolarHBondContact CZ-SG 2.99Å; M46-C303 HydrophobicContact CG-CB 4.27Å; M46-C303 HydrophobicContact SD-CB 4.36Å; M46-C303 VanDerWaalsContact SD-SG 3.63Å; F219-C303 HydrophobicContact CE2-CB 4.02Å; F219-C303 HydrophobicContact CZ-CB 3.98Å; N301-C303 PolarHBondContact O-N 3.36Å; N301-C303 VanDerWaalsContact OD1-CB 3.27Å; N301-C303 WeakPolarHBondContact OD1-CB 3.42Å; N301-C303 PolarHBondContact OD1-N 2.63Å
304	N	98.2	Very high	97.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.3	4.9	-174.1	66.7	-15.3	0	0	0	114.5	F219 S280 F300 N301 S306 M307 V308	F219-N304 HydrophobicContact CD1-CB 4.42Å; F219-N304 VanDerWaalsContact CD1-ND2 3.31Å; F219-N304 WeakPolarHBondContact CD1-ND2 3.41Å; F219-N304 VanDerWaalsContact CD2-ND2 3.35Å; F219-N304 WeakPolarHBondContact CD2-ND2 3.25Å; F219-N304 HydrophobicContact CE1-CB 3.76Å; F219-N304 WeakPolarHBondContact CE1-ND2 3.28Å; F219-N304 HydrophobicContact CE2-CB 3.99Å; F219-N304 VanDerWaalsContact CE2-CG 3.48Å; F219-N304 VanDerWaalsContact CG-ND2 3.26Å; F219-N304 WeakPolarHBondContact CG-ND2 3.38Å; F219-N304 HydrophobicContact CZ-CB 3.52Å; F219-N304 PolarHBondContact N-ND2 2.76Å; S280-N304 WeakPolarHBondContact OG-CB 3.32Å; S280-N304 PolarHBondContact OG-ND2 2.8Å; F300-N304 VanDerWaalsContact CA-OD1 3.32Å; F300-N304 WeakPolarHBondContact CA-OD1 3.4Å; F300-N304 WeakPolarHBondContact CB-OD1 3.36Å; N301-N304 PolarHBondContact N-OD1 3.18Å; N301-N304 PolarHBondContact O-N 2.97Å; N301-N304 PolarHBondContact O-OD1 2.86Å; N304-S306 PolarHBondContact O-N 2.91Å; N304-S306 VanDerWaalsContact O-N 3.12Å; N304-M307 HydrophobicContact CB-SD 4.46Å; N304-M307 WeakPolarHBondContact O-CA 3.46Å; N304-M307 WeakPolarHBondContact O-CB 3.4Å; N304-M307 PolarHBondContact O-N 3.01Å; N304-V308 PolarHBondContact O-N 3.31Å
305	I	98.4	Very high	97.8	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-31.4	-179.3	-164.8	65.4	0	0	0	113.3	W184 F300 N301 V308 W309 F351 L355 I395	W184-I305 HydrophobicContact CE3-CD1 4.17Å; W184-I305 HydrophobicContact CE3-CG1 4.42Å; W184-I305 HydrophobicContact CZ3-CB 4.13Å; W184-I305 HydrophobicContact CZ3-CD1 4.2Å; W184-I305 HydrophobicContact CZ3-CG1 3.95Å; W184-I305 HydrophobicContact CZ3-CG2 4.36Å; F300-I305 HydrophobicContact CD2-CD1 4.18Å; F300-I305 HydrophobicContact CE2-CD1 4.49Å; N301-I305 WeakPolarHBondContact O-CB 3.41Å; N301-I305 PolarHBondContact O-N 3.32Å; I305-V308 PolarHBondContact O-N 3.01Å; I305-W309 PolarHBondContact O-N 3.12Å; I305-F351 HydrophobicContact CD1-CE2 3.54Å; I305-F351 HydrophobicContact CD1-CZ 3.7Å; I305-F351 HydrophobicContact CG1-CE2 4.26Å; I305-F351 HydrophobicContact CG1-CZ 3.89Å; I305-L355 HydrophobicContact CD1-CD2 4.05Å; I305-L355 HydrophobicContact CG1-CD2 3.93Å; I305-I395 HydrophobicContact CG1-CG1 4.34Å; I305-I395 HydrophobicContact CG1-CG2 4.47Å; I305-I395 HydrophobicContact CG2-CB 4.24Å; I305-I395 HydrophobicContact CG2-CG1 4.41Å; I305-I395 HydrophobicContact CG2-CG2 4.3Å
306	S	97.6	Very high	97.6	Very high	70 Å²	70	25.9 Å²	25.9	49%	0.49	14%	0.139	S	C	.	.	H	α-helix	trans	-66.6	-37.3	174.9	58.1	0	0	0	0	112.7	N304 W309 Q310	N304-S306 PolarHBondContact O-N 2.91Å; N304-S306 VanDerWaalsContact O-N 3.12Å; S306-W309 PolarHBondContact O-N 2.86Å; S306-Q310 WeakPolarHBondContact O-CB 3.3Å; S306-Q310 PolarHBondContact O-N 3.31Å
307	M	97.5	Very high	97.5	Very high	63 Å²	63	31.8 Å²	31.8	31%	0.31	16%	0.164	S	C	.	.	H	α-helix	trans	-69.2	-41.3	174.9	-61.6	177.4	71.4	0	0	110.8	S280 N304 W309 Q310 N311	S280-M307 VanDerWaalsContact CB-CE 3.49Å; N304-M307 HydrophobicContact CB-SD 4.46Å; N304-M307 WeakPolarHBondContact O-CA 3.46Å; N304-M307 WeakPolarHBondContact O-CB 3.4Å; N304-M307 PolarHBondContact O-N 3.01Å; M307-W309 VanDerWaalsContact C-N 3.33Å; M307-W309 PolarHBondContact O-N 3.43Å; M307-Q310 PolarHBondContact O-N 3.02Å; M307-N311 WeakPolarHBondContact O-CB 3.34Å; M307-N311 VanDerWaalsContact O-CG 3.28Å; M307-N311 PolarHBondContact O-N 3.13Å; M307-N311 PolarHBondContact O-ND2 3.48Å
308	V	98.3	Very high	97.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-46.8	174.6	175.9	0	0	0	0	110.8	F216 F300 N304 I305 N311 L312 F351	F216-V308 HydrophobicContact CB-CG1 4.16Å; F216-V308 WeakPolarHBondContact O-CA 3.31Å; F300-V308 HydrophobicContact CB-CG2 3.89Å; F300-V308 HydrophobicContact CD1-CG1 4.32Å; F300-V308 HydrophobicContact CD1-CG2 3.79Å; F300-V308 HydrophobicContact CE1-CG1 4.29Å; F300-V308 HydrophobicContact CG-CG2 3.93Å; N304-V308 PolarHBondContact O-N 3.31Å; I305-V308 PolarHBondContact O-N 3.01Å; V308-N311 PolarHBondContact O-N 2.93Å; V308-L312 WeakPolarHBondContact O-CB 3.37Å; V308-L312 PolarHBondContact O-N 3.25Å; V308-F351 HydrophobicContact CB-CE2 4.41Å; V308-F351 HydrophobicContact CG1-CD2 4.34Å; V308-F351 HydrophobicContact CG1-CE2 3.75Å
309	W	98.1	Very high	97	Very high	8 Å²	8	34.5 Å²	34.5	3%	0.03	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-46.2	174.9	171.7	-122.3	0	0	0	112.6	I305 S306 M307 N311 L312 K313 Y348 F351 I395 L399 D402 I405	I305-W309 PolarHBondContact O-N 3.12Å; S306-W309 PolarHBondContact O-N 2.86Å; M307-W309 VanDerWaalsContact C-N 3.33Å; M307-W309 PolarHBondContact O-N 3.43Å; W309-N311 VanDerWaalsContact C-N 3.29Å; W309-N311 PolarHBondContact O-N 3.49Å; W309-L312 HydrophobicContact CE3-CB 4.45Å; W309-L312 HydrophobicContact CE3-CD2 4.07Å; W309-L312 HydrophobicContact CZ3-CD2 4.08Å; W309-L312 PolarHBondContact O-N 2.83Å; W309-K313 WeakPolarHBondContact O-CB 3.36Å; W309-K313 PolarHBondContact O-N 2.9Å; W309-Y348 HydrophobicContact CH2-CD1 4.22Å; W309-Y348 HydrophobicContact CH2-CD2 4.22Å; W309-Y348 AromaticContact CH2-CE1 3.72Å; W309-Y348 HydrophobicContact CH2-CE1 3.72Å; W309-Y348 AromaticContact CH2-CE2 3.71Å; W309-Y348 HydrophobicContact CH2-CE2 3.71Å; W309-Y348 HydrophobicContact CH2-CG 4.42Å; W309-Y348 AromaticContact CH2-CZ 3.4Å; W309-Y348 AromaticContact CZ3-CD1 3.77Å; W309-Y348 HydrophobicContact CZ3-CD1 3.77Å; W309-Y348 HydrophobicContact CZ3-CD2 4.47Å; W309-Y348 AromaticContact CZ3-CE1 3.52Å; W309-Y348 HydrophobicContact CZ3-CE1 3.52Å; W309-Y348 HydrophobicContact CZ3-CE2 4.25Å; W309-Y348 HydrophobicContact CZ3-CG 4.22Å; W309-Y348 AromaticContact CZ3-CZ 3.75Å; W309-F351 HydrophobicContact CB-CE1 4.06Å; W309-F351 HydrophobicContact CB-CZ 3.92Å; W309-F351 HydrophobicContact CD2-CE1 4.33Å; W309-F351 AromaticContact CE3-CD1 3.91Å; W309-F351 HydrophobicContact CE3-CD1 3.91Å; W309-F351 AromaticContact CE3-CE1 3.83Å; W309-F351 HydrophobicContact CE3-CE1 3.83Å; W309-F351 HydrophobicContact CG-CE1 4.45Å; W309-F351 HydrophobicContact CZ3-CD1 4.41Å; W309-I395 HydrophobicContact CB-CD1 3.76Å; W309-I395 HydrophobicContact CG-CD1 3.91Å; W309-L399 HydrophobicContact CD2-CD1 4.25Å; W309-L399 HydrophobicContact CD2-CG 4.42Å; W309-L399 HydrophobicContact CG-CD1 4.46Å; W309-L399 HydrophobicContact CH2-CG 4.38Å; W309-L399 HydrophobicContact CZ2-CG 4.24Å; W309-D402 HydrophobicContact CZ2-CB 4.18Å; W309-I405 HydrophobicContact CH2-CD1 3.97Å; W309-I405 HydrophobicContact CH2-CG1 3.99Å; W309-I405 HydrophobicContact CZ2-CG1 4.35Å
310	Q	97.2	Very high	96.8	Very high	87 Å²	87	36.4 Å²	36.4	41%	0.407	20%	0.199	S	C	.	.	H	α-helix	trans	-61	-39.6	178.9	-174.9	57.8	59.9	0	0	111.8	S306 M307 N314	S306-Q310 WeakPolarHBondContact O-CB 3.3Å; S306-Q310 PolarHBondContact O-N 3.31Å; M307-Q310 PolarHBondContact O-N 3.02Å; Q310-N314 PolarHBondContact NE2-ND2 3.11Å; Q310-N314 PolarHBondContact NE2-OD1 3.33Å; Q310-N314 WeakPolarHBondContact O-CB 3.36Å; Q310-N314 PolarHBondContact O-N 3.3Å; Q310-N314 PolarHBondContact O-ND2 3.38Å
311	N	97.1	Very high	96.5	Very high	47 Å²	47	41.1 Å²	41.1	25%	0.251	22%	0.224	S	C	.	.	H	α-helix	trans	-67	-43.4	175.6	-70.5	-25.1	0	0	0	111.9	F216 G217 M307 V308 W309 K313 N314 N315 F344	F216-N311 PolarHBondContact O-ND2 3.09Å; G217-N311 VanDerWaalsContact CA-ND2 3.34Å; G217-N311 WeakPolarHBondContact CA-ND2 3.28Å; M307-N311 WeakPolarHBondContact O-CB 3.34Å; M307-N311 VanDerWaalsContact O-CG 3.28Å; M307-N311 PolarHBondContact O-N 3.13Å; M307-N311 PolarHBondContact O-ND2 3.48Å; V308-N311 PolarHBondContact O-N 2.93Å; W309-N311 VanDerWaalsContact C-N 3.29Å; W309-N311 PolarHBondContact O-N 3.49Å; N311-K313 VanDerWaalsContact C-N 3.34Å; N311-K313 PolarHBondContact O-N 3.36Å; N311-N314 PolarHBondContact O-N 3.19Å; N311-N315 WeakPolarHBondContact O-CB 3.49Å; N311-N315 PolarHBondContact O-N 3.46Å; N311-N315 PolarHBondContact O-ND2 3.45Å; N311-F344 HydrophobicContact CB-CE2 4.47Å; N311-F344 HydrophobicContact CB-CZ 3.9Å
312	L	97.5	Very high	96.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-46.3	176.4	-176.2	61	0	0	0	111.2	V308 W309 N315 L316 L340 F344 I346 Y348 F351	V308-L312 WeakPolarHBondContact O-CB 3.37Å; V308-L312 PolarHBondContact O-N 3.25Å; W309-L312 HydrophobicContact CE3-CB 4.45Å; W309-L312 HydrophobicContact CE3-CD2 4.07Å; W309-L312 HydrophobicContact CZ3-CD2 4.08Å; W309-L312 PolarHBondContact O-N 2.83Å; L312-N315 PolarHBondContact O-N 3.14Å; L312-L316 PolarHBondContact O-N 2.89Å; L312-L340 HydrophobicContact CD1-CD1 4.16Å; L312-L340 HydrophobicContact CD1-CD2 3.72Å; L312-L340 HydrophobicContact CD1-CG 4.09Å; L312-L340 HydrophobicContact CG-CD2 4.45Å; L312-F344 HydrophobicContact CB-CE1 3.91Å; L312-F344 HydrophobicContact CD1-CD1 3.45Å; L312-F344 VanDerWaalsContact CD1-CD1 3.45Å; L312-F344 HydrophobicContact CD1-CE1 3.58Å; L312-F344 HydrophobicContact CG-CE1 4.36Å; L312-I346 HydrophobicContact CD1-CG1 4.03Å; L312-I346 WeakPolarHBondContact CD1-O 3.34Å; L312-Y348 HydrophobicContact CD1-CD1 4.48Å; L312-Y348 HydrophobicContact CD2-CD1 3.78Å; L312-Y348 HydrophobicContact CD2-CE1 4.21Å; L312-Y348 HydrophobicContact CG-CD1 3.81Å; L312-Y348 HydrophobicContact CG-CE1 3.86Å; L312-F351 HydrophobicContact CD2-CB 3.62Å; L312-F351 HydrophobicContact CD2-CD1 4.28Å; L312-F351 HydrophobicContact CD2-CD2 4.24Å; L312-F351 HydrophobicContact CD2-CG 3.8Å
313	K	96.2	Very high	95.9	Very high	68 Å²	68	49.5 Å²	49.5	30%	0.296	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-44.3	176	179.3	175.3	177.3	169.5	0	112.7	W309 N311 N315 L316 K317 D402	W309-K313 WeakPolarHBondContact O-CB 3.36Å; W309-K313 PolarHBondContact O-N 2.9Å; N311-K313 VanDerWaalsContact C-N 3.34Å; N311-K313 PolarHBondContact O-N 3.36Å; K313-N315 VanDerWaalsContact C-N 3.32Å; K313-N315 PolarHBondContact O-N 2.74Å; K313-L316 PolarHBondContact O-N 2.68Å; K313-K317 PolarHBondContact O-N 2.92Å; K313-D402 WeakPolarHBondContact CD-OD2 3.47Å; K313-D402 VanDerWaalsContact CE-OD2 3.24Å; K313-D402 WeakPolarHBondContact CE-OD2 3.39Å; K313-D402 IonicContact NZ-OD2 2.68Å; K313-D402 PolarHBondContact NZ-OD2 3.28Å
314	N	95.6	Very high	95.6	Very high	78 Å²	78	51.5 Å²	51.5	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-40.4	177.4	-73.3	-16.5	0	0	0	111.5	Q310 N311 K317 A318	Q310-N314 PolarHBondContact NE2-ND2 3.11Å; Q310-N314 PolarHBondContact NE2-OD1 3.33Å; Q310-N314 WeakPolarHBondContact O-CB 3.36Å; Q310-N314 PolarHBondContact O-N 3.3Å; Q310-N314 PolarHBondContact O-ND2 3.38Å; N311-N314 PolarHBondContact O-N 3.19Å; N314-K317 PolarHBondContact O-N 3.09Å; N314-A318 PolarHBondContact O-N 3.32Å
315	N	96.1	Very high	95.3	Very high	55 Å²	55	58 Å²	58	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-39.7	176.7	-81.5	-87.6	0	0	0	112.1	N311 L312 K313 K317 A318 V319 L340 F344	N311-N315 WeakPolarHBondContact O-CB 3.49Å; N311-N315 PolarHBondContact O-N 3.46Å; N311-N315 PolarHBondContact O-ND2 3.45Å; L312-N315 PolarHBondContact O-N 3.14Å; K313-N315 VanDerWaalsContact C-N 3.32Å; K313-N315 PolarHBondContact O-N 2.74Å; N315-K317 VanDerWaalsContact C-N 3.3Å; N315-K317 PolarHBondContact O-N 3.33Å; N315-A318 WeakPolarHBondContact O-CB 2.92Å; N315-A318 PolarHBondContact O-N 3.44Å; N315-A318 VanDerWaalsContact O-N 3.17Å; N315-V319 WeakPolarHBondContact O-CG2 3.3Å; N315-V319 PolarHBondContact O-N 2.95Å; N315-L340 HydrophobicContact CB-CD1 3.66Å; N315-F344 HydrophobicContact CB-CB 4.41Å; N315-F344 HydrophobicContact CB-CD2 3.92Å; N315-F344 HydrophobicContact CB-CE2 4.31Å; N315-F344 HydrophobicContact CB-CG 4.1Å; N315-F344 WeakPolarHBondContact ND2-CD2 3.49Å; N315-F344 WeakPolarHBondContact ND2-CE2 3.4Å
316	L	95.4	Very high	94.9	Very high	12 Å²	12	59.9 Å²	59.9	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-59.3	-44.4	172.8	-178	59.9	0	0	0	110.9	L312 K313 A318 V319 C320 C336 L340 Y348	L312-L316 PolarHBondContact O-N 2.89Å; K313-L316 PolarHBondContact O-N 2.68Å; L316-A318 VanDerWaalsContact C-N 3.31Å; L316-A318 PolarHBondContact O-N 3.24Å; L316-V319 PolarHBondContact O-N 2.79Å; L316-C320 PolarHBondContact O-N 3.46Å; L316-C320 PolarHBondContact O-SG 3.15Å; L316-C336 HydrophobicContact CD1-CB 3.83Å; L316-L340 HydrophobicContact CB-CD1 4.5Å; L316-L340 HydrophobicContact CB-CD2 3.91Å; L316-L340 HydrophobicContact CD1-CB 4.46Å; L316-L340 HydrophobicContact CD1-CD2 4.01Å; L316-L340 HydrophobicContact CG-CD2 4.42Å; L316-Y348 HydrophobicContact CB-CE1 4.18Å; L316-Y348 HydrophobicContact CD2-CD1 4.37Å; L316-Y348 HydrophobicContact CD2-CD2 4.22Å; L316-Y348 HydrophobicContact CD2-CE1 3.71Å; L316-Y348 HydrophobicContact CD2-CE2 3.55Å; L316-Y348 WeakPolarHBondContact CD2-OH 3.35Å
317	K	94.8	Very high	94.5	Very high	138 Å²	138	62.3 Å²	62.3	60%	0.6	33%	0.328	S	S	*	.	H	α-helix	trans	-60.2	-41.4	176.1	-176.5	179.7	178.1	-177.4	0	111.8	K313 N314 N315 C320 N321	K313-K317 PolarHBondContact O-N 2.92Å; N314-K317 PolarHBondContact O-N 3.09Å; N315-K317 VanDerWaalsContact C-N 3.3Å; N315-K317 PolarHBondContact O-N 3.33Å; K317-C320 PolarHBondContact O-N 3.4Å; K317-N321 PolarHBondContact O-N 2.89Å; K317-N321 PolarHBondContact O-ND2 3.1Å
318	A	93.8	Very high	94	Very high	52 Å²	52	67.9 Å²	67.9	43%	0.43	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-46.9	176.6	0	0	0	0	0	111.3	N314 N315 L316 C320 N321 E322	N314-A318 PolarHBondContact O-N 3.32Å; N315-A318 WeakPolarHBondContact O-CB 2.92Å; N315-A318 PolarHBondContact O-N 3.44Å; N315-A318 VanDerWaalsContact O-N 3.17Å; L316-A318 VanDerWaalsContact C-N 3.31Å; L316-A318 PolarHBondContact O-N 3.24Å; A318-C320 PolarHBondContact O-N 2.89Å; A318-N321 PolarHBondContact O-N 3.08Å; A318-E322 PolarHBondContact O-N 2.94Å
319	V	94.4	Very high	93.5	Very high	13 Å²	13	72.6 Å²	72.6	8%	0.079	38%	0.376	C	S	.	.	H	α-helix	trans	-57.4	-50.2	174.7	169.7	0	0	0	0	111	N315 L316 N321 E322 I323 C336 M339	N315-V319 WeakPolarHBondContact O-CG2 3.3Å; N315-V319 PolarHBondContact O-N 2.95Å; L316-V319 PolarHBondContact O-N 2.79Å; V319-N321 VanDerWaalsContact C-N 3.26Å; V319-N321 PolarHBondContact O-N 2.89Å; V319-E322 PolarHBondContact O-N 3.19Å; V319-E322 VanDerWaalsContact O-N 3.17Å; V319-I323 VanDerWaalsContact O-CG1 3.31Å; V319-I323 WeakPolarHBondContact O-CG1 3.5Å; V319-I323 PolarHBondContact O-N 2.96Å; V319-C336 HydrophobicContact CG1-CB 4.1Å; V319-M339 HydrophobicContact CG1-CB 3.67Å; V319-M339 HydrophobicContact CG1-SD 4.36Å
320	C	93.4	Very high	93	Very high	40 Å²	40	79 Å²	79	27%	0.27	41%	0.411	S	S	.	.	H	α-helix	trans	-58.6	-37.3	178.9	-69.9	0	0	0	0	112.9	L316 K317 A318 S324	L316-C320 PolarHBondContact O-N 3.46Å; L316-C320 PolarHBondContact O-SG 3.15Å; K317-C320 PolarHBondContact O-N 3.4Å; A318-C320 PolarHBondContact O-N 2.89Å; C320-S324 WeakPolarHBondContact O-CA 3.48Å; C320-S324 WeakPolarHBondContact O-CB 3.23Å; C320-S324 PolarHBondContact O-N 2.72Å
321	N	93.3	Very high	92.4	Very high	100 Å²	100	80.7 Å²	80.7	54%	0.535	42%	0.423	S	S	.	.	H	α-helix	trans	-70	-42.4	177.4	-69.8	-18.8	0	0	0	111.6	K317 A318 V319 I323 S324	K317-N321 PolarHBondContact O-N 2.89Å; K317-N321 PolarHBondContact O-ND2 3.1Å; A318-N321 PolarHBondContact O-N 3.08Å; V319-N321 VanDerWaalsContact C-N 3.26Å; V319-N321 PolarHBondContact O-N 2.89Å; N321-I323 VanDerWaalsContact C-N 3.32Å; N321-I323 PolarHBondContact O-N 3.01Å; N321-S324 WeakPolarHBondContact O-CB 3.48Å; N321-S324 PolarHBondContact O-N 3.42Å; N321-S324 PolarHBondContact O-OG 3.08Å
322	E	92.4	Very high	92.1	Very high	154 Å²	154	80 Å²	80	72%	0.72	42%	0.418	S	S	*	.	H	α-helix	trans	-61.4	-39.4	-177.6	-169.8	62	-157.8	0	0	112.2	A318 V319	A318-E322 PolarHBondContact O-N 2.94Å; V319-E322 PolarHBondContact O-N 3.19Å; V319-E322 VanDerWaalsContact O-N 3.17Å
323	I	90.8	Very high	91.6	Very high	29 Å²	29	82.8 Å²	82.8	15%	0.149	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	22.6	179.3	60.6	158.2	0	0	0	113.2	V319 N321 D325 C326 F332 M339	V319-I323 VanDerWaalsContact O-CG1 3.31Å; V319-I323 WeakPolarHBondContact O-CG1 3.5Å; V319-I323 PolarHBondContact O-N 2.96Å; N321-I323 VanDerWaalsContact C-N 3.32Å; N321-I323 PolarHBondContact O-N 3.01Å; I323-D325 PolarHBondContact O-N 3.35Å; I323-C326 WeakPolarHBondContact O-CA 3.39Å; I323-C326 WeakPolarHBondContact O-CB 3.14Å; I323-C326 PolarHBondContact O-N 3.4Å; I323-F332 HydrophobicContact CB-CE2 4.45Å; I323-F332 HydrophobicContact CD1-CD2 4.21Å; I323-F332 HydrophobicContact CD1-CE2 3.57Å; I323-F332 HydrophobicContact CD1-CZ 4.14Å; I323-F332 HydrophobicContact CG1-CE2 3.73Å; I323-F332 HydrophobicContact CG1-CZ 4.02Å; I323-F332 VanDerWaalsContact O-CE2 3.27Å; I323-F332 WeakPolarHBondContact O-CE2 3.39Å; I323-M339 HydrophobicContact CD1-SD 3.77Å; I323-M339 HydrophobicContact CG1-SD 4.36Å; I323-M339 HydrophobicContact CG2-CE 3.76Å; I323-M339 HydrophobicContact CG2-SD 3.82Å
324	S	91.8	Very high	91.3	Very high	63 Å²	63	81.4 Å²	81.4	44%	0.441	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-63.7	-24.2	-174.6	57.7	0	0	0	0	114	C320 N321 C326 Q327	C320-S324 WeakPolarHBondContact O-CA 3.48Å; C320-S324 WeakPolarHBondContact O-CB 3.23Å; C320-S324 PolarHBondContact O-N 2.72Å; N321-S324 WeakPolarHBondContact O-CB 3.48Å; N321-S324 PolarHBondContact O-N 3.42Å; N321-S324 PolarHBondContact O-OG 3.08Å; S324-C326 PolarHBondContact O-N 2.96Å; S324-Q327 VanDerWaalsContact O-CB 3.28Å; S324-Q327 WeakPolarHBondContact O-CB 3.45Å; S324-Q327 PolarHBondContact O-N 2.82Å
325	D	92.2	Very high	91.1	Very high	136 Å²	136	81.9 Å²	81.9	73%	0.727	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-64	-24.1	171.9	63.5	-35.8	0	0	0	112.8	I323	I323-D325 PolarHBondContact O-N 3.35Å
326	C	89.2	Confident	91	Very high	44 Å²	44	79.3 Å²	79.3	30%	0.297	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-92.2	8.2	176.2	-68.8	0	0	0	0	114.2	I323 S324 Q328 M329	I323-C326 WeakPolarHBondContact O-CA 3.39Å; I323-C326 WeakPolarHBondContact O-CB 3.14Å; I323-C326 PolarHBondContact O-N 3.4Å; S324-C326 PolarHBondContact O-N 2.96Å; C326-Q328 PolarHBondContact O-N 3.02Å; C326-M329 HydrophobicContact CB-CG 4.25Å; C326-M329 HydrophobicContact CB-SD 3.59Å; C326-M329 VanDerWaalsContact CB-SD 3.59Å; C326-M329 VanDerWaalsContact O-CB 3.29Å; C326-M329 WeakPolarHBondContact O-CB 3.44Å; C326-M329 WeakPolarHBondContact O-CG 3.48Å; C326-M329 PolarHBondContact O-N 3.17Å
327	Q	88.6	Confident	91	Very high	122 Å²	122	79 Å²	79	57%	0.57	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23	-173.3	-170.2	178.4	6.8	0	0	114.7	S324 M329 F332	S324-Q327 VanDerWaalsContact O-CB 3.28Å; S324-Q327 WeakPolarHBondContact O-CB 3.45Å; S324-Q327 PolarHBondContact O-N 2.82Å; Q327-M329 VanDerWaalsContact C-N 3.27Å; Q327-M329 PolarHBondContact O-N 2.96Å; Q327-F332 HydrophobicContact CB-CE1 4.45Å; Q327-F332 HydrophobicContact CB-CE2 4.35Å; Q327-F332 HydrophobicContact CB-CZ 4.3Å; Q327-F332 HydrophobicContact CG-CD1 4.13Å; Q327-F332 HydrophobicContact CG-CE1 4.11Å; Q327-F332 HydrophobicContact CG-CG 4.49Å; Q327-F332 HydrophobicContact CG-CZ 4.45Å
328	Q	88.1	Confident	91	Very high	179 Å²	179	77 Å²	77	84%	0.836	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-2.7	177.5	-58.7	-58.6	-48	0	0	113.9	C326	C326-Q328 PolarHBondContact O-N 3.02Å
329	M	87.4	Confident	91	Very high	100 Å²	100	78.2 Å²	78.2	49%	0.493	41%	0.413	S	S	.	.	S	Bend	trans	-70.4	143.8	175.7	-70.8	177.5	60	0	0	111.4	C326 Q327 N331 F332	C326-M329 HydrophobicContact CB-CG 4.25Å; C326-M329 HydrophobicContact CB-SD 3.59Å; C326-M329 VanDerWaalsContact CB-SD 3.59Å; C326-M329 VanDerWaalsContact O-CB 3.29Å; C326-M329 WeakPolarHBondContact O-CB 3.44Å; C326-M329 WeakPolarHBondContact O-CG 3.48Å; C326-M329 PolarHBondContact O-N 3.17Å; Q327-M329 VanDerWaalsContact C-N 3.27Å; Q327-M329 PolarHBondContact O-N 2.96Å; M329-N331 PolarHBondContact O-N 3.06Å; M329-F332 PolarHBondContact O-N 3.07Å
330	D	87.2	Confident	91.1	Very high	143 Å²	143	77.6 Å²	77.6	77%	0.765	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	139.7	170.5	-67.2	-30.4	0	0	0	110.4	F332 H335	D330-F332 PolarHBondContact O-N 3.14Å; D330-H335 PolarHBondContact O-CE1 3.37Å
331	N	86.3	Confident	91.1	Very high	121 Å²	121	81.5 Å²	81.5	65%	0.647	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	30.6	179.5	-51.7	-47.2	0	0	0	114.1	M329 E333 A334 H335	M329-N331 PolarHBondContact O-N 3.06Å; N331-E333 PolarHBondContact O-N 3.42Å; N331-E333 VanDerWaalsContact O-N 3.16Å; N331-A334 HydrophobicContact CB-CB 4.11Å; N331-A334 WeakPolarHBondContact O-CB 3.27Å; N331-A334 PolarHBondContact O-N 2.88Å; N331-H335 PolarHBondContact O-N 2.92Å; N331-H335 VanDerWaalsContact O-N 3.11Å; N331-H335 PolarHBondContact O-ND1 2.93Å
332	F	89	Confident	91.1	Very high	34 Å²	34	81 Å²	81	15%	0.149	43%	0.429	C	S	.	.	H	α-helix	trans	-45.1	-46.6	178.1	178	-106.5	0	0	0	113.1	I323 Q327 M329 D330 A334 H335 C336	I323-F332 HydrophobicContact CB-CE2 4.45Å; I323-F332 HydrophobicContact CD1-CD2 4.21Å; I323-F332 HydrophobicContact CD1-CE2 3.57Å; I323-F332 HydrophobicContact CD1-CZ 4.14Å; I323-F332 HydrophobicContact CG1-CE2 3.73Å; I323-F332 HydrophobicContact CG1-CZ 4.02Å; I323-F332 VanDerWaalsContact O-CE2 3.27Å; I323-F332 WeakPolarHBondContact O-CE2 3.39Å; Q327-F332 HydrophobicContact CB-CE1 4.45Å; Q327-F332 HydrophobicContact CB-CE2 4.35Å; Q327-F332 HydrophobicContact CB-CZ 4.3Å; Q327-F332 HydrophobicContact CG-CD1 4.13Å; Q327-F332 HydrophobicContact CG-CE1 4.11Å; Q327-F332 HydrophobicContact CG-CG 4.49Å; Q327-F332 HydrophobicContact CG-CZ 4.45Å; M329-F332 PolarHBondContact O-N 3.07Å; D330-F332 PolarHBondContact O-N 3.14Å; F332-A334 PolarHBondContact O-N 3.42Å; F332-H335 WeakPolarHBondContact O-CB 3.24Å; F332-H335 PolarHBondContact O-N 2.96Å; F332-H335 VanDerWaalsContact O-N 3.13Å; F332-C336 VanDerWaalsContact CE1-SG 3.59Å; F332-C336 PolarHBondContact O-N 2.97Å; F332-C336 PolarHBondContact O-SG 2.89Å; F332-C336 VanDerWaalsContact O-SG 3.36Å
333	E	88.6	Confident	91.1	Very high	57 Å²	57	77.9 Å²	77.9	27%	0.266	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-40.3	179.1	-170.2	-177.6	150.7	0	0	113.2	N331 H335 C336 Q337 S408 P409	N331-E333 PolarHBondContact O-N 3.42Å; N331-E333 VanDerWaalsContact O-N 3.16Å; E333-H335 VanDerWaalsContact C-N 3.26Å; E333-H335 PolarHBondContact O-N 2.94Å; E333-C336 WeakPolarHBondContact O-CB 3.46Å; E333-C336 PolarHBondContact O-N 3.45Å; E333-C336 VanDerWaalsContact O-N 3.15Å; E333-Q337 WeakPolarHBondContact O-CG 3.08Å; E333-Q337 PolarHBondContact O-N 3.41Å; E333-S408 VanDerWaalsContact OE1-CA 3.27Å; E333-S408 WeakPolarHBondContact OE1-CA 3.35Å; E333-S408 VanDerWaalsContact OE1-CB 3.26Å; E333-S408 WeakPolarHBondContact OE1-CB 3.48Å; E333-S408 PolarHBondContact OE1-OG 2.89Å; E333-P409 VanDerWaalsContact OE1-CD 3.3Å; E333-P409 WeakPolarHBondContact OE1-CD 3.01Å; E333-P409 WeakPolarHBondContact OE2-CD 3.3Å
334	A	90	Very high	91.2	Very high	39 Å²	39	77.8 Å²	77.8	32%	0.322	42%	0.422	S	S	.	.	H	α-helix	trans	-65.1	-33.6	176.8	0	0	0	0	0	111.6	N331 F332 Q337 T338	N331-A334 HydrophobicContact CB-CB 4.11Å; N331-A334 WeakPolarHBondContact O-CB 3.27Å; N331-A334 PolarHBondContact O-N 2.88Å; F332-A334 PolarHBondContact O-N 3.42Å; A334-Q337 PolarHBondContact O-N 3.06Å; A334-T338 WeakPolarHBondContact O-CB 3.03Å; A334-T338 PolarHBondContact O-N 3.41Å; A334-T338 PolarHBondContact O-OG1 3.31Å
335	H	91.4	Very high	91.3	Very high	88 Å²	88	76.5 Å²	76.5	41%	0.407	42%	0.418	S	S	.	.	H	α-helix	trans	-66.8	-43.4	171.6	-66.6	89	0	0	0	111.2	D330 N331 F332 E333 Q337 T338 M339	D330-H335 PolarHBondContact O-CE1 3.37Å; N331-H335 PolarHBondContact O-N 2.92Å; N331-H335 VanDerWaalsContact O-N 3.11Å; N331-H335 PolarHBondContact O-ND1 2.93Å; F332-H335 WeakPolarHBondContact O-CB 3.24Å; F332-H335 PolarHBondContact O-N 2.96Å; F332-H335 VanDerWaalsContact O-N 3.13Å; E333-H335 VanDerWaalsContact C-N 3.26Å; E333-H335 PolarHBondContact O-N 2.94Å; H335-Q337 VanDerWaalsContact C-N 3.33Å; H335-Q337 PolarHBondContact O-N 2.93Å; H335-T338 WeakPolarHBondContact O-CB 3.36Å; H335-T338 PolarHBondContact O-N 3.12Å; H335-T338 VanDerWaalsContact O-N 3.17Å; H335-M339 WeakPolarHBondContact O-CG 3.4Å; H335-M339 PolarHBondContact O-N 2.94Å
336	C	93.9	Very high	91.5	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.007	39%	0.389	C	S	.	.	H	α-helix	trans	-57.7	-44.4	173.7	-63.4	0	0	0	0	112	L316 V319 F332 E333 T338 M339 L340	L316-C336 HydrophobicContact CD1-CB 3.83Å; V319-C336 HydrophobicContact CG1-CB 4.1Å; F332-C336 VanDerWaalsContact CE1-SG 3.59Å; F332-C336 PolarHBondContact O-N 2.97Å; F332-C336 PolarHBondContact O-SG 2.89Å; F332-C336 VanDerWaalsContact O-SG 3.36Å; E333-C336 WeakPolarHBondContact O-CB 3.46Å; E333-C336 PolarHBondContact O-N 3.45Å; E333-C336 VanDerWaalsContact O-N 3.15Å; C336-T338 VanDerWaalsContact C-N 3.34Å; C336-T338 PolarHBondContact O-N 3.2Å; C336-M339 PolarHBondContact O-N 2.99Å; C336-L340 VanDerWaalsContact O-CB 3.24Å; C336-L340 WeakPolarHBondContact O-CB 3.02Å; C336-L340 PolarHBondContact O-N 2.73Å
337	Q	94.4	Very high	91.9	Very high	6 Å²	6	69.7 Å²	69.7	3%	0.028	38%	0.379	C	S	.	.	H	α-helix	trans	-65.6	-36.1	177.3	-66.8	-68.5	-16.5	0	0	112.3	E333 A334 H335 R341 N347 Y348	E333-Q337 WeakPolarHBondContact O-CG 3.08Å; E333-Q337 PolarHBondContact O-N 3.41Å; A334-Q337 PolarHBondContact O-N 3.06Å; H335-Q337 VanDerWaalsContact C-N 3.33Å; H335-Q337 PolarHBondContact O-N 2.93Å; Q337-R341 WeakPolarHBondContact O-CB 3.31Å; Q337-R341 PolarHBondContact O-N 3.43Å; Q337-N347 HydrophobicContact CB-CB 4.45Å; Q337-N347 WeakPolarHBondContact O-CB 3.37Å; Q337-Y348 VanDerWaalsContact OE1-N 3.15Å
338	T	94.3	Very high	92.3	Very high	95 Å²	95	64 Å²	64	58%	0.583	35%	0.352	S	S	*	.	H	α-helix	trans	-66.6	-46.1	175.3	-58.9	0	0	0	0	111.1	A334 H335 C336 R341 A342	A334-T338 WeakPolarHBondContact O-CB 3.03Å; A334-T338 PolarHBondContact O-N 3.41Å; A334-T338 PolarHBondContact O-OG1 3.31Å; H335-T338 WeakPolarHBondContact O-CB 3.36Å; H335-T338 PolarHBondContact O-N 3.12Å; H335-T338 VanDerWaalsContact O-N 3.17Å; C336-T338 VanDerWaalsContact C-N 3.34Å; C336-T338 PolarHBondContact O-N 3.2Å; T338-R341 PolarHBondContact O-N 3.19Å; T338-A342 PolarHBondContact O-N 3.38Å
339	M	94	Very high	92.7	Very high	78 Å²	78	57.6 Å²	57.6	38%	0.384	32%	0.324	S	S	.	.	H	α-helix	trans	-65.1	-41.4	176.8	-73.5	-177.2	69.1	0	0	111.8	V319 I323 H335 C336 R341 A342 S343	V319-M339 HydrophobicContact CG1-CB 3.67Å; V319-M339 HydrophobicContact CG1-SD 4.36Å; I323-M339 HydrophobicContact CD1-SD 3.77Å; I323-M339 HydrophobicContact CG1-SD 4.36Å; I323-M339 HydrophobicContact CG2-CE 3.76Å; I323-M339 HydrophobicContact CG2-SD 3.82Å; H335-M339 WeakPolarHBondContact O-CG 3.4Å; H335-M339 PolarHBondContact O-N 2.94Å; C336-M339 PolarHBondContact O-N 2.99Å; M339-R341 PolarHBondContact O-N 2.99Å; M339-A342 PolarHBondContact O-N 3.47Å; M339-A342 VanDerWaalsContact O-N 3.15Å; M339-S343 WeakPolarHBondContact O-CB 3.45Å; M339-S343 PolarHBondContact O-N 3.23Å; M339-S343 PolarHBondContact O-OG 3.07Å
340	L	95.8	Very high	93.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-57.9	-48.2	174.3	178.5	64.9	0	0	0	111.2	L312 N315 L316 C336 A342 S343 F344 N347 Y348	L312-L340 HydrophobicContact CD1-CD1 4.16Å; L312-L340 HydrophobicContact CD1-CD2 3.72Å; L312-L340 HydrophobicContact CD1-CG 4.09Å; L312-L340 HydrophobicContact CG-CD2 4.45Å; N315-L340 HydrophobicContact CB-CD1 3.66Å; L316-L340 HydrophobicContact CB-CD1 4.5Å; L316-L340 HydrophobicContact CB-CD2 3.91Å; L316-L340 HydrophobicContact CD1-CB 4.46Å; L316-L340 HydrophobicContact CD1-CD2 4.01Å; L316-L340 HydrophobicContact CG-CD2 4.42Å; C336-L340 VanDerWaalsContact O-CB 3.24Å; C336-L340 WeakPolarHBondContact O-CB 3.02Å; C336-L340 PolarHBondContact O-N 2.73Å; L340-A342 VanDerWaalsContact C-N 3.26Å; L340-A342 PolarHBondContact O-N 2.65Å; L340-S343 PolarHBondContact O-N 3.24Å; L340-F344 HydrophobicContact CD1-CB 3.76Å; L340-F344 HydrophobicContact CD1-CD1 4.4Å; L340-F344 HydrophobicContact CD1-CG 4.28Å; L340-F344 HydrophobicContact CG-CB 4.48Å; L340-F344 WeakPolarHBondContact O-CA 3.28Å; L340-F344 VanDerWaalsContact O-CB 3.24Å; L340-F344 WeakPolarHBondContact O-CB 3.31Å; L340-F344 PolarHBondContact O-N 3.19Å; L340-N347 HydrophobicContact CD2-CB 4.39Å; L340-Y348 HydrophobicContact CD2-CD1 4.18Å; L340-Y348 HydrophobicContact CD2-CE1 4.41Å
341	R	95.3	Very high	93.6	Very high	123 Å²	123	47.1 Å²	47.1	46%	0.464	27%	0.269	S	S	.	.	H	α-helix	trans	-57.8	-41.9	175.7	-169.3	176.4	177.7	131.1	4.6	111.7	Q337 T338 M339 G345 N347 D350	Q337-R341 WeakPolarHBondContact O-CB 3.31Å; Q337-R341 PolarHBondContact O-N 3.43Å; T338-R341 PolarHBondContact O-N 3.19Å; M339-R341 PolarHBondContact O-N 2.99Å; R341-G345 CarbonylContact O-C 3.33Å; R341-G345 WeakPolarHBondContact O-CA 3.5Å; R341-G345 PolarHBondContact O-N 3.24Å; R341-N347 HydrophobicContact CB-CB 4.06Å; R341-D350 IonicContact CZ-OD1 3.55Å; R341-D350 VanDerWaalsContact CZ-OD1 3.28Å; R341-D350 IonicContact CZ-OD2 3.24Å; R341-D350 VanDerWaalsContact CZ-OD2 3.29Å; R341-D350 IonicContact NE-OD2 2.67Å; R341-D350 IonicContact NH1-OD1 3.81Å; R341-D350 PolarHBondContact NH1-OD1 3.42Å; R341-D350 IonicContact NH1-OD2 2.8Å; R341-D350 PolarHBondContact NH1-OD2 3.19Å; R341-D350 IonicContact NH2-OD1 3.61Å; R341-D350 PolarHBondContact NH2-OD1 2.93Å; R341-D350 IonicContact NH2-OD2 2.99Å
342	A	93.2	Very high	94.2	Very high	90 Å²	90	41.4 Å²	41.4	74%	0.744	24%	0.239	S	C	*	.	H	α-helix	trans	-72.3	-37.7	-178.4	0	0	0	0	0	113.5	T338 M339 L340	T338-A342 PolarHBondContact O-N 3.38Å; M339-A342 PolarHBondContact O-N 3.47Å; M339-A342 VanDerWaalsContact O-N 3.15Å; L340-A342 VanDerWaalsContact C-N 3.26Å; L340-A342 PolarHBondContact O-N 2.65Å
343	S	91.8	Very high	94.6	Very high	87 Å²	87	42.6 Å²	42.6	61%	0.608	25%	0.245	S	C	*	.	H	α-helix	trans	-90.3	-36.5	-175.7	64.6	0	0	0	0	113.6	M339 L340	M339-S343 WeakPolarHBondContact O-CB 3.45Å; M339-S343 PolarHBondContact O-N 3.23Å; M339-S343 PolarHBondContact O-OG 3.07Å; L340-S343 PolarHBondContact O-N 3.24Å
344	F	93.5	Very high	95.1	Very high	28 Å²	28	40.1 Å²	40.1	12%	0.123	23%	0.233	C	C	.	.	H	α-helix	trans	-100.5	-26.5	-176.7	-168.7	-115.4	0	0	0	112.8	F216 N311 L312 N315 L340 I346	F216-F344 HydrophobicContact CB-CE1 4.49Å; F216-F344 HydrophobicContact CB-CZ 4.33Å; F216-F344 AromaticContact CD1-CD1 3.94Å; F216-F344 HydrophobicContact CD1-CD1 3.94Å; F216-F344 AromaticContact CD1-CE1 3.7Å; F216-F344 HydrophobicContact CD1-CE1 3.7Å; F216-F344 HydrophobicContact CD1-CZ 4.1Å; F216-F344 HydrophobicContact CE1-CD1 4.36Å; F216-F344 WeakPolarHBondContact CE1-O 3.3Å; N311-F344 HydrophobicContact CB-CE2 4.47Å; N311-F344 HydrophobicContact CB-CZ 3.9Å; L312-F344 HydrophobicContact CB-CE1 3.91Å; L312-F344 HydrophobicContact CD1-CD1 3.45Å; L312-F344 VanDerWaalsContact CD1-CD1 3.45Å; L312-F344 HydrophobicContact CD1-CE1 3.58Å; L312-F344 HydrophobicContact CG-CE1 4.36Å; N315-F344 HydrophobicContact CB-CB 4.41Å; N315-F344 HydrophobicContact CB-CD2 3.92Å; N315-F344 HydrophobicContact CB-CE2 4.31Å; N315-F344 HydrophobicContact CB-CG 4.1Å; N315-F344 WeakPolarHBondContact ND2-CD2 3.49Å; N315-F344 WeakPolarHBondContact ND2-CE2 3.4Å; L340-F344 HydrophobicContact CD1-CB 3.76Å; L340-F344 HydrophobicContact CD1-CD1 4.4Å; L340-F344 HydrophobicContact CD1-CG 4.28Å; L340-F344 HydrophobicContact CG-CB 4.48Å; L340-F344 WeakPolarHBondContact O-CA 3.28Å; L340-F344 VanDerWaalsContact O-CB 3.24Å; L340-F344 WeakPolarHBondContact O-CB 3.31Å; L340-F344 PolarHBondContact O-N 3.19Å; F344-I346 HydrophobicContact CD1-CG1 4.14Å; F344-I346 HydrophobicContact CE1-CG1 4.36Å
345	G	93.7	Very high	95.5	Very high	35 Å²	35	38.3 Å²	38.3	36%	0.361	22%	0.218	S	C	.	.	S	Bend	trans	110.2	-26	176	0	0	0	0	0	114.5	R341	R341-G345 CarbonylContact O-C 3.33Å; R341-G345 WeakPolarHBondContact O-CA 3.5Å; R341-G345 PolarHBondContact O-N 3.24Å
346	I	96.1	Very high	95.8	Very high	23 Å²	23	36 Å²	36	12%	0.118	21%	0.207	C	C	.	.			trans	-138.8	152.8	176.5	62	179.7	0	0	0	109.8	F216 L312 F344 D350 F351	F216-I346 HydrophobicContact CD1-CD1 4Å; F216-I346 HydrophobicContact CD1-CG1 3.97Å; F216-I346 HydrophobicContact CE1-CB 4.26Å; F216-I346 HydrophobicContact CE1-CD1 4.04Å; F216-I346 HydrophobicContact CE1-CG1 3.69Å; F216-I346 HydrophobicContact CE1-CG2 3.96Å; F216-I346 HydrophobicContact CG-CD1 4.43Å; F216-I346 HydrophobicContact CZ-CG1 4.37Å; F216-I346 HydrophobicContact CZ-CG2 3.84Å; L312-I346 HydrophobicContact CD1-CG1 4.03Å; L312-I346 WeakPolarHBondContact CD1-O 3.34Å; F344-I346 HydrophobicContact CD1-CG1 4.14Å; F344-I346 HydrophobicContact CE1-CG1 4.36Å; I346-D350 HydrophobicContact CB-CB 3.99Å; I346-D350 HydrophobicContact CG2-CB 4.28Å; I346-F351 HydrophobicContact CD1-CD2 4.29Å
347	N	96.5	Very high	95.9	Very high	15 Å²	15	37.6 Å²	37.6	8%	0.08	22%	0.215	C	C	.	.			trans	-109.6	-176.7	169.7	70.3	19.7	0	0	0	111.8	Q337 L340 R341 L349 D350 F351	Q337-N347 HydrophobicContact CB-CB 4.45Å; Q337-N347 WeakPolarHBondContact O-CB 3.37Å; L340-N347 HydrophobicContact CD2-CB 4.39Å; R341-N347 HydrophobicContact CB-CB 4.06Å; N347-L349 VanDerWaalsContact C-N 3.28Å; N347-L349 PolarHBondContact O-N 2.96Å; N347-L349 WeakPolarHBondContact OD1-CA 3.12Å; N347-L349 VanDerWaalsContact OD1-CB 3.31Å; N347-L349 WeakPolarHBondContact OD1-CB 3.35Å; N347-L349 PolarHBondContact OD1-N 2.68Å; N347-D350 VanDerWaalsContact CG-OD2 3.31Å; N347-D350 PolarHBondContact N-OD2 3.27Å; N347-D350 VanDerWaalsContact N-OD2 3.09Å; N347-D350 PolarHBondContact O-N 3.33Å; N347-D350 VanDerWaalsContact OD1-CG 3.32Å; N347-D350 PolarHBondContact OD1-N 2.87Å; N347-D350 PolarHBondContact OD1-OD2 2.97Å; N347-F351 PolarHBondContact O-N 3.4Å
348	Y	97.3	Very high	96	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-37	179.9	-77.1	10	0	0	0	112.9	W309 L312 L316 Q337 L340 F351 I352 T404 I405 L412	W309-Y348 HydrophobicContact CH2-CD1 4.22Å; W309-Y348 HydrophobicContact CH2-CD2 4.22Å; W309-Y348 AromaticContact CH2-CE1 3.72Å; W309-Y348 HydrophobicContact CH2-CE1 3.72Å; W309-Y348 AromaticContact CH2-CE2 3.71Å; W309-Y348 HydrophobicContact CH2-CE2 3.71Å; W309-Y348 HydrophobicContact CH2-CG 4.42Å; W309-Y348 AromaticContact CH2-CZ 3.4Å; W309-Y348 AromaticContact CZ3-CD1 3.77Å; W309-Y348 HydrophobicContact CZ3-CD1 3.77Å; W309-Y348 HydrophobicContact CZ3-CD2 4.47Å; W309-Y348 AromaticContact CZ3-CE1 3.52Å; W309-Y348 HydrophobicContact CZ3-CE1 3.52Å; W309-Y348 HydrophobicContact CZ3-CE2 4.25Å; W309-Y348 HydrophobicContact CZ3-CG 4.22Å; W309-Y348 AromaticContact CZ3-CZ 3.75Å; L312-Y348 HydrophobicContact CD1-CD1 4.48Å; L312-Y348 HydrophobicContact CD2-CD1 3.78Å; L312-Y348 HydrophobicContact CD2-CE1 4.21Å; L312-Y348 HydrophobicContact CG-CD1 3.81Å; L312-Y348 HydrophobicContact CG-CE1 3.86Å; L316-Y348 HydrophobicContact CB-CE1 4.18Å; L316-Y348 HydrophobicContact CD2-CD1 4.37Å; L316-Y348 HydrophobicContact CD2-CD2 4.22Å; L316-Y348 HydrophobicContact CD2-CE1 3.71Å; L316-Y348 HydrophobicContact CD2-CE2 3.55Å; L316-Y348 WeakPolarHBondContact CD2-OH 3.35Å; Q337-Y348 VanDerWaalsContact OE1-N 3.15Å; L340-Y348 HydrophobicContact CD2-CD1 4.18Å; L340-Y348 HydrophobicContact CD2-CE1 4.41Å; Y348-F351 PolarHBondContact O-N 3.4Å; Y348-I352 WeakPolarHBondContact O-CG1 3.02Å; Y348-I352 PolarHBondContact O-N 2.89Å; Y348-T404 VanDerWaalsContact CE2-OG1 3.3Å; Y348-T404 WeakPolarHBondContact CE2-OG1 3.28Å; Y348-T404 PolarHBondContact OH-OG1 3.45Å; Y348-I405 HydrophobicContact CD2-CD1 3.44Å; Y348-I405 VanDerWaalsContact CD2-CD1 3.44Å; Y348-I405 HydrophobicContact CD2-CG1 4.42Å; Y348-I405 HydrophobicContact CE2-CD1 3.81Å; Y348-I405 HydrophobicContact CE2-CG1 4.34Å; Y348-I405 HydrophobicContact CG-CD1 4.2Å; Y348-L412 HydrophobicContact CD2-CD1 4.16Å; Y348-L412 HydrophobicContact CG-CD1 4.49Å
349	L	96.5	Very high	96	Very high	46 Å²	46	32.8 Å²	32.8	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-64.8	-47.2	178.5	-176.6	68.6	0	0	0	111.1	N347 F351 I352 E353 L412	N347-L349 VanDerWaalsContact C-N 3.28Å; N347-L349 PolarHBondContact O-N 2.96Å; N347-L349 WeakPolarHBondContact OD1-CA 3.12Å; N347-L349 VanDerWaalsContact OD1-CB 3.31Å; N347-L349 WeakPolarHBondContact OD1-CB 3.35Å; N347-L349 PolarHBondContact OD1-N 2.68Å; L349-F351 VanDerWaalsContact C-N 3.28Å; L349-F351 PolarHBondContact O-N 3.05Å; L349-I352 PolarHBondContact O-N 3.36Å; L349-E353 WeakPolarHBondContact O-CB 3.33Å; L349-E353 WeakPolarHBondContact O-CG 3.46Å; L349-E353 PolarHBondContact O-N 3.09Å; L349-L412 HydrophobicContact CB-CD2 4.48Å; L349-L412 HydrophobicContact CD1-CD2 3.82Å
350	D	96.8	Very high	96	Very high	22 Å²	22	31.5 Å²	31.5	12%	0.118	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-41.9	177	-62.5	-48.2	0	0	0	110.7	R341 I346 N347 E353 L354	R341-D350 IonicContact CZ-OD1 3.55Å; R341-D350 VanDerWaalsContact CZ-OD1 3.28Å; R341-D350 IonicContact CZ-OD2 3.24Å; R341-D350 VanDerWaalsContact CZ-OD2 3.29Å; R341-D350 IonicContact NE-OD2 2.67Å; R341-D350 IonicContact NH1-OD1 3.81Å; R341-D350 PolarHBondContact NH1-OD1 3.42Å; R341-D350 IonicContact NH1-OD2 2.8Å; R341-D350 PolarHBondContact NH1-OD2 3.19Å; R341-D350 IonicContact NH2-OD1 3.61Å; R341-D350 PolarHBondContact NH2-OD1 2.93Å; R341-D350 IonicContact NH2-OD2 2.99Å; I346-D350 HydrophobicContact CB-CB 3.99Å; I346-D350 HydrophobicContact CG2-CB 4.28Å; N347-D350 VanDerWaalsContact CG-OD2 3.31Å; N347-D350 PolarHBondContact N-OD2 3.27Å; N347-D350 VanDerWaalsContact N-OD2 3.09Å; N347-D350 PolarHBondContact O-N 3.33Å; N347-D350 VanDerWaalsContact OD1-CG 3.32Å; N347-D350 PolarHBondContact OD1-N 2.87Å; N347-D350 PolarHBondContact OD1-OD2 2.97Å; D350-E353 PolarHBondContact O-N 3.04Å; D350-L354 WeakPolarHBondContact O-CB 3.38Å; D350-L354 PolarHBondContact O-N 3.04Å
351	F	98.1	Very high	95.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.8	-44	177.4	-172.4	-106.7	0	0	0	112.4	I305 V308 W309 L312 I346 N347 Y348 L349 L354 L355 I395 L399	I305-F351 HydrophobicContact CD1-CE2 3.54Å; I305-F351 HydrophobicContact CD1-CZ 3.7Å; I305-F351 HydrophobicContact CG1-CE2 4.26Å; I305-F351 HydrophobicContact CG1-CZ 3.89Å; V308-F351 HydrophobicContact CB-CE2 4.41Å; V308-F351 HydrophobicContact CG1-CD2 4.34Å; V308-F351 HydrophobicContact CG1-CE2 3.75Å; W309-F351 HydrophobicContact CB-CE1 4.06Å; W309-F351 HydrophobicContact CB-CZ 3.92Å; W309-F351 HydrophobicContact CD2-CE1 4.33Å; W309-F351 AromaticContact CE3-CD1 3.91Å; W309-F351 HydrophobicContact CE3-CD1 3.91Å; W309-F351 AromaticContact CE3-CE1 3.83Å; W309-F351 HydrophobicContact CE3-CE1 3.83Å; W309-F351 HydrophobicContact CG-CE1 4.45Å; W309-F351 HydrophobicContact CZ3-CD1 4.41Å; L312-F351 HydrophobicContact CD2-CB 3.62Å; L312-F351 HydrophobicContact CD2-CD1 4.28Å; L312-F351 HydrophobicContact CD2-CD2 4.24Å; L312-F351 HydrophobicContact CD2-CG 3.8Å; I346-F351 HydrophobicContact CD1-CD2 4.29Å; N347-F351 PolarHBondContact O-N 3.4Å; Y348-F351 PolarHBondContact O-N 3.4Å; L349-F351 VanDerWaalsContact C-N 3.28Å; L349-F351 PolarHBondContact O-N 3.05Å; F351-L354 HydrophobicContact CD2-CD2 4.33Å; F351-L354 WeakPolarHBondContact O-CB 3.44Å; F351-L354 PolarHBondContact O-N 3.14Å; F351-L355 HydrophobicContact CD1-CD1 4.2Å; F351-L355 HydrophobicContact CE1-CD1 3.83Å; F351-L355 HydrophobicContact CE1-CG 4.3Å; F351-L355 HydrophobicContact CZ-CD1 4.43Å; F351-L355 HydrophobicContact CZ-CD2 4.34Å; F351-L355 WeakPolarHBondContact O-CG 3.42Å; F351-L355 PolarHBondContact O-N 3.24Å; F351-L355 VanDerWaalsContact O-N 3.08Å; F351-I395 HydrophobicContact CE1-CG1 4.48Å; F351-L399 HydrophobicContact CD1-CD2 4.19Å; F351-L399 HydrophobicContact CE1-CD1 4.22Å; F351-L399 HydrophobicContact CE1-CD2 4.31Å
352	I	98.3	Very high	95.7	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-42	176.3	-70.1	162.6	0	0	0	110.9	Y348 L349 L354 L355 E356 L399 I405 L412 R415	Y348-I352 WeakPolarHBondContact O-CG1 3.02Å; Y348-I352 PolarHBondContact O-N 2.89Å; L349-I352 PolarHBondContact O-N 3.36Å; I352-L354 VanDerWaalsContact C-N 3.29Å; I352-L354 PolarHBondContact O-N 3.06Å; I352-L355 PolarHBondContact O-N 3.41Å; I352-L355 VanDerWaalsContact O-N 3.15Å; I352-E356 HydrophobicContact CG2-CG 4.3Å; I352-E356 WeakPolarHBondContact O-CG 3.42Å; I352-E356 PolarHBondContact O-N 2.95Å; I352-L399 HydrophobicContact CD1-CD2 4.33Å; I352-L399 HydrophobicContact CG1-CD2 3.75Å; I352-I405 HydrophobicContact CD1-CD1 4.25Å; I352-L412 HydrophobicContact CD1-CB 3.83Å; I352-L412 HydrophobicContact CD1-CD1 4.17Å; I352-L412 HydrophobicContact CD1-CD2 3.99Å; I352-L412 HydrophobicContact CD1-CG 4.21Å; I352-R415 HydrophobicContact CG2-CB 4.02Å
353	E	97.5	Very high	95.6	Very high	59 Å²	59	26.2 Å²	26.2	28%	0.276	15%	0.152	S	C	.	.	H	α-helix	trans	-61.7	-37.2	176.9	-79.9	177.3	-177.6	0	0	112.9	Q188 L349 D350 F357 R415	Q188-E353 PolarHBondContact NE2-O 2.98Å; L349-E353 WeakPolarHBondContact O-CB 3.33Å; L349-E353 WeakPolarHBondContact O-CG 3.46Å; L349-E353 PolarHBondContact O-N 3.09Å; D350-E353 PolarHBondContact O-N 3.04Å; E353-F357 VanDerWaalsContact O-CB 3.23Å; E353-F357 WeakPolarHBondContact O-CB 3.43Å; E353-F357 PolarHBondContact O-N 3.32Å; E353-R415 IonicContact OE1-CZ 3.99Å; E353-R415 IonicContact OE1-NH1 3.29Å; E353-R415 PolarHBondContact OE1-NH1 3.36Å; E353-R415 IonicContact OE1-NH2 3.56Å
354	L	98.1	Very high	95.4	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-51.3	170.2	167.3	73.9	0	0	0	111.5	W184 Q188 F300 D350 F351 I352 E356 F357 I358	W184-L354 HydrophobicContact CB-CD1 4.46Å; W184-L354 WeakPolarHBondContact O-CD1 3.26Å; Q188-L354 HydrophobicContact CB-CD1 3.97Å; Q188-L354 VanDerWaalsContact NE2-CA 3.31Å; F300-L354 HydrophobicContact CD2-CD2 4.44Å; F300-L354 HydrophobicContact CE2-CD1 4.38Å; F300-L354 HydrophobicContact CE2-CD2 3.29Å; F300-L354 HydrophobicContact CE2-CG 4.39Å; F300-L354 HydrophobicContact CZ-CD2 3.58Å; D350-L354 WeakPolarHBondContact O-CB 3.38Å; D350-L354 PolarHBondContact O-N 3.04Å; F351-L354 HydrophobicContact CD2-CD2 4.33Å; F351-L354 WeakPolarHBondContact O-CB 3.44Å; F351-L354 PolarHBondContact O-N 3.14Å; I352-L354 VanDerWaalsContact C-N 3.29Å; I352-L354 PolarHBondContact O-N 3.06Å; L354-E356 VanDerWaalsContact C-N 3.32Å; L354-E356 PolarHBondContact O-N 3.25Å; L354-F357 WeakPolarHBondContact O-CB 3.37Å; L354-F357 PolarHBondContact O-N 2.86Å; L354-I358 HydrophobicContact CD1-CG1 4.19Å; L354-I358 WeakPolarHBondContact O-CG1 3.42Å; L354-I358 PolarHBondContact O-N 3.46Å
355	L	98.5	Very high	94	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-43.8	179.4	-61.2	-178.1	0	0	0	111.6	W184 I305 F351 I352 F357 I358 A359 L392 I395 L399 L419	W184-L355 HydrophobicContact CZ3-CD2 4.38Å; I305-L355 HydrophobicContact CD1-CD2 4.05Å; I305-L355 HydrophobicContact CG1-CD2 3.93Å; F351-L355 HydrophobicContact CD1-CD1 4.2Å; F351-L355 HydrophobicContact CE1-CD1 3.83Å; F351-L355 HydrophobicContact CE1-CG 4.3Å; F351-L355 HydrophobicContact CZ-CD1 4.43Å; F351-L355 HydrophobicContact CZ-CD2 4.34Å; F351-L355 WeakPolarHBondContact O-CG 3.42Å; F351-L355 PolarHBondContact O-N 3.24Å; F351-L355 VanDerWaalsContact O-N 3.08Å; I352-L355 PolarHBondContact O-N 3.41Å; I352-L355 VanDerWaalsContact O-N 3.15Å; L355-F357 VanDerWaalsContact C-N 3.33Å; L355-F357 PolarHBondContact O-N 3.45Å; L355-I358 PolarHBondContact O-N 3.28Å; L355-A359 VanDerWaalsContact O-CB 3.24Å; L355-A359 WeakPolarHBondContact O-CB 3.13Å; L355-A359 PolarHBondContact O-N 3.17Å; L355-L392 HydrophobicContact CB-CD2 4.18Å; L355-L392 HydrophobicContact CD2-CD2 3.97Å; L355-I395 HydrophobicContact CD1-CG2 4Å; L355-I395 HydrophobicContact CD2-CG2 4.09Å; L355-L399 HydrophobicContact CD1-CD1 4.36Å; L355-L399 HydrophobicContact CD1-CD2 4.28Å; L355-L419 HydrophobicContact CB-CD2 3.85Å
356	E	97.7	Very high	92.1	Very high	39 Å²	39	31.6 Å²	31.6	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-62.2	-40.3	176.7	-71.9	178.6	-178.5	0	0	112.5	I352 L354 A360 R415 L419	I352-E356 HydrophobicContact CG2-CG 4.3Å; I352-E356 WeakPolarHBondContact O-CG 3.42Å; I352-E356 PolarHBondContact O-N 2.95Å; L354-E356 VanDerWaalsContact C-N 3.32Å; L354-E356 PolarHBondContact O-N 3.25Å; E356-A360 VanDerWaalsContact O-CB 3.3Å; E356-A360 WeakPolarHBondContact O-CB 3.34Å; E356-A360 PolarHBondContact O-N 2.95Å; E356-R415 IonicContact OE1-CZ 2.93Å; E356-R415 IonicContact OE1-NE 2.99Å; E356-R415 PolarHBondContact OE1-NE 2.85Å; E356-R415 IonicContact OE1-NH2 2.76Å; E356-R415 PolarHBondContact OE1-NH2 3.16Å; E356-R415 IonicContact OE2-CZ 3.44Å; E356-R415 IonicContact OE2-NE 2.87Å; E356-R415 IonicContact OE2-NH2 2.58Å; E356-R415 PolarHBondContact OE2-NH2 2.85Å; E356-L419 HydrophobicContact CG-CB 4.41Å; E356-L419 HydrophobicContact CG-CD1 4.37Å; E356-L419 HydrophobicContact CG-CD2 4.01Å; E356-L419 HydrophobicContact CG-CG 4.5Å
357	F	95.9	Very high	89.6	Confident	36 Å²	36	36.8 Å²	36.8	16%	0.158	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-48.1	177.5	171	-91.2	0	0	0	111.4	E187 Q188 Q191 E353 L354 L355 A360 R361	E187-F357 HydrophobicContact CG-CE1 4.09Å; Q188-F357 HydrophobicContact CB-CD1 3.6Å; Q188-F357 HydrophobicContact CB-CE1 3.68Å; Q188-F357 HydrophobicContact CB-CG 4.2Å; Q188-F357 HydrophobicContact CB-CZ 4.31Å; Q188-F357 HydrophobicContact CG-CB 4.26Å; Q188-F357 HydrophobicContact CG-CD1 3.75Å; Q188-F357 HydrophobicContact CG-CD2 4.18Å; Q188-F357 HydrophobicContact CG-CE1 4.09Å; Q188-F357 HydrophobicContact CG-CE2 4.48Å; Q188-F357 HydrophobicContact CG-CG 3.79Å; Q188-F357 HydrophobicContact CG-CZ 4.43Å; Q191-F357 HydrophobicContact CB-CE2 4.15Å; Q191-F357 HydrophobicContact CB-CZ 3.77Å; Q191-F357 HydrophobicContact CG-CE2 3.79Å; Q191-F357 HydrophobicContact CG-CZ 3.8Å; E353-F357 VanDerWaalsContact O-CB 3.23Å; E353-F357 WeakPolarHBondContact O-CB 3.43Å; E353-F357 PolarHBondContact O-N 3.32Å; L354-F357 WeakPolarHBondContact O-CB 3.37Å; L354-F357 PolarHBondContact O-N 2.86Å; L355-F357 VanDerWaalsContact C-N 3.33Å; L355-F357 PolarHBondContact O-N 3.45Å; F357-A360 PolarHBondContact O-N 2.96Å; F357-R361 VanDerWaalsContact CE1-CD 3.44Å; F357-R361 WeakPolarHBondContact O-CG 3.45Å; F357-R361 PolarHBondContact O-N 2.98Å
358	I	96.1	Very high	87.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-45.9	179.1	-59.5	-63.7	0	0	0	110.1	W184 E187 L354 L355 A360 R361 R362 L392	W184-I358 HydrophobicContact CB-CD1 3.71Å; W184-I358 HydrophobicContact CB-CG1 3.86Å; W184-I358 HydrophobicContact CD2-CB 4.48Å; W184-I358 HydrophobicContact CD2-CG1 4.12Å; W184-I358 HydrophobicContact CD2-CG2 3.86Å; W184-I358 HydrophobicContact CE3-CG1 4.36Å; W184-I358 HydrophobicContact CE3-CG2 4.34Å; W184-I358 HydrophobicContact CG-CD1 3.89Å; W184-I358 HydrophobicContact CG-CG1 3.92Å; W184-I358 HydrophobicContact CG-CG2 4.13Å; W184-I358 HydrophobicContact CZ2-CG2 4.24Å; E187-I358 HydrophobicContact CB-CD1 4.35Å; E187-I358 HydrophobicContact CG-CD1 4.38Å; L354-I358 HydrophobicContact CD1-CG1 4.19Å; L354-I358 WeakPolarHBondContact O-CG1 3.42Å; L354-I358 PolarHBondContact O-N 3.46Å; L355-I358 PolarHBondContact O-N 3.28Å; I358-A360 VanDerWaalsContact C-N 3.35Å; I358-A360 PolarHBondContact O-N 3.05Å; I358-R361 PolarHBondContact O-N 3.21Å; I358-R362 HydrophobicContact CG2-CG 4.13Å; I358-R362 WeakPolarHBondContact O-CG 3.47Å; I358-R362 PolarHBondContact O-N 2.91Å; I358-L392 HydrophobicContact CB-CD2 4.5Å; I358-L392 HydrophobicContact CG2-CD1 4.13Å
359	A	95.6	Very high	84.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.8	-46.7	177	0	0	0	0	0	112.2	L355 R361 R362 L363 L392 L419 L423	L355-A359 VanDerWaalsContact O-CB 3.24Å; L355-A359 WeakPolarHBondContact O-CB 3.13Å; L355-A359 PolarHBondContact O-N 3.17Å; A359-R361 PolarHBondContact O-N 2.91Å; A359-R362 PolarHBondContact O-N 2.91Å; A359-L363 WeakPolarHBondContact O-CB 3.16Å; A359-L363 VanDerWaalsContact O-CG 3.28Å; A359-L363 WeakPolarHBondContact O-CG 3.49Å; A359-L363 PolarHBondContact O-N 2.92Å; A359-L392 HydrophobicContact CB-CD1 3.89Å; A359-L419 HydrophobicContact CB-CD1 3.53Å; A359-L423 HydrophobicContact CB-CD2 4.09Å
360	A	93.5	Very high	82.5	Confident	50 Å²	50	46.3 Å²	46.3	41%	0.413	27%	0.274	S	S	.	.	H	α-helix	trans	-59.1	-36.7	177.3	0	0	0	0	0	112.3	E356 F357 I358 A364	E356-A360 VanDerWaalsContact O-CB 3.3Å; E356-A360 WeakPolarHBondContact O-CB 3.34Å; E356-A360 PolarHBondContact O-N 2.95Å; F357-A360 PolarHBondContact O-N 2.96Å; I358-A360 VanDerWaalsContact C-N 3.35Å; I358-A360 PolarHBondContact O-N 3.05Å; A360-A364 PolarHBondContact O-N 3.3Å
361	R	92	Very high	80.4	Confident	30 Å²	30	48 Å²	48	11%	0.113	28%	0.28	C	S	.	.	H	α-helix	trans	-73.9	-37.2	177.4	-72.6	177.9	61.9	113.1	-16.5	112.9	E187 F357 I358 A359 F372	E187-R361 IonicContact OE1-CZ 3.71Å; E187-R361 VanDerWaalsContact OE1-CZ 3.24Å; E187-R361 IonicContact OE1-NE 3.93Å; E187-R361 PolarHBondContact OE1-NE 3.36Å; E187-R361 IonicContact OE1-NH2 2.69Å; E187-R361 PolarHBondContact OE1-NH2 3.32Å; F357-R361 VanDerWaalsContact CE1-CD 3.44Å; F357-R361 WeakPolarHBondContact O-CG 3.45Å; F357-R361 PolarHBondContact O-N 2.98Å; I358-R361 PolarHBondContact O-N 3.21Å; A359-R361 PolarHBondContact O-N 2.91Å; R361-F372 HydrophobicContact CB-CD2 4.17Å; R361-F372 HydrophobicContact CB-CE2 4.25Å; R361-F372 HydrophobicContact CG-CD2 4.2Å; R361-F372 HydrophobicContact CG-CE2 4.05Å; R361-F372 VanDerWaalsContact CZ-CG 3.49Å
362	R	92	Very high	78.8	Confident	17 Å²	17	51.8 Å²	51.8	6%	0.064	30%	0.297	C	S	.	.	H	α-helix	trans	-73.3	-29.4	176.8	-61	-55.5	177.8	-91.3	-1.3	112.8	E187 I358 A359 M380 V385 D388 L389	E187-R362 IonicContact OE1-CZ 2.89Å; E187-R362 IonicContact OE1-NH1 3.55Å; E187-R362 PolarHBondContact OE1-NH1 3.5Å; E187-R362 IonicContact OE1-NH2 2.68Å; E187-R362 IonicContact OE2-CZ 3.3Å; E187-R362 IonicContact OE2-NH1 3.36Å; E187-R362 PolarHBondContact OE2-NH1 2.81Å; E187-R362 IonicContact OE2-NH2 3.36Å; E187-R362 PolarHBondContact OE2-NH2 3.49Å; I358-R362 HydrophobicContact CG2-CG 4.13Å; I358-R362 WeakPolarHBondContact O-CG 3.47Å; I358-R362 PolarHBondContact O-N 2.91Å; A359-R362 PolarHBondContact O-N 2.91Å; R362-M380 VanDerWaalsContact CZ-CE 3.48Å; R362-V385 HydrophobicContact CB-CG1 4.13Å; R362-V385 WeakPolarHBondContact O-CG1 3.44Å; R362-D388 HydrophobicContact CG-CB 4.13Å; R362-D388 IonicContact CZ-OD2 3.87Å; R362-D388 IonicContact NE-OD2 3.43Å; R362-D388 PolarHBondContact NE-OD2 3.46Å; R362-D388 IonicContact NH2-OD2 3.71Å; R362-D388 PolarHBondContact NH2-OD2 3.42Å; R362-D388 VanDerWaalsContact NH2-OD2 3.17Å; R362-L389 HydrophobicContact CB-CD2 3.6Å; R362-L389 HydrophobicContact CB-CG 3.94Å
363	L	92.2	Very high	77.9	Confident	56 Å²	56	53 Å²	53	29%	0.293	30%	0.303	S	S	.	.	S	Bend	trans	-86.3	-5.9	177.5	-68.2	170.8	0	0	0	114.5	A359 E365 L389 R422 L423	A359-L363 WeakPolarHBondContact O-CB 3.16Å; A359-L363 VanDerWaalsContact O-CG 3.28Å; A359-L363 WeakPolarHBondContact O-CG 3.49Å; A359-L363 PolarHBondContact O-N 2.92Å; L363-E365 PolarHBondContact O-N 3.46Å; L363-E365 VanDerWaalsContact O-N 3.11Å; L363-L389 HydrophobicContact CD2-CD1 4.22Å; L363-L389 HydrophobicContact CD2-CD2 3.72Å; L363-L389 HydrophobicContact CG-CD2 3.8Å; L363-R422 HydrophobicContact CD1-CB 4.23Å; L363-R422 WeakPolarHBondContact CD1-O 3.42Å; L363-L423 HydrophobicContact CD1-CD2 4.28Å
364	A	87.9	Confident	77.6	Confident	35 Å²	35	50.4 Å²	50.4	29%	0.289	29%	0.291	S	S	.	.			trans	-65.3	111.9	-174.1	0	0	0	0	0	112.8	A360 G366 T370 F372	A360-A364 PolarHBondContact O-N 3.3Å; A364-G366 PolarHBondContact O-N 2.93Å; A364-T370 HydrophobicContact CB-CG2 4.19Å; A364-T370 WeakPolarHBondContact O-CB 2.94Å; A364-T370 PolarHBondContact O-OG1 2.91Å; A364-F372 HydrophobicContact CB-CE2 4.34Å
365	E	64.2	Low	77.2	Confident	197 Å²	197	52.1 Å²	52.1	92%	0.921	30%	0.298	S	S	*	.			trans	-68.9	122	173.8	-63.2	-176.4	171.5	0	0	111.6	L363	L363-E365 PolarHBondContact O-N 3.46Å; L363-E365 VanDerWaalsContact O-N 3.11Å
366	G	54	Low	76.7	Confident	30 Å²	30	58.5 Å²	58.5	31%	0.309	33%	0.332	S	S	.	.			trans	159.8	102.4	171.3	0	0	0	0	0	119.3	A364 V368 T370	A364-G366 PolarHBondContact O-N 2.93Å; G366-V368 PolarHBondContact O-N 3.09Å; G366-T370 PolarHBondContact N-OG1 3.2Å; G366-T370 WeakPolarHBondContact O-CB 3.45Å; G366-T370 WeakPolarHBondContact O-CG2 3.46Å; G366-T370 PolarHBondContact O-N 3.49Å; G366-T370 PolarHBondContact O-OG1 2.99Å
367	T	43.6	Very low	76.4	Confident	133 Å²	133	58.3 Å²	58.3	82%	0.816	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.6	80.8	149.4	55.1	0	0	0	0	119	A369	T367-A369 WeakPolarHBondContact O-CB 3.34Å; T367-A369 PolarHBondContact O-N 3.31Å
368	V	48.9	Very low	76.2	Confident	140 Å²	140	57.8 Å²	57.8	85%	0.848	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	-12.5	168.3	-170.1	0	0	0	0	116.4	G366	G366-V368 PolarHBondContact O-N 3.09Å
369	A	43.4	Very low	76	Confident	77 Å²	77	58.5 Å²	58.5	64%	0.636	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-7.6	-164.1	0	0	0	0	0	112.8	T367	T367-A369 WeakPolarHBondContact O-CB 3.34Å; T367-A369 PolarHBondContact O-N 3.31Å
370	T	48.8	Very low	75.8	Confident	45 Å²	45	58.8 Å²	58.8	28%	0.276	34%	0.338	S	S	.	.	S	Bend	trans	-77.8	-4.2	157	55.8	0	0	0	0	112.9	A364 G366 F372	A364-T370 HydrophobicContact CB-CG2 4.19Å; A364-T370 WeakPolarHBondContact O-CB 2.94Å; A364-T370 PolarHBondContact O-OG1 2.91Å; G366-T370 PolarHBondContact N-OG1 3.2Å; G366-T370 WeakPolarHBondContact O-CB 3.45Å; G366-T370 WeakPolarHBondContact O-CG2 3.46Å; G366-T370 PolarHBondContact O-N 3.49Å; G366-T370 PolarHBondContact O-OG1 2.99Å; T370-F372 VanDerWaalsContact O-CD2 3.25Å; T370-F372 WeakPolarHBondContact O-CD2 3.42Å; T370-F372 PolarHBondContact O-N 3.44Å
371	K	53.2	Low	75.7	Confident	57 Å²	57	57.1 Å²	57.1	25%	0.248	32%	0.322	C	S	.	.	S	Bend	trans	-67.1	77.2	154.7	-67.8	-178.9	177.3	-156.4	0	107.2	L373 T379 M380 D382	K371-L373 PolarHBondContact O-N 2.99Å; K371-T379 HydrophobicContact CB-CG2 4.23Å; K371-M380 WeakPolarHBondContact CD-O 3.34Å; K371-M380 WeakPolarHBondContact CE-O 3.43Å; K371-M380 PolarHBondContact NZ-O 3.44Å; K371-D382 WeakPolarHBondContact CE-OD1 3.46Å; K371-D382 IonicContact NZ-OD1 3.17Å; K371-D382 PolarHBondContact NZ-OD1 3.02Å
372	F	64.3	Low	75.7	Confident	80 Å²	80	61.2 Å²	61.2	35%	0.351	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-52.6	134.7	178.8	-69.5	-84	0	0	0	109.3	R361 A364 T370 L374	R361-F372 HydrophobicContact CB-CD2 4.17Å; R361-F372 HydrophobicContact CB-CE2 4.25Å; R361-F372 HydrophobicContact CG-CD2 4.2Å; R361-F372 HydrophobicContact CG-CE2 4.05Å; R361-F372 VanDerWaalsContact CZ-CG 3.49Å; A364-F372 HydrophobicContact CB-CE2 4.34Å; T370-F372 VanDerWaalsContact O-CD2 3.25Å; T370-F372 WeakPolarHBondContact O-CD2 3.42Å; T370-F372 PolarHBondContact O-N 3.44Å; F372-L374 PolarHBondContact O-N 3.48Å
373	L	79.3	Confident	75.9	Confident	27 Å²	27	64.1 Å²	64.1	14%	0.141	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-65.7	119	176.5	-66.7	169.8	0	0	0	109	D9 K371 F375 Y378 T379	D9-L373 HydrophobicContact CB-CD2 4.43Å; D9-L373 WeakPolarHBondContact OD1-CD2 3.33Å; K371-L373 PolarHBondContact O-N 2.99Å; L373-F375 PolarHBondContact O-N 3.33Å; L373-Y378 CarbonylContact C-O 3.58Å; L373-Y378 VanDerWaalsContact CA-O 3.28Å; L373-Y378 WeakPolarHBondContact CA-O 3.45Å; L373-T379 HydrophobicContact CD2-CG2 3.65Å
374	L	89.8	Confident	76	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.016	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-73.2	125	167.1	-51.6	163.7	0	0	0	106.6	L12 A181 E187 F372 D376 S377 Y378 M380	L12-L374 HydrophobicContact CD1-CD1 3.74Å; A181-L374 WeakPolarHBondContact O-CB 3.48Å; A181-L374 WeakPolarHBondContact O-CD1 3.5Å; E187-L374 HydrophobicContact CG-CD2 4.35Å; E187-L374 WeakPolarHBondContact OE2-CD2 3.48Å; F372-L374 PolarHBondContact O-N 3.48Å; L374-D376 PolarHBondContact O-N 3.3Å; L374-D376 VanDerWaalsContact O-N 3.12Å; L374-S377 PolarHBondContact O-N 2.92Å; L374-S377 VanDerWaalsContact O-N 3.08Å; L374-Y378 PolarHBondContact N-O 3.06Å; L374-Y378 WeakPolarHBondContact O-CD2 3.47Å; L374-Y378 PolarHBondContact O-N 3.15Å; L374-Y378 VanDerWaalsContact O-N 3.08Å; L374-M380 HydrophobicContact CD1-CE 4.15Å; L374-M380 HydrophobicContact CD1-CG 4.13Å; L374-M380 HydrophobicContact CD1-SD 4.15Å; L374-M380 HydrophobicContact CD2-CE 4.29Å; L374-M380 HydrophobicContact CG-CE 4.4Å
375	F	91.4	Very high	76.3	Confident	42 Å²	42	61.2 Å²	61.2	18%	0.184	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	37.9	-175.4	-58.1	-78.9	0	0	0	113.5	V176 D183 N186 I190 L373 S377	V176-F375 HydrophobicContact CB-CB 4.33Å; V176-F375 HydrophobicContact CB-CD1 4.4Å; V176-F375 HydrophobicContact CB-CD2 3.82Å; V176-F375 HydrophobicContact CB-CE2 4.16Å; V176-F375 HydrophobicContact CB-CG 3.93Å; V176-F375 HydrophobicContact CG1-CD2 3.83Å; V176-F375 HydrophobicContact CG1-CE2 3.79Å; V176-F375 HydrophobicContact CG1-CG 4.44Å; V176-F375 HydrophobicContact CG1-CZ 4.36Å; V176-F375 HydrophobicContact CG2-CB 4.26Å; V176-F375 HydrophobicContact CG2-CD1 3.57Å; V176-F375 HydrophobicContact CG2-CD2 3.83Å; V176-F375 HydrophobicContact CG2-CE1 3.71Å; V176-F375 HydrophobicContact CG2-CE2 3.96Å; V176-F375 HydrophobicContact CG2-CG 3.61Å; V176-F375 HydrophobicContact CG2-CZ 3.9Å; D183-F375 HydrophobicContact CB-CE2 3.78Å; D183-F375 HydrophobicContact CB-CZ 3.87Å; N186-F375 HydrophobicContact CB-CE1 4.21Å; N186-F375 HydrophobicContact CB-CZ 4.01Å; I190-F375 HydrophobicContact CD1-CD1 4.12Å; I190-F375 HydrophobicContact CD1-CE1 3.71Å; L373-F375 PolarHBondContact O-N 3.33Å; F375-S377 PolarHBondContact O-N 2.99Å; F375-S377 PolarHBondContact O-OG 3.34Å
376	D	87.5	Confident	77.7	Confident	134 Å²	134	54.8 Å²	54.8	72%	0.717	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	15	-179.7	-59.9	-47.4	0	0	0	115.6	L374	L374-D376 PolarHBondContact O-N 3.3Å; L374-D376 VanDerWaalsContact O-N 3.12Å
377	S	90.5	Very high	79.7	Confident	35 Å²	35	54.4 Å²	54.4	25%	0.245	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.1	-21.2	-170.3	-51.5	0	0	0	0	114.8	G8 V10 L374 F375	G8-S377 VanDerWaalsContact O-O 3.1Å; V10-S377 PolarHBondContact N-O 3.42Å; L374-S377 PolarHBondContact O-N 2.92Å; L374-S377 VanDerWaalsContact O-N 3.08Å; F375-S377 PolarHBondContact O-N 2.99Å; F375-S377 PolarHBondContact O-OG 3.34Å
378	Y	92.8	Very high	82.2	Confident	26 Å²	26	48.1 Å²	48.1	10%	0.102	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.2	-169.2	-57.7	-76.6	0	0	0	113.3	V10 L12 V176 K178 A181 L373 L374	V10-Y378 HydrophobicContact CB-CD1 3.69Å; V10-Y378 HydrophobicContact CB-CE1 3.79Å; V10-Y378 HydrophobicContact CG1-CD1 4.04Å; V10-Y378 HydrophobicContact CG1-CE1 4.01Å; V10-Y378 HydrophobicContact CG2-CE1 4.35Å; V10-Y378 WeakPolarHBondContact O-CA 3.39Å; L12-Y378 HydrophobicContact CD2-CD1 3.67Å; L12-Y378 HydrophobicContact CD2-CE1 4.45Å; L12-Y378 HydrophobicContact CD2-CG 4.11Å; L12-Y378 HydrophobicContact CG-CD1 4.43Å; V176-Y378 WeakPolarHBondContact O-CE2 3.47Å; V176-Y378 PolarHBondContact O-OH 3.49Å; K178-Y378 HydrophobicContact CB-CD1 4.21Å; K178-Y378 HydrophobicContact CB-CE1 3.6Å; K178-Y378 PolarHBondContact N-OH 3.37Å; A181-Y378 HydrophobicContact CB-CD1 4.43Å; A181-Y378 HydrophobicContact CB-CD2 3.41Å; A181-Y378 VanDerWaalsContact CB-CD2 3.41Å; A181-Y378 HydrophobicContact CB-CE2 3.92Å; A181-Y378 HydrophobicContact CB-CG 3.72Å; L373-Y378 CarbonylContact C-O 3.58Å; L373-Y378 VanDerWaalsContact CA-O 3.28Å; L373-Y378 WeakPolarHBondContact CA-O 3.45Å; L374-Y378 PolarHBondContact N-O 3.06Å; L374-Y378 WeakPolarHBondContact O-CD2 3.47Å; L374-Y378 PolarHBondContact O-N 3.15Å; L374-Y378 VanDerWaalsContact O-N 3.08Å
379	T	91.6	Very high	84.5	Confident	15 Å²	15	42 Å²	42	9%	0.092	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	156.4	171.5	59.1	0	0	0	0	110.9	D9 V10 L12 K371 L373	D9-T379 HydrophobicContact CB-CG2 4.12Å; V10-T379 PolarHBondContact O-N 3.01Å; L12-T379 WeakPolarHBondContact CB-O 3.31Å; L12-T379 PolarHBondContact N-O 2.81Å; K371-T379 HydrophobicContact CB-CG2 4.23Å; L373-T379 HydrophobicContact CD2-CG2 3.65Å
380	M	91.2	Very high	87	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.03	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	141.3	176.1	-75.8	169.7	-69.6	0	0	110.8	L12 R362 K371 L374 H384 V385	L12-M380 HydrophobicContact CD1-CG 4.5Å; R362-M380 VanDerWaalsContact CZ-CE 3.48Å; K371-M380 WeakPolarHBondContact CD-O 3.34Å; K371-M380 WeakPolarHBondContact CE-O 3.43Å; K371-M380 PolarHBondContact NZ-O 3.44Å; L374-M380 HydrophobicContact CD1-CE 4.15Å; L374-M380 HydrophobicContact CD1-CG 4.13Å; L374-M380 HydrophobicContact CD1-SD 4.15Å; L374-M380 HydrophobicContact CD2-CE 4.29Å; L374-M380 HydrophobicContact CG-CE 4.4Å; M380-H384 HydrophobicContact CB-CB 4.09Å; M380-H384 HydrophobicContact CG-CB 4.25Å; M380-V385 HydrophobicContact CB-CG2 3.89Å
381	N	92.4	Very high	89.4	Confident	15 Å²	15	40.6 Å²	40.6	8%	0.08	20%	0.2	C	C	.	.			trans	-76.6	169.6	166.2	77	-8.7	0	0	0	110.7	L11 Q13 L14 Y383 H384 V385	L11-N381 HydrophobicContact CD1-CB 3.97Å; L11-N381 HydrophobicContact CD2-CB 4.37Å; L11-N381 HydrophobicContact CG-CB 4.36Å; Q13-N381 PolarHBondContact NE2-ND2 2.83Å; L14-N381 PolarHBondContact N-ND2 3Å; L14-N381 PolarHBondContact O-ND2 2.83Å; L14-N381 PolarHBondContact O-OD1 3.33Å; N381-Y383 VanDerWaalsContact C-N 3.27Å; N381-Y383 PolarHBondContact O-N 3.36Å; N381-H384 PolarHBondContact O-N 3.48Å; N381-H384 VanDerWaalsContact O-N 3.17Å; N381-H384 VanDerWaalsContact OD1-CB 3.3Å; N381-H384 WeakPolarHBondContact OD1-CB 3.45Å; N381-H384 PolarHBondContact OD1-N 2.69Å; N381-V385 PolarHBondContact O-N 3.38Å
382	D	91.9	Very high	91.5	Very high	116 Å²	116	37.9 Å²	37.9	62%	0.62	19%	0.188	S	C	*	.	H	α-helix	trans	-67.3	-32.8	-170.3	-56.3	-6.6	0	0	0	111.8	K371 V385 Q386	K371-D382 WeakPolarHBondContact CE-OD1 3.46Å; K371-D382 IonicContact NZ-OD1 3.17Å; K371-D382 PolarHBondContact NZ-OD1 3.02Å; D382-V385 PolarHBondContact O-N 2.82Å; D382-Q386 WeakPolarHBondContact O-CB 3.38Å; D382-Q386 PolarHBondContact O-N 3.13Å
383	Y	94.4	Very high	93.2	Very high	78 Å²	78	38.1 Å²	38.1	31%	0.306	19%	0.187	S	C	.	.	H	α-helix	trans	-64.4	-40.1	174.8	-179	-93.3	0	0	0	112.3	L14 H15 P16 W43 N381 Q386 Y387	L14-Y383 HydrophobicContact CB-CD1 4.1Å; L14-Y383 HydrophobicContact CD2-CD1 3.92Å; L14-Y383 HydrophobicContact CD2-CE1 3.89Å; L14-Y383 HydrophobicContact CG-CD1 3.73Å; L14-Y383 HydrophobicContact CG-CE1 3.82Å; L14-Y383 WeakPolarHBondContact O-CB 3.42Å; L14-Y383 WeakPolarHBondContact O-CD1 3.5Å; H15-Y383 VanDerWaalsContact C-CE1 3.46Å; P16-Y383 WeakPolarHBondContact CA-OH 3.24Å; P16-Y383 HydrophobicContact CB-CE2 4.39Å; P16-Y383 HydrophobicContact CG-CD2 4.13Å; P16-Y383 HydrophobicContact CG-CE2 3.52Å; W43-Y383 HydrophobicContact CZ2-CE1 4.11Å; N381-Y383 VanDerWaalsContact C-N 3.27Å; N381-Y383 PolarHBondContact O-N 3.36Å; Y383-Q386 PolarHBondContact O-N 3.3Å; Y383-Y387 WeakPolarHBondContact O-CB 3.39Å; Y383-Y387 PolarHBondContact O-N 3.02Å
384	H	94.8	Very high	94.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-46.8	176	-164.8	-46.2	0	0	0	111.7	L14 Y38 S182 M380 N381 Q386 Y387 D388	L14-H384 HydrophobicContact CB-CB 3.96Å; L14-H384 HydrophobicContact CD2-CB 4.14Å; Y38-H384 AromaticContact CE1-CD2 3.67Å; Y38-H384 AromaticContact CE1-NE2 3.87Å; Y38-H384 AromaticContact CZ-NE2 3.76Å; Y38-H384 PolarHBondContact OH-NE2 3.11Å; S182-H384 PolarHBondContact OG-CE1 3.19Å; M380-H384 HydrophobicContact CB-CB 4.09Å; M380-H384 HydrophobicContact CG-CB 4.25Å; N381-H384 PolarHBondContact O-N 3.48Å; N381-H384 VanDerWaalsContact O-N 3.17Å; N381-H384 VanDerWaalsContact OD1-CB 3.3Å; N381-H384 WeakPolarHBondContact OD1-CB 3.45Å; N381-H384 PolarHBondContact OD1-N 2.69Å; H384-Q386 VanDerWaalsContact C-N 3.27Å; H384-Q386 PolarHBondContact O-N 3.31Å; H384-Y387 WeakPolarHBondContact O-CB 3.33Å; H384-Y387 PolarHBondContact O-N 2.97Å; H384-Y387 VanDerWaalsContact O-N 3.1Å; H384-D388 IonicContact CE1-OD1 2.65Å; H384-D388 IonicContact ND1-OD1 3.24Å; H384-D388 PolarHBondContact O-N 3.48Å
385	V	94	Very high	94.5	Very high	29 Å²	29	42.3 Å²	42.3	18%	0.176	20%	0.204	C	C	.	.	H	α-helix	trans	-57.5	-43.9	175.6	177.6	0	0	0	0	110.9	R362 M380 N381 D382 D388 L389	R362-V385 HydrophobicContact CB-CG1 4.13Å; R362-V385 WeakPolarHBondContact O-CG1 3.44Å; M380-V385 HydrophobicContact CB-CG2 3.89Å; N381-V385 PolarHBondContact O-N 3.38Å; D382-V385 PolarHBondContact O-N 2.82Å; V385-D388 PolarHBondContact O-N 2.92Å; V385-L389 HydrophobicContact CG1-CD1 4.15Å; V385-L389 WeakPolarHBondContact O-CG 3.31Å; V385-L389 PolarHBondContact O-N 3.12Å
386	Q	94.3	Very high	94.8	Very high	63 Å²	63	40.3 Å²	40.3	29%	0.294	20%	0.196	S	C	.	.	H	α-helix	trans	-61.4	-43.2	176.1	-179.3	60.6	22.8	0	0	112.2	D382 Y383 H384 L389 E390 F425	D382-Q386 WeakPolarHBondContact O-CB 3.38Å; D382-Q386 PolarHBondContact O-N 3.13Å; Y383-Q386 PolarHBondContact O-N 3.3Å; H384-Q386 VanDerWaalsContact C-N 3.27Å; H384-Q386 PolarHBondContact O-N 3.31Å; Q386-L389 PolarHBondContact O-N 2.92Å; Q386-E390 PolarHBondContact NE2-OE1 3.35Å; Q386-E390 WeakPolarHBondContact O-CG 3.21Å; Q386-E390 PolarHBondContact O-N 3.36Å; Q386-F425 VanDerWaalsContact NE2-CE2 3.25Å
387	Y	95.9	Very high	95.3	Very high	22 Å²	22	39.4 Å²	39.4	9%	0.086	18%	0.182	C	C	.	.	H	α-helix	trans	-59.8	-47	175.7	-180	-85.8	0	0	0	111.7	L14 F42 W43 H47 Y383 H384 L389 E390 C391	L14-Y387 HydrophobicContact CD2-CG 4.48Å; F42-Y387 HydrophobicContact CE1-CE1 4.3Å; F42-Y387 HydrophobicContact CE1-CE2 4.35Å; F42-Y387 AromaticContact CZ-CD1 3.89Å; F42-Y387 HydrophobicContact CZ-CD1 3.89Å; F42-Y387 AromaticContact CZ-CE1 3.58Å; F42-Y387 HydrophobicContact CZ-CE1 3.58Å; F42-Y387 HydrophobicContact CZ-CE2 4.38Å; F42-Y387 HydrophobicContact CZ-CG 4.44Å; F42-Y387 AromaticContact CZ-CZ 3.85Å; W43-Y387 HydrophobicContact CH2-CD2 4.19Å; W43-Y387 AromaticContact CH2-CE2 3.88Å; W43-Y387 HydrophobicContact CH2-CE2 3.88Å; W43-Y387 HydrophobicContact CZ3-CE2 4.38Å; H47-Y387 PolarHBondContact CD2-OH 3.01Å; H47-Y387 PolarHBondContact NE2-OH 3.37Å; Y383-Y387 WeakPolarHBondContact O-CB 3.39Å; Y383-Y387 PolarHBondContact O-N 3.02Å; H384-Y387 WeakPolarHBondContact O-CB 3.33Å; H384-Y387 PolarHBondContact O-N 2.97Å; H384-Y387 VanDerWaalsContact O-N 3.1Å; Y387-L389 VanDerWaalsContact C-N 3.34Å; Y387-L389 PolarHBondContact O-N 2.99Å; Y387-E390 PolarHBondContact O-N 3.16Å; Y387-C391 VanDerWaalsContact CE1-SG 3.54Å; Y387-C391 PolarHBondContact O-N 3.31Å
388	D	96.4	Very high	95.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-44.6	176.6	-87	4.8	0	0	0	111.1	W184 R362 H384 V385 C391 L392	W184-D388 HydrophobicContact CZ2-CB 3.95Å; W184-D388 WeakPolarHBondContact CZ2-OD1 3.39Å; W184-D388 PolarHBondContact NE1-OD2 3.17Å; W184-D388 VanDerWaalsContact NE1-OD2 3.12Å; R362-D388 HydrophobicContact CG-CB 4.13Å; R362-D388 IonicContact CZ-OD2 3.87Å; R362-D388 IonicContact NE-OD2 3.43Å; R362-D388 PolarHBondContact NE-OD2 3.46Å; R362-D388 IonicContact NH2-OD2 3.71Å; R362-D388 PolarHBondContact NH2-OD2 3.42Å; R362-D388 VanDerWaalsContact NH2-OD2 3.17Å; H384-D388 IonicContact CE1-OD1 2.65Å; H384-D388 IonicContact ND1-OD1 3.24Å; H384-D388 PolarHBondContact O-N 3.48Å; V385-D388 PolarHBondContact O-N 2.92Å; D388-C391 PolarHBondContact O-N 2.68Å; D388-L392 WeakPolarHBondContact O-CB 3.3Å; D388-L392 VanDerWaalsContact O-CG 3.27Å; D388-L392 WeakPolarHBondContact O-CG 3.48Å; D388-L392 PolarHBondContact O-N 3.32Å
389	L	96.4	Very high	95.8	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-40.7	177.4	-71.6	172.3	0	0	0	112.7	R362 L363 V385 Q386 Y387 L392 W393 L423 F425	R362-L389 HydrophobicContact CB-CD2 3.6Å; R362-L389 HydrophobicContact CB-CG 3.94Å; L363-L389 HydrophobicContact CD2-CD1 4.22Å; L363-L389 HydrophobicContact CD2-CD2 3.72Å; L363-L389 HydrophobicContact CG-CD2 3.8Å; V385-L389 HydrophobicContact CG1-CD1 4.15Å; V385-L389 WeakPolarHBondContact O-CG 3.31Å; V385-L389 PolarHBondContact O-N 3.12Å; Q386-L389 PolarHBondContact O-N 2.92Å; Y387-L389 VanDerWaalsContact C-N 3.34Å; Y387-L389 PolarHBondContact O-N 2.99Å; L389-L392 HydrophobicContact CD2-CD1 4.4Å; L389-L392 PolarHBondContact O-N 3.06Å; L389-W393 WeakPolarHBondContact O-CB 3.24Å; L389-W393 PolarHBondContact O-N 3.05Å; L389-L423 HydrophobicContact CD2-CD2 3.82Å; L389-F425 HydrophobicContact CB-CE1 3.84Å; L389-F425 HydrophobicContact CB-CZ 4.38Å; L389-F425 HydrophobicContact CD1-CD1 4.5Å; L389-F425 HydrophobicContact CD1-CE1 4.38Å
390	E	97.2	Very high	96	Very high	81 Å²	81	39.8 Å²	39.8	38%	0.379	19%	0.186	S	C	.	.	H	α-helix	trans	-65.5	-40.9	175.4	-74.8	177.8	-161.1	0	0	112.1	Q386 Y387 W393 K394	Q386-E390 PolarHBondContact NE2-OE1 3.35Å; Q386-E390 WeakPolarHBondContact O-CG 3.21Å; Q386-E390 PolarHBondContact O-N 3.36Å; Y387-E390 PolarHBondContact O-N 3.16Å; E390-W393 PolarHBondContact O-N 3.14Å; E390-K394 VanDerWaalsContact O-CG 3.28Å; E390-K394 WeakPolarHBondContact O-CG 3.46Å; E390-K394 PolarHBondContact O-N 2.83Å
391	C	98.2	Very high	96.3	Very high	12 Å²	12	44.8 Å²	44.8	8%	0.081	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-42.1	175.2	-74.1	0	0	0	0	111.7	W184 G302 Y387 D388 K394 I395	W184-C391 HydrophobicContact CH2-CB 4.46Å; G302-C391 PolarHBondContact O-SG 3.49Å; Y387-C391 VanDerWaalsContact CE1-SG 3.54Å; Y387-C391 PolarHBondContact O-N 3.31Å; D388-C391 PolarHBondContact O-N 2.68Å; C391-K394 PolarHBondContact O-N 2.96Å; C391-I395 VanDerWaalsContact O-CG2 3.31Å; C391-I395 WeakPolarHBondContact O-CG2 3.29Å; C391-I395 PolarHBondContact O-N 3.23Å
392	L	98.4	Very high	96.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-48.1	172.6	-76.1	164.5	0	0	0	111.4	W184 L355 I358 A359 D388 L389 K394 I395 T396 L423	W184-L392 HydrophobicContact CH2-CD2 4.06Å; W184-L392 HydrophobicContact CH2-CG 3.91Å; W184-L392 HydrophobicContact CZ3-CD2 3.96Å; W184-L392 HydrophobicContact CZ3-CG 4.33Å; L355-L392 HydrophobicContact CB-CD2 4.18Å; L355-L392 HydrophobicContact CD2-CD2 3.97Å; I358-L392 HydrophobicContact CB-CD2 4.5Å; I358-L392 HydrophobicContact CG2-CD1 4.13Å; A359-L392 HydrophobicContact CB-CD1 3.89Å; D388-L392 WeakPolarHBondContact O-CB 3.3Å; D388-L392 VanDerWaalsContact O-CG 3.27Å; D388-L392 WeakPolarHBondContact O-CG 3.48Å; D388-L392 PolarHBondContact O-N 3.32Å; L389-L392 HydrophobicContact CD2-CD1 4.4Å; L389-L392 PolarHBondContact O-N 3.06Å; L392-K394 PolarHBondContact O-N 3.43Å; L392-I395 VanDerWaalsContact O-CG2 3.31Å; L392-I395 WeakPolarHBondContact O-CG2 3.48Å; L392-I395 PolarHBondContact O-N 2.86Å; L392-T396 VanDerWaalsContact O-CB 3.28Å; L392-T396 WeakPolarHBondContact O-CB 3.47Å; L392-T396 PolarHBondContact O-N 2.95Å; L392-T396 PolarHBondContact O-OG1 2.78Å; L392-L423 HydrophobicContact CB-CD1 3.94Å; L392-L423 HydrophobicContact CB-CD2 4.14Å
393	W	98.3	Very high	96.5	Very high	86 Å²	86	42.6 Å²	42.6	33%	0.326	20%	0.202	S	C	.	.	H	α-helix	trans	-59.7	-47.2	178.2	178.6	92.5	0	0	0	111.6	L389 E390 R397 L420 L423	L389-W393 WeakPolarHBondContact O-CB 3.24Å; L389-W393 PolarHBondContact O-N 3.05Å; E390-W393 PolarHBondContact O-N 3.14Å; W393-R397 WeakPolarHBondContact O-CB 3.37Å; W393-R397 PolarHBondContact O-N 3.49Å; W393-L420 HydrophobicContact CG-CD1 4.19Å; W393-L423 HydrophobicContact CB-CB 4.3Å
394	K	98.1	Very high	96.3	Very high	110 Å²	110	41.4 Å²	41.4	48%	0.478	20%	0.203	S	C	.	.	H	α-helix	trans	-59.9	-49.5	179.1	-73.2	169.6	-171.2	161.1	0	111.4	E390 C391 L392 R397 T398	E390-K394 VanDerWaalsContact O-CG 3.28Å; E390-K394 WeakPolarHBondContact O-CG 3.46Å; E390-K394 PolarHBondContact O-N 2.83Å; C391-K394 PolarHBondContact O-N 2.96Å; L392-K394 PolarHBondContact O-N 3.43Å; K394-R397 PolarHBondContact O-N 2.91Å; K394-T398 PolarHBondContact O-N 3.15Å; K394-T398 VanDerWaalsContact O-N 3.09Å; K394-T398 PolarHBondContact O-OG1 2.87Å
395	I	98.2	Very high	96.3	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.036	20%	0.203	C	C	.	.	H	α-helix	trans	-67.7	-46.5	-178.1	-168	54.4	0	0	0	110.8	I305 W309 F351 L355 C391 L392 R397 T398 L399	I305-I395 HydrophobicContact CG1-CG1 4.34Å; I305-I395 HydrophobicContact CG1-CG2 4.47Å; I305-I395 HydrophobicContact CG2-CB 4.24Å; I305-I395 HydrophobicContact CG2-CG1 4.41Å; I305-I395 HydrophobicContact CG2-CG2 4.3Å; W309-I395 HydrophobicContact CB-CD1 3.76Å; W309-I395 HydrophobicContact CG-CD1 3.91Å; F351-I395 HydrophobicContact CE1-CG1 4.48Å; L355-I395 HydrophobicContact CD1-CG2 4Å; L355-I395 HydrophobicContact CD2-CG2 4.09Å; C391-I395 VanDerWaalsContact O-CG2 3.31Å; C391-I395 WeakPolarHBondContact O-CG2 3.29Å; C391-I395 PolarHBondContact O-N 3.23Å; L392-I395 VanDerWaalsContact O-CG2 3.31Å; L392-I395 WeakPolarHBondContact O-CG2 3.48Å; L392-I395 PolarHBondContact O-N 2.86Å; I395-R397 VanDerWaalsContact C-N 3.27Å; I395-R397 PolarHBondContact O-N 3.41Å; I395-T398 WeakPolarHBondContact O-CA 3.49Å; I395-T398 WeakPolarHBondContact O-CB 3.4Å; I395-T398 PolarHBondContact O-N 3.31Å; I395-L399 HydrophobicContact CD1-CD1 3.91Å; I395-L399 HydrophobicContact CG1-CD1 3.7Å; I395-L399 WeakPolarHBondContact O-CD1 3.4Å; I395-L399 PolarHBondContact O-N 3.17Å
396	T	98.2	Very high	96.3	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-58	-40.4	177.7	-60.8	0	0	0	0	111.7	L392 L399 T400 C416 L419 L420	L392-T396 VanDerWaalsContact O-CB 3.28Å; L392-T396 WeakPolarHBondContact O-CB 3.47Å; L392-T396 PolarHBondContact O-N 2.95Å; L392-T396 PolarHBondContact O-OG1 2.78Å; T396-L399 WeakPolarHBondContact O-CB 3.5Å; T396-L399 PolarHBondContact O-N 3.4Å; T396-T400 PolarHBondContact O-N 3.14Å; T396-C416 HydrophobicContact CG2-CB 4.41Å; T396-C416 WeakPolarHBondContact CG2-O 3.48Å; T396-L419 HydrophobicContact CG2-CB 4.07Å; T396-L419 HydrophobicContact CG2-CD2 4.02Å; T396-L419 HydrophobicContact CG2-CG 3.97Å; T396-L419 WeakPolarHBondContact OG1-CD2 3.5Å; T396-L420 HydrophobicContact CG2-CB 3.97Å; T396-L420 HydrophobicContact CG2-CD1 4.36Å
397	R	97.4	Very high	96	Very high	114 Å²	114	46 Å²	46	43%	0.43	23%	0.232	S	C	.	.	H	α-helix	trans	-59.7	-46.6	172.4	-179.6	179.5	172	160.8	0	112	W393 K394 I395 L399 T400 E401 L420	W393-R397 WeakPolarHBondContact O-CB 3.37Å; W393-R397 PolarHBondContact O-N 3.49Å; K394-R397 PolarHBondContact O-N 2.91Å; I395-R397 VanDerWaalsContact C-N 3.27Å; I395-R397 PolarHBondContact O-N 3.41Å; R397-L399 VanDerWaalsContact C-N 3.25Å; R397-L399 PolarHBondContact O-N 3.47Å; R397-T400 PolarHBondContact O-N 3.19Å; R397-T400 VanDerWaalsContact O-N 3.11Å; R397-T400 PolarHBondContact O-OG1 2.74Å; R397-E401 IonicContact CZ-OE1 3.71Å; R397-E401 IonicContact NE-OE1 3.22Å; R397-E401 PolarHBondContact NE-OE1 3.39Å; R397-E401 IonicContact NH2-OE1 3.56Å; R397-E401 WeakPolarHBondContact O-CG 3.46Å; R397-E401 PolarHBondContact O-N 2.98Å; R397-E401 VanDerWaalsContact O-N 3.16Å; R397-L420 HydrophobicContact CB-CD1 4.29Å
398	T	97.6	Very high	95.5	Very high	64 Å²	64	45.3 Å²	45.3	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-57.6	-37.7	174.6	-59.9	0	0	0	0	112.2	K394 I395 E401 D402	K394-T398 PolarHBondContact O-N 3.15Å; K394-T398 VanDerWaalsContact O-N 3.09Å; K394-T398 PolarHBondContact O-OG1 2.87Å; I395-T398 WeakPolarHBondContact O-CA 3.49Å; I395-T398 WeakPolarHBondContact O-CB 3.4Å; I395-T398 PolarHBondContact O-N 3.31Å; T398-E401 PolarHBondContact O-N 3.27Å; T398-D402 PolarHBondContact O-N 3.39Å
399	L	97.4	Very high	94.8	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-42.1	175	-81.7	79.3	0	0	0	111.9	W309 F351 I352 L355 I395 T396 R397 E401 D402 I405	W309-L399 HydrophobicContact CD2-CD1 4.25Å; W309-L399 HydrophobicContact CD2-CG 4.42Å; W309-L399 HydrophobicContact CG-CD1 4.46Å; W309-L399 HydrophobicContact CH2-CG 4.38Å; W309-L399 HydrophobicContact CZ2-CG 4.24Å; F351-L399 HydrophobicContact CD1-CD2 4.19Å; F351-L399 HydrophobicContact CE1-CD1 4.22Å; F351-L399 HydrophobicContact CE1-CD2 4.31Å; I352-L399 HydrophobicContact CD1-CD2 4.33Å; I352-L399 HydrophobicContact CG1-CD2 3.75Å; L355-L399 HydrophobicContact CD1-CD1 4.36Å; L355-L399 HydrophobicContact CD1-CD2 4.28Å; I395-L399 HydrophobicContact CD1-CD1 3.91Å; I395-L399 HydrophobicContact CG1-CD1 3.7Å; I395-L399 WeakPolarHBondContact O-CD1 3.4Å; I395-L399 PolarHBondContact O-N 3.17Å; T396-L399 WeakPolarHBondContact O-CB 3.5Å; T396-L399 PolarHBondContact O-N 3.4Å; R397-L399 VanDerWaalsContact C-N 3.25Å; R397-L399 PolarHBondContact O-N 3.47Å; L399-E401 PolarHBondContact O-N 3.17Å; L399-D402 WeakPolarHBondContact O-CB 3.47Å; L399-D402 PolarHBondContact O-N 2.94Å; L399-D402 VanDerWaalsContact O-N 3.12Å; L399-I405 HydrophobicContact CB-CG1 4.44Å; L399-I405 VanDerWaalsContact O-CB 3.31Å; L399-I405 WeakPolarHBondContact O-CB 3.4Å; L399-I405 WeakPolarHBondContact O-CG2 3.31Å
400	T	96.2	Very high	94.3	Very high	20 Å²	20	53.2 Å²	53.2	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-24.7	178.1	59.3	0	0	0	0	113.5	T396 R397 Q406 C416 Q417	T396-T400 PolarHBondContact O-N 3.14Å; R397-T400 PolarHBondContact O-N 3.19Å; R397-T400 VanDerWaalsContact O-N 3.11Å; R397-T400 PolarHBondContact O-OG1 2.74Å; T400-Q406 PolarHBondContact O-NE2 3.37Å; T400-C416 HydrophobicContact CG2-CB 3.61Å; T400-Q417 HydrophobicContact CG2-CG 4.23Å
401	E	95.8	Very high	93.9	Very high	110 Å²	110	55.7 Å²	55.7	51%	0.514	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-5.8	177.6	-65.9	172	-177.6	0	0	112.3	R397 T398 L399 P403	R397-E401 IonicContact CZ-OE1 3.71Å; R397-E401 IonicContact NE-OE1 3.22Å; R397-E401 PolarHBondContact NE-OE1 3.39Å; R397-E401 IonicContact NH2-OE1 3.56Å; R397-E401 WeakPolarHBondContact O-CG 3.46Å; R397-E401 PolarHBondContact O-N 2.98Å; R397-E401 VanDerWaalsContact O-N 3.16Å; T398-E401 PolarHBondContact O-N 3.27Å; L399-E401 PolarHBondContact O-N 3.17Å; E401-P403 WeakPolarHBondContact O-CD 3.24Å
402	D	95.6	Very high	93.8	Very high	7 Å²	7	55.1 Å²	55.1	4%	0.037	29%	0.285	C	S	.	.			trans	-86.1	121.6	-177.4	-162.3	-59.8	0	0	0	112.3	W309 K313 T398 L399 T404 I405 Q406	W309-D402 HydrophobicContact CZ2-CB 4.18Å; K313-D402 WeakPolarHBondContact CD-OD2 3.47Å; K313-D402 VanDerWaalsContact CE-OD2 3.24Å; K313-D402 WeakPolarHBondContact CE-OD2 3.39Å; K313-D402 IonicContact NZ-OD2 2.68Å; K313-D402 PolarHBondContact NZ-OD2 3.28Å; T398-D402 PolarHBondContact O-N 3.39Å; L399-D402 WeakPolarHBondContact O-CB 3.47Å; L399-D402 PolarHBondContact O-N 2.94Å; L399-D402 VanDerWaalsContact O-N 3.12Å; D402-T404 PolarHBondContact O-N 3.19Å; D402-T404 VanDerWaalsContact O-N 3.13Å; D402-T404 WeakPolarHBondContact OD1-CB 3.26Å; D402-T404 PolarHBondContact OD1-N 2.98Å; D402-T404 PolarHBondContact OD1-OG1 2.88Å; D402-I405 HydrophobicContact CB-CB 4.36Å; D402-I405 HydrophobicContact CB-CG1 4.08Å; D402-I405 WeakPolarHBondContact O-CB 3.43Å; D402-I405 PolarHBondContact O-N 3.17Å; D402-Q406 PolarHBondContact O-N 3.44Å
403	P	93.2	Very high	93.7	Very high	78 Å²	78	57.7 Å²	57.7	51%	0.506	30%	0.297	S	S	.	.	H	α-helix	trans	-58.7	-28.3	179	-26.1	35.3	0	0	0	114.4	E401 I405 C407	E401-P403 WeakPolarHBondContact O-CD 3.24Å; P403-I405 PolarHBondContact O-N 3.06Å; P403-C407 WeakPolarHBondContact O-CB 3.45Å; P403-C407 PolarHBondContact O-N 2.59Å; P403-C407 PolarHBondContact O-SG 2.83Å; P403-C407 VanDerWaalsContact O-SG 3.42Å
404	T	91.8	Very high	93.6	Very high	54 Å²	54	57.7 Å²	57.7	33%	0.331	30%	0.304	S	S	.	.	H	α-helix	trans	-73.3	-18.3	177.8	64.2	0	0	0	0	112.7	Y348 D402	Y348-T404 VanDerWaalsContact CE2-OG1 3.3Å; Y348-T404 WeakPolarHBondContact CE2-OG1 3.28Å; Y348-T404 PolarHBondContact OH-OG1 3.45Å; D402-T404 PolarHBondContact O-N 3.19Å; D402-T404 VanDerWaalsContact O-N 3.13Å; D402-T404 WeakPolarHBondContact OD1-CB 3.26Å; D402-T404 PolarHBondContact OD1-N 2.98Å; D402-T404 PolarHBondContact OD1-OG1 2.88Å
405	I	94.7	Very high	93.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-88.4	-46	171.4	-64.5	-69	0	0	0	110.2	W309 Y348 I352 L399 D402 P403 C407 S408 L412 E413	W309-I405 HydrophobicContact CH2-CD1 3.97Å; W309-I405 HydrophobicContact CH2-CG1 3.99Å; W309-I405 HydrophobicContact CZ2-CG1 4.35Å; Y348-I405 HydrophobicContact CD2-CD1 3.44Å; Y348-I405 VanDerWaalsContact CD2-CD1 3.44Å; Y348-I405 HydrophobicContact CD2-CG1 4.42Å; Y348-I405 HydrophobicContact CE2-CD1 3.81Å; Y348-I405 HydrophobicContact CE2-CG1 4.34Å; Y348-I405 HydrophobicContact CG-CD1 4.2Å; I352-I405 HydrophobicContact CD1-CD1 4.25Å; L399-I405 HydrophobicContact CB-CG1 4.44Å; L399-I405 VanDerWaalsContact O-CB 3.31Å; L399-I405 WeakPolarHBondContact O-CB 3.4Å; L399-I405 WeakPolarHBondContact O-CG2 3.31Å; D402-I405 HydrophobicContact CB-CB 4.36Å; D402-I405 HydrophobicContact CB-CG1 4.08Å; D402-I405 WeakPolarHBondContact O-CB 3.43Å; D402-I405 PolarHBondContact O-N 3.17Å; P403-I405 PolarHBondContact O-N 3.06Å; I405-C407 VanDerWaalsContact C-N 3.32Å; I405-C407 PolarHBondContact O-N 2.95Å; I405-S408 WeakPolarHBondContact O-CB 3.43Å; I405-S408 PolarHBondContact O-N 3.13Å; I405-L412 HydrophobicContact CD1-CB 4.31Å; I405-L412 HydrophobicContact CD1-CD1 4.08Å; I405-L412 HydrophobicContact CG2-CB 4.09Å; I405-E413 HydrophobicContact CG2-CB 4.32Å
406	Q	93.5	Very high	93.5	Very high	87 Å²	87	55.4 Å²	55.4	41%	0.407	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-39.3	-179.5	-68.6	175.8	-12.2	0	0	113.1	T400 D402 S408	T400-Q406 PolarHBondContact O-NE2 3.37Å; D402-Q406 PolarHBondContact O-N 3.44Å; Q406-S408 VanDerWaalsContact C-N 3.31Å; Q406-S408 PolarHBondContact O-N 3.41Å
407	C	86.5	Confident	93.5	Very high	99 Å²	99	59.8 Å²	59.8	67%	0.669	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	1.2	-178	-65.6	0	0	0	0	113.9	P403 I405	P403-C407 WeakPolarHBondContact O-CB 3.45Å; P403-C407 PolarHBondContact O-N 2.59Å; P403-C407 PolarHBondContact O-SG 2.83Å; P403-C407 VanDerWaalsContact O-SG 3.42Å; I405-C407 VanDerWaalsContact C-N 3.32Å; I405-C407 PolarHBondContact O-N 2.95Å
408	S	86.7	Confident	93.5	Very high	9 Å²	9	56.2 Å²	56.2	6%	0.063	31%	0.311	C	S	.	.			trans	-74.7	131.3	-169.1	-166.6	0	0	0	0	112.8	E333 I405 Q406 L410 Q411	E333-S408 VanDerWaalsContact OE1-CA 3.27Å; E333-S408 WeakPolarHBondContact OE1-CA 3.35Å; E333-S408 VanDerWaalsContact OE1-CB 3.26Å; E333-S408 WeakPolarHBondContact OE1-CB 3.48Å; E333-S408 PolarHBondContact OE1-OG 2.89Å; I405-S408 WeakPolarHBondContact O-CB 3.43Å; I405-S408 PolarHBondContact O-N 3.13Å; Q406-S408 VanDerWaalsContact C-N 3.31Å; Q406-S408 PolarHBondContact O-N 3.41Å; S408-L410 PolarHBondContact O-N 3.49Å; S408-L410 VanDerWaalsContact O-N 3.14Å; S408-Q411 PolarHBondContact O-N 3.42Å; S408-Q411 VanDerWaalsContact O-N 3.14Å
409	P	82.4	Confident	93.5	Very high	92 Å²	92	53.2 Å²	53.2	60%	0.597	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.7	178.9	29.8	-36.1	0	0	0	112.9	E333 Q411	E333-P409 VanDerWaalsContact OE1-CD 3.3Å; E333-P409 WeakPolarHBondContact OE1-CD 3.01Å; E333-P409 WeakPolarHBondContact OE2-CD 3.3Å; P409-Q411 PolarHBondContact O-N 3.01Å
410	L	85.3	Confident	93.4	Very high	85 Å²	85	54.5 Å²	54.5	45%	0.445	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6.8	175.4	-64.1	179.3	0	0	0	113.3	S408 L412	S408-L410 PolarHBondContact O-N 3.49Å; S408-L410 VanDerWaalsContact O-N 3.14Å; L410-L412 HydrophobicContact CB-CD2 3.85Å; L410-L412 HydrophobicContact CB-CG 3.98Å; L410-L412 PolarHBondContact O-N 2.96Å
411	Q	89.5	Confident	93.5	Very high	132 Å²	132	56.6 Å²	56.6	62%	0.617	32%	0.318	S	S	*	.			trans	54	39	-178.2	-57.9	-174.2	-59.8	0	0	112.2	S408 P409 E413 D414 R415	S408-Q411 PolarHBondContact O-N 3.42Å; S408-Q411 VanDerWaalsContact O-N 3.14Å; P409-Q411 PolarHBondContact O-N 3.01Å; Q411-E413 PolarHBondContact O-N 3.35Å; Q411-D414 HydrophobicContact CB-CB 4.43Å; Q411-D414 PolarHBondContact O-N 3.27Å; Q411-R415 PolarHBondContact O-N 3.14Å
412	L	95	Very high	93.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-32	-178.9	-62	-174.3	0	0	0	111.8	Y348 L349 I352 I405 L410 D414 R415 C416	Y348-L412 HydrophobicContact CD2-CD1 4.16Å; Y348-L412 HydrophobicContact CG-CD1 4.49Å; L349-L412 HydrophobicContact CB-CD2 4.48Å; L349-L412 HydrophobicContact CD1-CD2 3.82Å; I352-L412 HydrophobicContact CD1-CB 3.83Å; I352-L412 HydrophobicContact CD1-CD1 4.17Å; I352-L412 HydrophobicContact CD1-CD2 3.99Å; I352-L412 HydrophobicContact CD1-CG 4.21Å; I405-L412 HydrophobicContact CD1-CB 4.31Å; I405-L412 HydrophobicContact CD1-CD1 4.08Å; I405-L412 HydrophobicContact CG2-CB 4.09Å; L410-L412 HydrophobicContact CB-CD2 3.85Å; L410-L412 HydrophobicContact CB-CG 3.98Å; L410-L412 PolarHBondContact O-N 2.96Å; L412-D414 PolarHBondContact O-N 3.23Å; L412-R415 PolarHBondContact O-N 2.97Å; L412-C416 PolarHBondContact O-N 3.11Å; L412-C416 PolarHBondContact O-SG 3.36Å; L412-C416 VanDerWaalsContact O-SG 3.36Å
413	E	95.9	Very high	93.3	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-57.7	-45.9	173.9	-172	-179.7	-177.7	0	0	112	I405 Q411 R415 C416 Q417	I405-E413 HydrophobicContact CG2-CB 4.32Å; Q411-E413 PolarHBondContact O-N 3.35Å; E413-R415 VanDerWaalsContact C-N 3.28Å; E413-R415 PolarHBondContact O-N 3.41Å; E413-C416 PolarHBondContact O-N 3.13Å; E413-C416 VanDerWaalsContact O-N 3.13Å; E413-Q417 HydrophobicContact CG-CG 4.26Å; E413-Q417 WeakPolarHBondContact O-CG 3.27Å; E413-Q417 PolarHBondContact O-N 3.48Å; E413-Q417 PolarHBondContact OE1-NE2 3.27Å
414	D	96.4	Very high	92.9	Very high	87 Å²	87	59.4 Å²	59.4	47%	0.465	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-39.1	180	-67.3	-23.9	0	0	0	111.4	Q411 L412 G418	Q411-D414 HydrophobicContact CB-CB 4.43Å; Q411-D414 PolarHBondContact O-N 3.27Å; L412-D414 PolarHBondContact O-N 3.23Å; D414-G418 PolarHBondContact O-N 3.45Å
415	R	97.3	Very high	91.6	Very high	67 Å²	67	64.6 Å²	64.6	25%	0.253	34%	0.338	S	S	.	.	H	α-helix	trans	-64.2	-46.6	174.4	-67.4	-169.4	70.5	162.3	7.6	111.7	I352 E353 E356 Q411 L412 E413 G418 L419	I352-R415 HydrophobicContact CG2-CB 4.02Å; E353-R415 IonicContact OE1-CZ 3.99Å; E353-R415 IonicContact OE1-NH1 3.29Å; E353-R415 PolarHBondContact OE1-NH1 3.36Å; E353-R415 IonicContact OE1-NH2 3.56Å; E356-R415 IonicContact OE1-CZ 2.93Å; E356-R415 IonicContact OE1-NE 2.99Å; E356-R415 PolarHBondContact OE1-NE 2.85Å; E356-R415 IonicContact OE1-NH2 2.76Å; E356-R415 PolarHBondContact OE1-NH2 3.16Å; E356-R415 IonicContact OE2-CZ 3.44Å; E356-R415 IonicContact OE2-NE 2.87Å; E356-R415 IonicContact OE2-NH2 2.58Å; E356-R415 PolarHBondContact OE2-NH2 2.85Å; Q411-R415 PolarHBondContact O-N 3.14Å; L412-R415 PolarHBondContact O-N 2.97Å; E413-R415 VanDerWaalsContact C-N 3.28Å; E413-R415 PolarHBondContact O-N 3.41Å; R415-G418 PolarHBondContact O-N 3.22Å; R415-L419 WeakPolarHBondContact O-CB 3.27Å; R415-L419 PolarHBondContact O-N 2.95Å
416	C	97.8	Very high	91.4	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.014	36%	0.355	C	S	.	.	H	α-helix	trans	-63	-42.7	178	-69.4	0	0	0	0	112	T396 T400 L412 E413 L419 L420	T396-C416 HydrophobicContact CG2-CB 4.41Å; T396-C416 WeakPolarHBondContact CG2-O 3.48Å; T400-C416 HydrophobicContact CG2-CB 3.61Å; L412-C416 PolarHBondContact O-N 3.11Å; L412-C416 PolarHBondContact O-SG 3.36Å; L412-C416 VanDerWaalsContact O-SG 3.36Å; E413-C416 PolarHBondContact O-N 3.13Å; E413-C416 VanDerWaalsContact O-N 3.13Å; C416-L419 PolarHBondContact O-N 3.21Å; C416-L420 WeakPolarHBondContact O-CB 3.39Å; C416-L420 PolarHBondContact O-N 3.42Å
417	Q	97.1	Very high	91.3	Very high	93 Å²	93	66.7 Å²	66.7	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-63.6	-43.2	175.1	-70.6	-177.7	5.3	0	0	111.5	T400 E413 L419 L420 A421	T400-Q417 HydrophobicContact CG2-CG 4.23Å; E413-Q417 HydrophobicContact CG-CG 4.26Å; E413-Q417 WeakPolarHBondContact O-CG 3.27Å; E413-Q417 PolarHBondContact O-N 3.48Å; E413-Q417 PolarHBondContact OE1-NE2 3.27Å; Q417-L419 VanDerWaalsContact C-N 3.32Å; Q417-L419 PolarHBondContact O-N 3.41Å; Q417-L420 PolarHBondContact O-N 3.06Å; Q417-A421 WeakPolarHBondContact O-CB 3.35Å; Q417-A421 PolarHBondContact O-N 2.81Å
418	G	97.2	Very high	91.6	Very high	38 Å²	38	64.9 Å²	64.9	39%	0.392	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-32.5	175.6	0	0	0	0	0	113.6	D414 R415 R422	D414-G418 PolarHBondContact O-N 3.45Å; R415-G418 PolarHBondContact O-N 3.22Å; G418-R422 WeakPolarHBondContact O-CG 3.32Å; G418-R422 PolarHBondContact O-NE 3.2Å
419	L	97.5	Very high	91.9	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-70.3	-45.3	170.3	177.5	57.3	0	0	0	111.3	L355 E356 A359 T396 R415 C416 Q417 A421 R422 L423	L355-L419 HydrophobicContact CB-CD2 3.85Å; E356-L419 HydrophobicContact CG-CB 4.41Å; E356-L419 HydrophobicContact CG-CD1 4.37Å; E356-L419 HydrophobicContact CG-CD2 4.01Å; E356-L419 HydrophobicContact CG-CG 4.5Å; A359-L419 HydrophobicContact CB-CD1 3.53Å; T396-L419 HydrophobicContact CG2-CB 4.07Å; T396-L419 HydrophobicContact CG2-CD2 4.02Å; T396-L419 HydrophobicContact CG2-CG 3.97Å; T396-L419 WeakPolarHBondContact OG1-CD2 3.5Å; R415-L419 WeakPolarHBondContact O-CB 3.27Å; R415-L419 PolarHBondContact O-N 2.95Å; C416-L419 PolarHBondContact O-N 3.21Å; Q417-L419 VanDerWaalsContact C-N 3.32Å; Q417-L419 PolarHBondContact O-N 3.41Å; L419-A421 VanDerWaalsContact C-N 3.34Å; L419-A421 PolarHBondContact O-N 3.27Å; L419-R422 WeakPolarHBondContact O-CB 3.39Å; L419-R422 PolarHBondContact O-N 3.3Å; L419-L423 HydrophobicContact CD1-CD1 3.98Å; L419-L423 HydrophobicContact CD1-CG 4.25Å; L419-L423 HydrophobicContact CG-CD1 3.89Å; L419-L423 WeakPolarHBondContact O-CG 3.29Å; L419-L423 PolarHBondContact O-N 2.99Å; L419-L423 VanDerWaalsContact O-N 3.17Å
420	L	96.9	Very high	92.5	Very high	29 Å²	29	66.8 Å²	66.8	15%	0.152	34%	0.335	C	S	.	.	H	α-helix	trans	-59.6	-44.3	179.9	-169.4	63.2	0	0	0	111.5	W393 T396 R397 C416 Q417 R422 L423 E424	W393-L420 HydrophobicContact CG-CD1 4.19Å; T396-L420 HydrophobicContact CG2-CB 3.97Å; T396-L420 HydrophobicContact CG2-CD1 4.36Å; R397-L420 HydrophobicContact CB-CD1 4.29Å; C416-L420 WeakPolarHBondContact O-CB 3.39Å; C416-L420 PolarHBondContact O-N 3.42Å; Q417-L420 PolarHBondContact O-N 3.06Å; L420-R422 PolarHBondContact O-N 3.48Å; L420-L423 CarbonylContact O-C 3.56Å; L420-L423 WeakPolarHBondContact O-CA 3.34Å; L420-L423 PolarHBondContact O-N 3.32Å; L420-E424 PolarHBondContact O-N 3.47Å; L420-E424 VanDerWaalsContact O-N 3.14Å
421	A	96.5	Very high	93	Very high	64 Å²	64	65.5 Å²	65.5	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-27	176.6	0	0	0	0	0	113.5	Q417 L419	Q417-A421 WeakPolarHBondContact O-CB 3.35Å; Q417-A421 PolarHBondContact O-N 2.81Å; L419-A421 VanDerWaalsContact C-N 3.34Å; L419-A421 PolarHBondContact O-N 3.27Å
422	R	94.4	Very high	93.2	Very high	110 Å²	110	60.8 Å²	60.8	42%	0.415	31%	0.307	S	S	.	.	H	α-helix	trans	-80.1	-21.9	173.5	-71	-176.5	-70	153.2	-6.1	113	L363 G418 L419 L420	L363-R422 HydrophobicContact CD1-CB 4.23Å; L363-R422 WeakPolarHBondContact CD1-O 3.42Å; G418-R422 WeakPolarHBondContact O-CG 3.32Å; G418-R422 PolarHBondContact O-NE 3.2Å; L419-R422 WeakPolarHBondContact O-CB 3.39Å; L419-R422 PolarHBondContact O-N 3.3Å; L420-R422 PolarHBondContact O-N 3.48Å
423	L	94.5	Very high	93.1	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-92.5	-4.9	179.6	-67.6	168.2	0	0	0	112.6	A359 L363 L389 L392 W393 L419 L420 F425	A359-L423 HydrophobicContact CB-CD2 4.09Å; L363-L423 HydrophobicContact CD1-CD2 4.28Å; L389-L423 HydrophobicContact CD2-CD2 3.82Å; L392-L423 HydrophobicContact CB-CD1 3.94Å; L392-L423 HydrophobicContact CB-CD2 4.14Å; W393-L423 HydrophobicContact CB-CB 4.3Å; L419-L423 HydrophobicContact CD1-CD1 3.98Å; L419-L423 HydrophobicContact CD1-CG 4.25Å; L419-L423 HydrophobicContact CG-CD1 3.89Å; L419-L423 WeakPolarHBondContact O-CG 3.29Å; L419-L423 PolarHBondContact O-N 2.99Å; L419-L423 VanDerWaalsContact O-N 3.17Å; L420-L423 CarbonylContact O-C 3.56Å; L420-L423 WeakPolarHBondContact O-CA 3.34Å; L420-L423 PolarHBondContact O-N 3.32Å; L423-F425 VanDerWaalsContact C-N 3.27Å; L423-F425 WeakPolarHBondContact O-CD1 3.36Å; L423-F425 WeakPolarHBondContact O-CE1 3.28Å; L423-F425 PolarHBondContact O-N 2.92Å
424	E	84.3	Confident	92.9	Very high	141 Å²	141	66.4 Å²	66.4	66%	0.659	34%	0.337	S	S	*	.			trans	-77.1	80.3	165.5	-68.1	-178.4	171.4	0	0	108.5	L420	L420-E424 PolarHBondContact O-N 3.47Å; L420-E424 VanDerWaalsContact O-N 3.14Å
425	F	64.3	Low	92.5	Very high	163 Å²	163	64.5 Å²	64.5	72%	0.715	33%	0.325	S	S	*	.			trans	-89.2	0	176.7	51.8	-98.3	0	0	0	113.1	Q386 L389 L423	Q386-F425 VanDerWaalsContact NE2-CE2 3.25Å; L389-F425 HydrophobicContact CB-CE1 3.84Å; L389-F425 HydrophobicContact CB-CZ 4.38Å; L389-F425 HydrophobicContact CD1-CD1 4.5Å; L389-F425 HydrophobicContact CD1-CE1 4.38Å; L423-F425 VanDerWaalsContact C-N 3.27Å; L423-F425 WeakPolarHBondContact O-CD1 3.36Å; L423-F425 WeakPolarHBondContact O-CE1 3.28Å; L423-F425 PolarHBondContact O-N 2.92Å

Retrieved 425 of 425 residues in 91.4 ms (Link to these results)

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