A0A087XLG8_POEFO Loading...

RNA polymerase II elongation factor ELL-like

AlphaFold DB , UniProt , Accession A0A087XLG8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 602 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.8	Low	68.1	Low	239 Å²	239	125.5 Å²	125.5	100%	1.177	62%	0.616	S	S	*	*				0	157.7	0	-60.1	-168	-67.2	0	0	107.8
2	A	58.1	Low	67.9	Low	46 Å²	46	125 Å²	125	38%	0.38	62%	0.617	S	S	.	*			trans	-61.2	136	173.6	0	0	0	0	0	110.1	L4 Q101	A2-L4 HydrophobicContact CB-CD2 4.25Å; A2-Q101 HydrophobicContact CB-CB 4.22Å
3	A	65.1	Low	67.4	Low	74 Å²	74	118.6 Å²	118.6	61%	0.612	59%	0.592	S	S	*	*			trans	-106	77.5	-176.5	0	0	0	0	0	108.9	R5 Q101	A3-R5 PolarHBondContact O-N 2.74Å; A3-Q101 VanDerWaalsContact N-OE1 3.13Å
4	L	74.9	Confident	66.6	Low	100 Å²	100	117.3 Å²	117.3	52%	0.524	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-73.1	127.4	-179.6	-52.4	-173.3	0	0	0	109.5	A2 Y10 L111	A2-L4 HydrophobicContact CB-CD2 4.25Å; L4-Y10 HydrophobicContact CB-CD2 4.41Å; L4-Y10 HydrophobicContact CB-CE2 3.87Å; L4-Y10 HydrophobicContact CD2-CD1 4.22Å; L4-Y10 HydrophobicContact CD2-CD2 3.95Å; L4-Y10 HydrophobicContact CD2-CE1 4.19Å; L4-Y10 HydrophobicContact CD2-CE2 3.91Å; L4-Y10 HydrophobicContact CD2-CG 4.12Å; L4-Y10 HydrophobicContact CG-CE2 4.4Å; L4-L111 HydrophobicContact CD2-CD1 3.89Å; L4-L111 HydrophobicContact CD2-CD2 4.1Å
5	R	75.7	Confident	65.6	Low	170 Å²	170	112.4 Å²	112.4	64%	0.642	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-83.1	145	176.5	-64.6	179.5	179.5	-176.7	-0.2	110	A3 H8 Y10	A3-R5 PolarHBondContact O-N 2.74Å; R5-H8 HydrophobicContact CB-CB 4.18Å; R5-H8 PolarHBondContact O-N 3.48Å; R5-Y10 PolarHBondContact N-OH 3.14Å
6	Q	70.6	Confident	64.7	Low	159 Å²	159	117.8 Å²	117.8	74%	0.743	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	143.1	172.8	-177.5	170.4	-32	0	0	110.6	H8	Q6-H8 PolarHBondContact O-N 2.93Å; Q6-H8 PolarHBondContact O-ND1 2.98Å
7	E	71.5	Confident	64	Low	171 Å²	171	119.7 Å²	119.7	80%	0.799	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.9	3.1	179.1	-70.6	146.3	-130.7	0	0	116.8
8	H	71.3	Confident	63.1	Low	99 Å²	99	118.2 Å²	118.2	46%	0.458	61%	0.609	S	S	.	*			trans	-85.7	132.3	176.3	-70.4	51.3	0	0	0	111.7	R5 Q6 Y10	R5-H8 HydrophobicContact CB-CB 4.18Å; R5-H8 PolarHBondContact O-N 3.48Å; Q6-H8 PolarHBondContact O-N 2.93Å; Q6-H8 PolarHBondContact O-ND1 2.98Å; H8-Y10 HydrophobicContact CB-CD2 4.44Å; H8-Y10 HydrophobicContact CB-CE2 3.66Å; H8-Y10 WeakPolarHBondContact O-CD2 3.39Å
9	R	70.9	Confident	62.4	Low	248 Å²	248	122.4 Å²	122.4	94%	0.936	62%	0.622	S	S	*	*			trans	-91.3	103.9	177.9	-70.2	-173.1	65.8	149.4	0.7	111.4
10	Y	72.8	Confident	61.6	Low	40 Å²	40	123.3 Å²	123.3	16%	0.157	63%	0.628	C	S	.	*			trans	-85.3	136.3	177.5	-65.4	-81.6	0	0	0	112.6	L4 R5 H8 L12 D109 L111	L4-Y10 HydrophobicContact CB-CD2 4.41Å; L4-Y10 HydrophobicContact CB-CE2 3.87Å; L4-Y10 HydrophobicContact CD2-CD1 4.22Å; L4-Y10 HydrophobicContact CD2-CD2 3.95Å; L4-Y10 HydrophobicContact CD2-CE1 4.19Å; L4-Y10 HydrophobicContact CD2-CE2 3.91Å; L4-Y10 HydrophobicContact CD2-CG 4.12Å; L4-Y10 HydrophobicContact CG-CE2 4.4Å; R5-Y10 PolarHBondContact N-OH 3.14Å; H8-Y10 HydrophobicContact CB-CD2 4.44Å; H8-Y10 HydrophobicContact CB-CE2 3.66Å; H8-Y10 WeakPolarHBondContact O-CD2 3.39Å; Y10-L12 PolarHBondContact O-N 2.92Å; Y10-D109 HydrophobicContact CD1-CB 3.71Å; Y10-D109 HydrophobicContact CE1-CB 3.63Å; Y10-D109 WeakPolarHBondContact CE1-OD2 3.37Å; Y10-L111 VanDerWaalsContact CB-CD1 3.49Å; Y10-L111 HydrophobicContact CD1-CD1 4.38Å; Y10-L111 HydrophobicContact CD1-CG 4.38Å; Y10-L111 HydrophobicContact CG-CD1 3.95Å; Y10-L111 HydrophobicContact CG-CG 4.4Å
11	G	65.6	Low	61.3	Low	34 Å²	34	121 Å²	121	35%	0.351	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.2	105.5	172	0	0	0	0	0	111.2	H110 L111	G11-H110 PolarHBondContact O-CE1 2.85Å; G11-H110 PolarHBondContact O-ND1 3.42Å; G11-L111 PolarHBondContact O-N 3.14Å
12	L	65	Low	61.3	Low	120 Å²	120	115.9 Å²	115.9	63%	0.628	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90	101.1	174	-84.6	162.1	0	0	0	110.7	Y10 C14 L111	Y10-L12 PolarHBondContact O-N 2.92Å; L12-C14 PolarHBondContact O-N 3.16Å; L12-L111 WeakPolarHBondContact CA-O 3.31Å; L12-L111 HydrophobicContact CD2-CB 3.52Å; L12-L111 HydrophobicContact CD2-CD1 3.91Å; L12-L111 HydrophobicContact CD2-CG 4.38Å; L12-L111 HydrophobicContact CG-CB 4.06Å; L12-L111 HydrophobicContact CG-CD1 4.09Å
13	S	62.1	Low	61.5	Low	42 Å²	42	118.1 Å²	118.1	29%	0.294	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.2	103.6	164.8	68.4	0	0	0	0	110.3	G15 H110 L111	S13-G15 PolarHBondContact O-N 3.32Å; S13-H110 VanDerWaalsContact CB-NE2 3.31Å; S13-H110 WeakPolarHBondContact CB-NE2 3.3Å; S13-H110 PolarHBondContact OG-NE2 2.85Å; S13-L111 PolarHBondContact N-O 2.87Å
14	C	56.3	Low	61.7	Low	100 Å²	100	121 Å²	121	68%	0.676	62%	0.616	S	S	*	*			trans	-73.2	80.7	153.4	-166.2	0	0	0	0	107.8	L12 K16	L12-C14 PolarHBondContact O-N 3.16Å; C14-K16 PolarHBondContact O-N 2.91Å
15	G	51.3	Low	61.7	Low	44 Å²	44	120.3 Å²	120.3	45%	0.454	62%	0.619	S	S	.	*			trans	-56.5	130.8	170	0	0	0	0	0	108.6	S13 I17	S13-G15 PolarHBondContact O-N 3.32Å; G15-I17 PolarHBondContact O-N 3.44Å
16	K	51.1	Low	61.9	Low	198 Å²	198	114.8 Å²	114.8	86%	0.861	60%	0.602	S	S	*	*			trans	-40.3	115.3	-172.9	-72.2	178.1	178.4	174.8	0	110.6	C14 N18	C14-K16 PolarHBondContact O-N 2.91Å; K16-N18 VanDerWaalsContact O-CA 3.26Å; K16-N18 WeakPolarHBondContact O-CA 3.46Å; K16-N18 PolarHBondContact O-N 3.29Å; K16-N18 VanDerWaalsContact O-N 3.16Å
17	I	52.2	Low	62.5	Low	151 Å²	151	110.9 Å²	110.9	77%	0.774	58%	0.581	S	S	*	*			trans	-45.3	122.5	-173.9	-54.3	172.9	0	0	0	109	G15 K19	G15-I17 PolarHBondContact O-N 3.44Å; I17-K19 PolarHBondContact O-N 3Å
18	N	48.6	Very low	63.2	Low	92 Å²	92	106 Å²	106	49%	0.492	56%	0.558	S	S	.	*			trans	-79.1	80.4	-136.4	-152.2	-23.6	0	0	0	114.3	K16 N20 N21	K16-N18 VanDerWaalsContact O-CA 3.26Å; K16-N18 WeakPolarHBondContact O-CA 3.46Å; K16-N18 PolarHBondContact O-N 3.29Å; K16-N18 VanDerWaalsContact O-N 3.16Å; N18-N20 PolarHBondContact O-N 3.42Å; N18-N20 WeakPolarHBondContact OD1-CA 3.49Å; N18-N20 PolarHBondContact OD1-N 3.19Å; N18-N20 VanDerWaalsContact OD1-N 3.15Å; N18-N21 PolarHBondContact O-N 3.47Å; N18-N21 VanDerWaalsContact O-N 3.16Å; N18-N21 PolarHBondContact OD1-N 3.07Å; N18-N21 VanDerWaalsContact OD1-N 3.17Å
19	K	49.9	Very low	64	Low	199 Å²	199	104.5 Å²	104.5	87%	0.865	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-11.6	168.6	-73.4	-166.8	174.1	-172.6	0	113.5	I17	I17-K19 PolarHBondContact O-N 3Å
20	N	46.8	Very low	64.9	Low	139 Å²	139	98.8 Å²	98.8	74%	0.743	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	4.2	-178	-67.7	20.9	0	0	0	114.2	N18	N18-N20 PolarHBondContact O-N 3.42Å; N18-N20 WeakPolarHBondContact OD1-CA 3.49Å; N18-N20 PolarHBondContact OD1-N 3.19Å; N18-N20 VanDerWaalsContact OD1-N 3.15Å
21	N	54	Low	65.7	Low	77 Å²	77	99.3 Å²	99.3	41%	0.412	54%	0.543	S	S	.	.			trans	-145.3	76.3	170.6	-88.4	-75	0	0	0	112.5	N18 S23	N18-N21 PolarHBondContact O-N 3.47Å; N18-N21 VanDerWaalsContact O-N 3.16Å; N18-N21 PolarHBondContact OD1-N 3.07Å; N18-N21 VanDerWaalsContact OD1-N 3.17Å; N21-S23 PolarHBondContact O-N 3.43Å
22	P	54.3	Low	66.9	Low	130 Å²	130	98.9 Å²	98.9	84%	0.844	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	7.4	175.7	33.4	-37.2	0	0	0	114.3
23	S	60.9	Low	67.9	Low	93 Å²	93	98.4 Å²	98.4	65%	0.65	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-3.4	-168.2	53.3	0	0	0	0	115.4	N21	N21-S23 PolarHBondContact O-N 3.43Å
24	Q	70.6	Confident	69	Low	136 Å²	136	96.9 Å²	96.9	64%	0.636	52%	0.521	S	S	*	.			trans	-101.7	101.3	-177.7	-64.5	-171.9	9.8	0	0	111.5
25	S	73.6	Confident	70.6	Confident	84 Å²	84	92.3 Å²	92.3	59%	0.587	49%	0.49	S	S	*	.			trans	-85.8	123.6	172.2	-55	0	0	0	0	110.9
26	L	80.4	Confident	72.4	Confident	55 Å²	55	93.3 Å²	93.3	29%	0.288	48%	0.484	S	S	.	.			trans	-93.7	130.7	176	-61.7	177.6	0	0	0	110.8	C98 K114 I117	L26-C98 HydrophobicContact CD1-CB 3.85Å; L26-K114 HydrophobicContact CD1-CB 3.86Å; L26-K114 WeakPolarHBondContact CD1-O 3.48Å; L26-I117 HydrophobicContact CB-CG1 4.15Å; L26-I117 HydrophobicContact CD1-CG1 4.47Å
27	Y	83.4	Confident	74.1	Confident	76 Å²	76	88.5 Å²	88.5	30%	0.298	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.3	-179.8	-64.5	-72.8	0	0	0	111.8	V29 F57 L84 D119 I121	Y27-V29 PolarHBondContact O-N 3.2Å; Y27-V29 VanDerWaalsContact O-N 3.14Å; Y27-F57 HydrophobicContact CE2-CZ 4.32Å; Y27-L84 HydrophobicContact CD1-CD1 3.78Å; Y27-L84 HydrophobicContact CE1-CD1 3.75Å; Y27-D119 WeakPolarHBondContact CA-O 3.21Å; Y27-D119 HydrophobicContact CD1-CB 3.45Å; Y27-D119 VanDerWaalsContact CD1-CB 3.45Å; Y27-D119 HydrophobicContact CE1-CB 3.45Å; Y27-D119 VanDerWaalsContact CE1-CB 3.45Å; Y27-I121 HydrophobicContact CD1-CD1 4.11Å; Y27-I121 HydrophobicContact CD1-CG1 4.14Å; Y27-I121 HydrophobicContact CD2-CD1 4.18Å; Y27-I121 HydrophobicContact CG-CD1 3.75Å; Y27-I121 HydrophobicContact CG-CG1 4.2Å
28	H	86.2	Confident	75.8	Confident	68 Å²	68	82 Å²	82	32%	0.315	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	99.5	165.6	-174.9	152.9	0	0	0	108	K30 I117 D119 K120 I121	H28-K30 PolarHBondContact O-N 3.2Å; H28-I117 HydrophobicContact CB-CG2 3.89Å; H28-I117 VanDerWaalsContact N-CG2 3.31Å; H28-D119 PolarHBondContact N-O 2.85Å; H28-K120 HydrophobicContact CB-CB 4.25Å; H28-K120 HydrophobicContact CB-CG 4.11Å; H28-K120 CarbonylContact O-C 3.5Å; H28-K120 WeakPolarHBondContact O-CA 3.3Å; H28-K120 WeakPolarHBondContact O-CG 3.5Å; H28-I121 PolarHBondContact O-N 3.03Å
29	V	88.4	Confident	77.7	Confident	68 Å²	68	80 Å²	80	41%	0.412	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	104.6	178.3	-168.2	0	0	0	0	110.7	Y27 L31 I121 V123	Y27-V29 PolarHBondContact O-N 3.2Å; Y27-V29 VanDerWaalsContact O-N 3.14Å; V29-L31 HydrophobicContact CG1-CD2 3.58Å; V29-L31 HydrophobicContact CG1-CG 3.97Å; V29-L31 PolarHBondContact O-N 2.69Å; V29-I121 CarbonylContact C-O 3.57Å; V29-I121 WeakPolarHBondContact CA-O 3.39Å; V29-I121 HydrophobicContact CG1-CB 4.3Å; V29-I121 HydrophobicContact CG1-CG2 4.09Å; V29-I121 HydrophobicContact CG2-CB 4.3Å; V29-I121 HydrophobicContact CG2-CD1 4.33Å; V29-V123 HydrophobicContact CG1-CG2 4.29Å
30	K	90.5	Very high	79.6	Confident	128 Å²	128	75.2 Å²	75.2	56%	0.557	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	101.5	165	-176.3	175.9	179.4	179.2	0	109	H28 I121 V123	H28-K30 PolarHBondContact O-N 3.2Å; K30-I121 PolarHBondContact N-O 3.09Å; K30-V123 PolarHBondContact O-N 3.41Å
31	L	89.4	Confident	81.5	Confident	52 Å²	52	70.9 Å²	70.9	27%	0.272	38%	0.381	S	S	.	.			trans	-79.9	162.1	172.3	-61.4	176.1	0	0	0	111.6	V29 A35 I36 L39 V123	V29-L31 HydrophobicContact CG1-CD2 3.58Å; V29-L31 HydrophobicContact CG1-CG 3.97Å; V29-L31 PolarHBondContact O-N 2.69Å; L31-A35 HydrophobicContact CD2-CB 4.32Å; L31-I36 HydrophobicContact CB-CD1 4.08Å; L31-I36 HydrophobicContact CB-CG1 3.62Å; L31-I36 HydrophobicContact CD1-CG1 3.77Å; L31-I36 HydrophobicContact CG-CG1 4.36Å; L31-L39 HydrophobicContact CD1-CD1 3.7Å; L31-L39 HydrophobicContact CD2-CD1 4.48Å; L31-V123 HydrophobicContact CD2-CG2 3.85Å
32	T	89.4	Confident	83	Confident	25 Å²	25	68.1 Å²	68.1	15%	0.153	37%	0.366	C	S	.	.			trans	-99.9	154.5	162.8	57.6	0	0	0	0	109.8	T34 A35 I36 V123 A125	T32-T34 PolarHBondContact O-N 3.15Å; T32-A35 WeakPolarHBondContact O-CA 3.48Å; T32-A35 WeakPolarHBondContact O-CB 3.45Å; T32-A35 PolarHBondContact O-N 2.96Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 2.82Å; T32-V123 WeakPolarHBondContact CG2-O 3.32Å; T32-A125 HydrophobicContact CG2-CB 4.34Å
33	D	86.6	Confident	84.5	Confident	109 Å²	109	68.2 Å²	68.2	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-54.8	-31.6	-176.8	-42	-3	0	0	0	112.8	I36 R37	D33-I36 PolarHBondContact O-N 2.71Å; D33-R37 WeakPolarHBondContact O-CB 3.2Å; D33-R37 WeakPolarHBondContact O-CG 3.3Å; D33-R37 PolarHBondContact O-N 3.32Å; D33-R37 PolarHBondContact O-NH1 3.17Å
34	T	86.3	Confident	85.5	Confident	11 Å²	11	70.4 Å²	70.4	7%	0.067	36%	0.36	C	S	.	.	H	α-helix	trans	-74.8	-32.7	177.7	-58.2	0	0	0	0	111.9	T32 R37 T38 F80 S129	T32-T34 PolarHBondContact O-N 3.15Å; T34-R37 PolarHBondContact OG1-NH2 2.79Å; T34-T38 WeakPolarHBondContact O-CB 3.42Å; T34-T38 PolarHBondContact O-N 2.92Å; T34-T38 PolarHBondContact O-OG1 3.03Å; T34-F80 HydrophobicContact CG2-CE1 4.18Å; T34-S129 WeakPolarHBondContact OG1-CB 3.22Å; T34-S129 PolarHBondContact OG1-OG 3.16Å
35	A	88.8	Confident	85.8	Confident	3 Å²	3	67.4 Å²	67.4	3%	0.025	35%	0.347	C	S	.	.	H	α-helix	trans	-69.5	-42.5	168.4	0	0	0	0	0	111.4	L31 T32 T38 L39 F80 V123	L31-A35 HydrophobicContact CD2-CB 4.32Å; T32-A35 WeakPolarHBondContact O-CA 3.48Å; T32-A35 WeakPolarHBondContact O-CB 3.45Å; T32-A35 PolarHBondContact O-N 2.96Å; A35-T38 PolarHBondContact O-N 3.3Å; A35-L39 WeakPolarHBondContact O-CG 3.41Å; A35-L39 PolarHBondContact O-N 3.21Å; A35-F80 HydrophobicContact CB-CD1 3.8Å; A35-F80 HydrophobicContact CB-CD2 4.49Å; A35-F80 HydrophobicContact CB-CE1 3.85Å; A35-F80 HydrophobicContact CB-CG 4.16Å; A35-F80 HydrophobicContact CB-CZ 4.22Å; A35-V123 HydrophobicContact CB-CG1 4.32Å
36	I	88.8	Confident	85.4	Confident	65 Å²	65	70.6 Å²	70.6	33%	0.333	35%	0.351	S	S	.	.	H	α-helix	trans	-58.1	-56.6	176.2	-63.7	171.5	0	0	0	110.4	L31 T32 D33 T38 L39 E40	L31-I36 HydrophobicContact CB-CD1 4.08Å; L31-I36 HydrophobicContact CB-CG1 3.62Å; L31-I36 HydrophobicContact CD1-CG1 3.77Å; L31-I36 HydrophobicContact CG-CG1 4.36Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 2.82Å; D33-I36 PolarHBondContact O-N 2.71Å; I36-T38 PolarHBondContact O-N 3.37Å; I36-T38 VanDerWaalsContact O-N 3.14Å; I36-L39 WeakPolarHBondContact O-CA 3.25Å; I36-L39 WeakPolarHBondContact O-CB 3.33Å; I36-L39 PolarHBondContact O-N 2.87Å; I36-E40 HydrophobicContact CG2-CG 4.33Å; I36-E40 WeakPolarHBondContact CG2-OE1 3.43Å; I36-E40 WeakPolarHBondContact O-CG 3.2Å; I36-E40 PolarHBondContact O-N 3.42Å
37	R	87.6	Confident	84.5	Confident	97 Å²	97	73.1 Å²	73.1	37%	0.366	38%	0.38	S	S	.	.	H	α-helix	trans	-59.3	-28.8	178.6	-70.1	-172.5	-51	-85.5	-4.8	113.8	D33 T34 E40 A41	D33-R37 WeakPolarHBondContact O-CB 3.2Å; D33-R37 WeakPolarHBondContact O-CG 3.3Å; D33-R37 PolarHBondContact O-N 3.32Å; D33-R37 PolarHBondContact O-NH1 3.17Å; T34-R37 PolarHBondContact OG1-NH2 2.79Å; R37-E40 WeakPolarHBondContact CA-OE2 3.42Å; R37-A41 VanDerWaalsContact O-CB 3.25Å; R37-A41 WeakPolarHBondContact O-CB 3.31Å; R37-A41 PolarHBondContact O-N 3.34Å
38	T	88.3	Confident	83.4	Confident	15 Å²	15	74.5 Å²	74.5	9%	0.092	40%	0.4	C	S	.	.	H	α-helix	trans	-75	-36.9	175.6	-55	0	0	0	0	111.6	T34 A35 I36 F42 I66 A68 R78 F80	T34-T38 WeakPolarHBondContact O-CB 3.42Å; T34-T38 PolarHBondContact O-N 2.92Å; T34-T38 PolarHBondContact O-OG1 3.03Å; A35-T38 PolarHBondContact O-N 3.3Å; I36-T38 PolarHBondContact O-N 3.37Å; I36-T38 VanDerWaalsContact O-N 3.14Å; T38-F42 WeakPolarHBondContact O-CB 3.26Å; T38-F42 PolarHBondContact O-N 2.98Å; T38-I66 HydrophobicContact CG2-CB 3.89Å; T38-I66 HydrophobicContact CG2-CD1 4.02Å; T38-I66 HydrophobicContact CG2-CG2 3.88Å; T38-A68 HydrophobicContact CG2-CB 4.32Å; T38-R78 HydrophobicContact CG2-CB 3.97Å; T38-R78 HydrophobicContact CG2-CG 3.88Å; T38-F80 HydrophobicContact CG2-CE2 4.13Å; T38-F80 HydrophobicContact CG2-CZ 4.32Å
39	L	87.7	Confident	82.5	Confident	51 Å²	51	73.8 Å²	73.8	27%	0.267	40%	0.399	S	S	.	.	H	α-helix	trans	-65.2	-43.9	171.2	-70.8	166.2	0	0	0	111.4	L31 A35 I36 F42 Q43 I66	L31-L39 HydrophobicContact CD1-CD1 3.7Å; L31-L39 HydrophobicContact CD2-CD1 4.48Å; A35-L39 WeakPolarHBondContact O-CG 3.41Å; A35-L39 PolarHBondContact O-N 3.21Å; I36-L39 WeakPolarHBondContact O-CA 3.25Å; I36-L39 WeakPolarHBondContact O-CB 3.33Å; I36-L39 PolarHBondContact O-N 2.87Å; L39-F42 PolarHBondContact O-N 2.93Å; L39-Q43 VanDerWaalsContact O-CG 3.3Å; L39-Q43 WeakPolarHBondContact O-CG 3.37Å; L39-Q43 PolarHBondContact O-N 2.84Å; L39-I66 HydrophobicContact CD2-CD1 3.58Å; L39-I66 HydrophobicContact CD2-CG1 4.32Å; L39-I66 HydrophobicContact CG-CD1 3.69Å
40	E	89.3	Confident	81.6	Confident	97 Å²	97	76 Å²	76	45%	0.453	42%	0.417	S	S	.	.	H	α-helix	trans	-61.6	-48.3	176.6	-67.8	167.6	160.6	0	0	111.4	I36 R37 F42 Q43 N44	I36-E40 HydrophobicContact CG2-CG 4.33Å; I36-E40 WeakPolarHBondContact CG2-OE1 3.43Å; I36-E40 WeakPolarHBondContact O-CG 3.2Å; I36-E40 PolarHBondContact O-N 3.42Å; R37-E40 WeakPolarHBondContact CA-OE2 3.42Å; E40-F42 VanDerWaalsContact C-N 3.33Å; E40-F42 PolarHBondContact O-N 2.91Å; E40-Q43 PolarHBondContact O-N 2.9Å; E40-N44 PolarHBondContact O-N 3.47Å; E40-N44 PolarHBondContact O-ND2 3.03Å
41	A	86.9	Confident	81	Confident	48 Å²	48	72.1 Å²	72.1	40%	0.397	40%	0.402	S	S	.	.	H	α-helix	trans	-60.1	-42.1	175.3	0	0	0	0	0	112	R37 N44 L45	R37-A41 VanDerWaalsContact O-CB 3.25Å; R37-A41 WeakPolarHBondContact O-CB 3.31Å; R37-A41 PolarHBondContact O-N 3.34Å; A41-N44 PolarHBondContact O-N 2.85Å; A41-L45 WeakPolarHBondContact O-CB 3.4Å; A41-L45 VanDerWaalsContact O-CG 3.3Å; A41-L45 WeakPolarHBondContact O-CG 3.45Å; A41-L45 PolarHBondContact O-N 2.68Å
42	F	86.1	Confident	80.7	Confident	19 Å²	19	77 Å²	77	8%	0.083	42%	0.423	C	S	.	.	H	α-helix	trans	-64.6	-39.8	175.2	177.7	-97.4	0	0	0	112.6	T38 L39 E40 N44 L45 K46 L49 N51 P53 I66 P67	T38-F42 WeakPolarHBondContact O-CB 3.26Å; T38-F42 PolarHBondContact O-N 2.98Å; L39-F42 PolarHBondContact O-N 2.93Å; E40-F42 VanDerWaalsContact C-N 3.33Å; E40-F42 PolarHBondContact O-N 2.91Å; F42-N44 VanDerWaalsContact C-N 3.33Å; F42-N44 PolarHBondContact O-N 2.81Å; F42-L45 CarbonylContact O-C 3.55Å; F42-L45 PolarHBondContact O-N 2.69Å; F42-K46 PolarHBondContact O-N 3.41Å; F42-L49 HydrophobicContact CD2-CD1 3.98Å; F42-L49 HydrophobicContact CE2-CD1 3.96Å; F42-N51 WeakPolarHBondContact CE2-O 3.42Å; F42-P53 HydrophobicContact CD1-CG 4.43Å; F42-P53 HydrophobicContact CE1-CG 4.05Å; F42-I66 HydrophobicContact CB-CG2 3.8Å; F42-I66 HydrophobicContact CD2-CG2 4.43Å; F42-I66 HydrophobicContact CG-CG2 4.04Å; F42-P67 HydrophobicContact CD2-CB 3.92Å; F42-P67 HydrophobicContact CD2-CG 4.06Å; F42-P67 HydrophobicContact CE2-CB 3.87Å; F42-P67 HydrophobicContact CE2-CG 3.69Å
43	Q	84.6	Confident	80.6	Confident	132 Å²	132	78.3 Å²	78.3	62%	0.617	43%	0.433	S	S	*	.	H	α-helix	trans	-60.6	-42.9	175.2	-74.9	174.3	23.6	0	0	111.6	L39 E40 L45 K46	L39-Q43 VanDerWaalsContact O-CG 3.3Å; L39-Q43 WeakPolarHBondContact O-CG 3.37Å; L39-Q43 PolarHBondContact O-N 2.84Å; E40-Q43 PolarHBondContact O-N 2.9Å; Q43-L45 VanDerWaalsContact C-N 3.29Å; Q43-L45 PolarHBondContact O-N 2.82Å; Q43-K46 VanDerWaalsContact O-CB 3.22Å; Q43-K46 WeakPolarHBondContact O-CB 3.44Å; Q43-K46 PolarHBondContact O-N 3.36Å
44	N	82.8	Confident	80.8	Confident	140 Å²	140	77 Å²	77	75%	0.749	43%	0.428	S	S	*	.	H	α-helix	trans	-67.2	-27.9	176.5	-65.9	-27.4	0	0	0	113.1	E40 A41 F42	E40-N44 PolarHBondContact O-N 3.47Å; E40-N44 PolarHBondContact O-ND2 3.03Å; A41-N44 PolarHBondContact O-N 2.85Å; F42-N44 VanDerWaalsContact C-N 3.33Å; F42-N44 PolarHBondContact O-N 2.81Å
45	L	76.9	Confident	81.1	Confident	72 Å²	72	80.3 Å²	80.3	38%	0.377	45%	0.445	S	S	.	.	H	α-helix	trans	-90.1	-5.2	177.3	-68.5	168.5	0	0	0	114	A41 F42 Q43 A47 S48 L49 P69	A41-L45 WeakPolarHBondContact O-CB 3.4Å; A41-L45 VanDerWaalsContact O-CG 3.3Å; A41-L45 WeakPolarHBondContact O-CG 3.45Å; A41-L45 PolarHBondContact O-N 2.68Å; F42-L45 CarbonylContact O-C 3.55Å; F42-L45 PolarHBondContact O-N 2.69Å; Q43-L45 VanDerWaalsContact C-N 3.29Å; Q43-L45 PolarHBondContact O-N 2.82Å; L45-A47 PolarHBondContact O-N 3.16Å; L45-S48 PolarHBondContact O-N 3.36Å; L45-L49 HydrophobicContact CB-CD1 3.72Å; L45-L49 HydrophobicContact CB-CG 4.24Å; L45-L49 HydrophobicContact CD1-CD1 4.36Å; L45-P69 HydrophobicContact CD1-CG 4.12Å
46	K	65.9	Low	81.2	Confident	151 Å²	151	82.2 Å²	82.2	66%	0.657	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.2	-168.1	-169.8	178.6	176.1	-172.2	0	114.8	F42 Q43 S48	F42-K46 PolarHBondContact O-N 3.41Å; Q43-K46 VanDerWaalsContact O-CB 3.22Å; Q43-K46 WeakPolarHBondContact O-CB 3.44Å; Q43-K46 PolarHBondContact O-N 3.36Å; K46-S48 VanDerWaalsContact C-N 3.29Å; K46-S48 PolarHBondContact O-N 3.03Å
47	A	59.8	Low	81.3	Confident	109 Å²	109	83.3 Å²	83.3	90%	0.901	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.3	175.2	0	0	0	0	0	114.5	L45	L45-A47 PolarHBondContact O-N 3.16Å
48	S	61.4	Low	81.4	Confident	104 Å²	104	87.2 Å²	87.2	73%	0.727	48%	0.479	S	S	*	.	S	Bend	trans	-131.1	7.5	-167.5	-169.8	0	0	0	0	115	L45 K46	L45-S48 PolarHBondContact O-N 3.36Å; K46-S48 VanDerWaalsContact C-N 3.29Å; K46-S48 PolarHBondContact O-N 3.03Å
49	L	66.9	Low	81.4	Confident	54 Å²	54	89.5 Å²	89.5	28%	0.283	51%	0.506	S	S	.	.			trans	-122.6	132.7	-175.2	-60.5	179.3	0	0	0	112.2	F42 L45 P67 P69	F42-L49 HydrophobicContact CD2-CD1 3.98Å; F42-L49 HydrophobicContact CE2-CD1 3.96Å; L45-L49 HydrophobicContact CB-CD1 3.72Å; L45-L49 HydrophobicContact CB-CG 4.24Å; L45-L49 HydrophobicContact CD1-CD1 4.36Å; L49-P67 HydrophobicContact CD1-CB 4.47Å; L49-P69 HydrophobicContact CD1-CG 4.26Å; L49-P69 HydrophobicContact CD2-CG 4.05Å
50	S	68.9	Low	81.3	Confident	113 Å²	113	90.9 Å²	90.9	79%	0.79	52%	0.52	S	S	*	.	S	Bend	trans	-72.6	-27.2	174.1	51.1	0	0	0	0	113.7
51	N	78.2	Confident	81.4	Confident	48 Å²	48	91.2 Å²	91.2	26%	0.257	52%	0.522	S	S	.	.			trans	-91.5	143.4	-167.6	-60.6	-4.2	0	0	0	110.8	F42 P67 D75 F77	F42-N51 WeakPolarHBondContact CE2-O 3.42Å; N51-P67 HydrophobicContact CB-CB 4.1Å; N51-P67 HydrophobicContact CB-CG 3.68Å; N51-D75 PolarHBondContact ND2-OD1 2.75Å; N51-F77 HydrophobicContact CB-CE1 4.39Å; N51-F77 HydrophobicContact CB-CZ 4.2Å; N51-F77 WeakPolarHBondContact ND2-CZ 3.41Å
52	Q	83.1	Confident	81.6	Confident	153 Å²	153	89.4 Å²	89.4	72%	0.715	51%	0.508	S	S	*	.			trans	-108.2	153.7	177	-63.9	-169	16.2	0	0	111.7
53	P	88.1	Confident	81.9	Confident	54 Å²	54	92.7 Å²	92.7	35%	0.351	52%	0.52	S	S	.	.			trans	-69.2	142.5	170.1	29.9	-35	0	0	0	110.9	F42 K65 I66	F42-P53 HydrophobicContact CD1-CG 4.43Å; F42-P53 HydrophobicContact CE1-CG 4.05Å; P53-K65 CarbonylContact C-O 3.56Å; P53-K65 WeakPolarHBondContact CA-O 3.36Å; P53-I66 HydrophobicContact CB-CG1 4.39Å; P53-I66 HydrophobicContact CB-CG2 4.41Å
54	V	90.5	Very high	82.3	Confident	81 Å²	81	87.7 Å²	87.7	49%	0.491	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.7	-176	179.2	0	0	0	0	109.9	I64 K65	V54-I64 CarbonylContact O-C 3.54Å; V54-I64 WeakPolarHBondContact O-CA 3.48Å; V54-K65 PolarHBondContact N-O 3.26Å; V54-K65 PolarHBondContact O-N 2.67Å
55	I	92.1	Very high	82.7	Confident	81 Å²	81	85 Å²	85	42%	0.415	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.8	169.6	-171.2	166.1	0	0	0	110.2	F57 I64 F82 I121	I55-F57 HydrophobicContact CD1-CE1 4.5Å; I55-F57 HydrophobicContact CD1-CE2 3.79Å; I55-F57 HydrophobicContact CD1-CZ 3.65Å; I55-F57 HydrophobicContact CG1-CD2 4.37Å; I55-F57 HydrophobicContact CG1-CE2 3.81Å; I55-F57 HydrophobicContact CG1-CZ 4.15Å; I55-F57 HydrophobicContact CG2-CE2 4.17Å; I55-I64 HydrophobicContact CB-CG1 4.26Å; I55-I64 HydrophobicContact CD1-CD1 4.3Å; I55-I64 HydrophobicContact CD1-CG1 3.93Å; I55-I64 HydrophobicContact CG1-CG1 3.85Å; I55-F82 HydrophobicContact CD1-CE1 3.89Å; I55-F82 HydrophobicContact CD1-CZ 4.02Å; I55-F82 HydrophobicContact CG1-CE1 3.71Å; I55-F82 HydrophobicContact CG1-CZ 4Å; I55-I121 HydrophobicContact CD1-CD1 4.19Å
56	C	92.3	Very high	83.3	Confident	42 Å²	42	81.6 Å²	81.6	28%	0.284	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	123.8	-179.7	-176.6	0	0	0	0	109.9	G62 Y63	C56-G62 CarbonylContact O-C 3.59Å; C56-G62 WeakPolarHBondContact O-CA 3.1Å; C56-Y63 HydrophobicContact CB-CD1 4.22Å; C56-Y63 HydrophobicContact CB-CD2 4.08Å; C56-Y63 HydrophobicContact CB-CE1 3.78Å; C56-Y63 HydrophobicContact CB-CE2 3.61Å; C56-Y63 HydrophobicContact CB-CG 4.36Å; C56-Y63 VanDerWaalsContact CB-CZ 3.46Å; C56-Y63 PolarHBondContact N-O 2.79Å; C56-Y63 PolarHBondContact O-N 2.99Å
57	F	90.6	Very high	84.4	Confident	88 Å²	88	74.7 Å²	74.7	39%	0.386	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	143.2	177.2	-65.2	-96.2	0	0	0	110.7	Y27 I55 F82 I121	Y27-F57 HydrophobicContact CE2-CZ 4.32Å; I55-F57 HydrophobicContact CD1-CE1 4.5Å; I55-F57 HydrophobicContact CD1-CE2 3.79Å; I55-F57 HydrophobicContact CD1-CZ 3.65Å; I55-F57 HydrophobicContact CG1-CD2 4.37Å; I55-F57 HydrophobicContact CG1-CE2 3.81Å; I55-F57 HydrophobicContact CG1-CZ 4.15Å; I55-F57 HydrophobicContact CG2-CE2 4.17Å; F57-F82 AromaticContact CD1-CE2 3.75Å; F57-F82 HydrophobicContact CD1-CE2 3.75Å; F57-F82 AromaticContact CD1-CZ 3.64Å; F57-F82 HydrophobicContact CD1-CZ 3.64Å; F57-F82 AromaticContact CE1-CE2 3.73Å; F57-F82 HydrophobicContact CE1-CE2 3.73Å; F57-F82 AromaticContact CE1-CZ 3.65Å; F57-F82 HydrophobicContact CE1-CZ 3.65Å; F57-F82 HydrophobicContact CG-CZ 4.13Å; F57-F82 HydrophobicContact CZ-CZ 4.15Å; F57-I121 HydrophobicContact CE1-CD1 3.76Å; F57-I121 HydrophobicContact CE1-CG1 4.37Å; F57-I121 HydrophobicContact CZ-CD1 3.76Å
58	K	89.4	Confident	85.5	Confident	179 Å²	179	70.4 Å²	70.4	78%	0.778	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.9	67.9	179.7	-168.1	-177.1	177.1	-178.1	0	109.5	Q61	K58-Q61 CarbonylContact C-O 3.57Å; K58-Q61 VanDerWaalsContact C-O 3.29Å; K58-Q61 WeakPolarHBondContact CA-O 3.18Å; K58-Q61 PolarHBondContact N-O 2.69Å
59	G	87.1	Confident	86.2	Confident	63 Å²	63	67.5 Å²	67.5	65%	0.649	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	-135.2	-170.9	0	0	0	0	0	111.3	Q61	G59-Q61 PolarHBondContact O-N 3.34Å; G59-Q61 VanDerWaalsContact O-N 3.09Å
60	S	86.6	Confident	86.7	Confident	80 Å²	80	67.8 Å²	67.8	56%	0.559	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	11.7	178	55.6	0	0	0	0	114.8	L84	S60-L84 PolarHBondContact O-N 2.98Å
61	Q	90.3	Very high	86.8	Confident	104 Å²	104	69.1 Å²	69.1	49%	0.486	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	163.3	177.6	-67.3	179.8	17.6	0	0	110	K58 G59 F82 Y83	K58-Q61 CarbonylContact C-O 3.57Å; K58-Q61 VanDerWaalsContact C-O 3.29Å; K58-Q61 WeakPolarHBondContact CA-O 3.18Å; K58-Q61 PolarHBondContact N-O 2.69Å; G59-Q61 PolarHBondContact O-N 3.34Å; G59-Q61 VanDerWaalsContact O-N 3.09Å; Q61-F82 CarbonylContact C-O 3.46Å; Q61-F82 VanDerWaalsContact CA-O 3.31Å; Q61-F82 WeakPolarHBondContact CA-O 3.33Å; Q61-Y83 HydrophobicContact CG-CD1 3.69Å; Q61-Y83 HydrophobicContact CG-CE1 3.89Å
62	G	92.5	Very high	86.5	Confident	10 Å²	10	75.1 Å²	75.1	10%	0.103	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	-168.5	174.4	0	0	0	0	0	112.8	C56 S81 F82	C56-G62 CarbonylContact O-C 3.59Å; C56-G62 WeakPolarHBondContact O-CA 3.1Å; G62-S81 CarbonylContact O-C 3.52Å; G62-S81 WeakPolarHBondContact O-CA 3.46Å; G62-F82 VanDerWaalsContact C-CD1 3.44Å; G62-F82 VanDerWaalsContact C-CE1 3.42Å; G62-F82 PolarHBondContact N-O 2.96Å; G62-F82 PolarHBondContact O-N 2.98Å
63	Y	92.5	Very high	86.1	Confident	89 Å²	89	70.2 Å²	70.2	35%	0.349	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154.4	171	63.4	-98.1	0	0	0	112.6	C56 K65 V79 F80	C56-Y63 HydrophobicContact CB-CD1 4.22Å; C56-Y63 HydrophobicContact CB-CD2 4.08Å; C56-Y63 HydrophobicContact CB-CE1 3.78Å; C56-Y63 HydrophobicContact CB-CE2 3.61Å; C56-Y63 HydrophobicContact CB-CG 4.36Å; C56-Y63 VanDerWaalsContact CB-CZ 3.46Å; C56-Y63 PolarHBondContact N-O 2.79Å; C56-Y63 PolarHBondContact O-N 2.99Å; Y63-K65 HydrophobicContact CD2-CD 4.42Å; Y63-K65 HydrophobicContact CD2-CG 3.8Å; Y63-K65 HydrophobicContact CE2-CD 3.93Å; Y63-K65 HydrophobicContact CE2-CG 3.79Å; Y63-V79 HydrophobicContact CD2-CG1 4.19Å; Y63-V79 HydrophobicContact CG-CG1 4.33Å; Y63-F80 CarbonylContact C-O 3.33Å; Y63-F80 WeakPolarHBondContact CA-O 3.43Å
64	I	92.1	Very high	85.3	Confident	26 Å²	26	73.1 Å²	73.1	13%	0.133	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.8	170.1	-58.1	165.1	0	0	0	107.3	V54 I55 I66 V79 F80 F82 V123	V54-I64 CarbonylContact O-C 3.54Å; V54-I64 WeakPolarHBondContact O-CA 3.48Å; I55-I64 HydrophobicContact CB-CG1 4.26Å; I55-I64 HydrophobicContact CD1-CD1 4.3Å; I55-I64 HydrophobicContact CD1-CG1 3.93Å; I55-I64 HydrophobicContact CG1-CG1 3.85Å; I64-I66 HydrophobicContact CG2-CD1 4.35Å; I64-I66 HydrophobicContact CG2-CG1 3.9Å; I64-V79 WeakPolarHBondContact O-CA 3.45Å; I64-F80 PolarHBondContact N-O 3.46Å; I64-F80 PolarHBondContact O-N 2.79Å; I64-F82 HydrophobicContact CD1-CD1 4.42Å; I64-F82 HydrophobicContact CG1-CD1 4.04Å; I64-F82 HydrophobicContact CG1-CE1 4.11Å; I64-V123 HydrophobicContact CD1-CG2 4.02Å
65	K	91	Very high	84.6	Confident	83 Å²	83	74.3 Å²	74.3	36%	0.361	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.2	168.5	-65.3	-174	174.8	176.2	0	109	P53 V54 Y63 F77 R78 V79	P53-K65 CarbonylContact C-O 3.56Å; P53-K65 WeakPolarHBondContact CA-O 3.36Å; V54-K65 PolarHBondContact N-O 3.26Å; V54-K65 PolarHBondContact O-N 2.67Å; Y63-K65 HydrophobicContact CD2-CD 4.42Å; Y63-K65 HydrophobicContact CD2-CG 3.8Å; Y63-K65 HydrophobicContact CE2-CD 3.93Å; Y63-K65 HydrophobicContact CE2-CG 3.79Å; K65-F77 HydrophobicContact CB-CD1 4.36Å; K65-R78 WeakPolarHBondContact CA-O 3.34Å; K65-V79 HydrophobicContact CG-CG1 4.13Å; K65-V79 HydrophobicContact CG-CG2 4.14Å
66	I	90.1	Very high	84.1	Confident	2 Å²	2	71 Å²	71	1%	0.01	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128.1	175.7	-49.3	174.7	0	0	0	108.1	T38 L39 F42 P53 I64 A68 F77 R78 F80	T38-I66 HydrophobicContact CG2-CB 3.89Å; T38-I66 HydrophobicContact CG2-CD1 4.02Å; T38-I66 HydrophobicContact CG2-CG2 3.88Å; L39-I66 HydrophobicContact CD2-CD1 3.58Å; L39-I66 HydrophobicContact CD2-CG1 4.32Å; L39-I66 HydrophobicContact CG-CD1 3.69Å; F42-I66 HydrophobicContact CB-CG2 3.8Å; F42-I66 HydrophobicContact CD2-CG2 4.43Å; F42-I66 HydrophobicContact CG-CG2 4.04Å; P53-I66 HydrophobicContact CB-CG1 4.39Å; P53-I66 HydrophobicContact CB-CG2 4.41Å; I64-I66 HydrophobicContact CG2-CD1 4.35Å; I64-I66 HydrophobicContact CG2-CG1 3.9Å; I66-A68 PolarHBondContact O-N 3.22Å; I66-F77 WeakPolarHBondContact O-CA 3.47Å; I66-R78 PolarHBondContact N-O 3.49Å; I66-R78 PolarHBondContact O-N 2.83Å; I66-F80 HydrophobicContact CD1-CD2 4.1Å; I66-F80 HydrophobicContact CD1-CE2 3.84Å; I66-F80 HydrophobicContact CG1-CD2 4.45Å; I66-F80 HydrophobicContact CG1-CE2 4.35Å
67	P	88.3	Confident	83.8	Confident	6 Å²	6	73.1 Å²	73.1	4%	0.039	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	127.3	170.8	-21.4	32.1	0	0	0	110.3	F42 L49 N51 F77	F42-P67 HydrophobicContact CD2-CB 3.92Å; F42-P67 HydrophobicContact CD2-CG 4.06Å; F42-P67 HydrophobicContact CE2-CB 3.87Å; F42-P67 HydrophobicContact CE2-CG 3.69Å; L49-P67 HydrophobicContact CD1-CB 4.47Å; N51-P67 HydrophobicContact CB-CB 4.1Å; N51-P67 HydrophobicContact CB-CG 3.68Å; P67-F77 HydrophobicContact CB-CE1 4.39Å; P67-F77 HydrophobicContact CG-CD1 4.29Å; P67-F77 HydrophobicContact CG-CE1 3.93Å
68	A	82.8	Confident	83.7	Confident	18 Å²	18	73.4 Å²	73.4	15%	0.149	40%	0.403	C	S	.	.			trans	-146	70.5	-174.9	0	0	0	0	0	108.3	T38 I66 G76 R78	T38-A68 HydrophobicContact CG2-CB 4.32Å; I66-A68 PolarHBondContact O-N 3.22Å; A68-G76 CarbonylContact C-O 3.55Å; A68-G76 PolarHBondContact N-O 3.14Å; A68-R78 HydrophobicContact CB-CB 4.23Å; A68-R78 HydrophobicContact CB-CG 3.41Å; A68-R78 VanDerWaalsContact CB-CG 3.41Å
69	P	77.4	Confident	83.8	Confident	44 Å²	44	68.4 Å²	68.4	29%	0.286	39%	0.387	S	S	.	.			trans	-58.8	143.1	180	27.1	-36.9	0	0	0	110.7	L45 L49 P74	L45-P69 HydrophobicContact CD1-CG 4.12Å; L49-P69 HydrophobicContact CD1-CG 4.26Å; L49-P69 HydrophobicContact CD2-CG 4.05Å; P69-P74 WeakPolarHBondContact CB-O 3.37Å
70	T	77.1	Confident	84	Confident	59 Å²	59	65.4 Å²	65.4	36%	0.362	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-132.5	162.8	172.7	60.4	0	0	0	0	109.5	E72 S73	T70-E72 PolarHBondContact O-N 2.85Å; T70-E72 VanDerWaalsContact O-N 3.14Å; T70-S73 PolarHBondContact N-O 2.9Å; T70-S73 CarbonylContact O-C 3.12Å; T70-S73 PolarHBondContact O-N 2.91Å; T70-S73 VanDerWaalsContact O-O 3.13Å; T70-S73 PolarHBondContact OG1-N 2.92Å; T70-S73 PolarHBondContact OG1-OG 2.8Å
71	T	71.6	Confident	84.2	Confident	141 Å²	141	64.7 Å²	64.7	87%	0.865	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-34.1	178.4	-37.6	0	0	0	0	112.6
72	E	71	Confident	84.4	Confident	175 Å²	175	59.8 Å²	59.8	82%	0.818	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-15.2	178.1	-48.3	-54.9	124.6	0	0	113.7	T70	T70-E72 PolarHBondContact O-N 2.85Å; T70-E72 VanDerWaalsContact O-N 3.14Å
73	S	74	Confident	84.4	Confident	50 Å²	50	65.5 Å²	65.5	35%	0.35	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-155.6	98.8	-178.9	53.7	0	0	0	0	112.5	T70 D75 G76	T70-S73 PolarHBondContact N-O 2.9Å; T70-S73 CarbonylContact O-C 3.12Å; T70-S73 PolarHBondContact O-N 2.91Å; T70-S73 VanDerWaalsContact O-O 3.13Å; T70-S73 PolarHBondContact OG1-N 2.92Å; T70-S73 PolarHBondContact OG1-OG 2.8Å; S73-D75 VanDerWaalsContact C-N 3.31Å; S73-D75 PolarHBondContact O-N 2.94Å; S73-G76 PolarHBondContact O-N 3.09Å; S73-G76 VanDerWaalsContact O-N 3.16Å
74	P	71.9	Confident	84.2	Confident	115 Å²	115	63.1 Å²	63.1	75%	0.747	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-22.8	-179.6	27.9	-34.3	0	0	0	113.4	P69 G76	P69-P74 WeakPolarHBondContact CB-O 3.37Å; P74-G76 VanDerWaalsContact C-N 3.3Å
75	D	75.6	Confident	84	Confident	106 Å²	106	64.1 Å²	64.1	57%	0.567	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	30.8	170	-163.5	48.2	0	0	0	111.8	N51 S73 F77	N51-D75 PolarHBondContact ND2-OD1 2.75Å; S73-D75 VanDerWaalsContact C-N 3.31Å; S73-D75 PolarHBondContact O-N 2.94Å; D75-F77 WeakPolarHBondContact O-CD2 3.41Å; D75-F77 WeakPolarHBondContact O-CE2 3.45Å
76	G	82.5	Confident	83.4	Confident	12 Å²	12	63.1 Å²	63.1	12%	0.124	35%	0.354	C	S	.	.			trans	-66.5	136.9	179.3	0	0	0	0	0	112.4	A68 S73 P74	A68-G76 CarbonylContact C-O 3.55Å; A68-G76 PolarHBondContact N-O 3.14Å; S73-G76 PolarHBondContact O-N 3.09Å; S73-G76 VanDerWaalsContact O-N 3.16Å; P74-G76 VanDerWaalsContact C-N 3.3Å
77	F	86.2	Confident	82.2	Confident	86 Å²	86	65 Å²	65	38%	0.377	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.5	172.1	-69.5	-95.4	0	0	0	110.6	N51 K65 I66 P67 D75	N51-F77 HydrophobicContact CB-CE1 4.39Å; N51-F77 HydrophobicContact CB-CZ 4.2Å; N51-F77 WeakPolarHBondContact ND2-CZ 3.41Å; K65-F77 HydrophobicContact CB-CD1 4.36Å; I66-F77 WeakPolarHBondContact O-CA 3.47Å; P67-F77 HydrophobicContact CB-CE1 4.39Å; P67-F77 HydrophobicContact CG-CD1 4.29Å; P67-F77 HydrophobicContact CG-CE1 3.93Å; D75-F77 WeakPolarHBondContact O-CD2 3.41Å; D75-F77 WeakPolarHBondContact O-CE2 3.45Å
78	R	88.1	Confident	80.8	Confident	93 Å²	93	67.5 Å²	67.5	35%	0.351	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.2	163.6	-63.7	-94.2	-176	-129.8	-20.1	108.2	T38 K65 I66 A68 F80 D128	T38-R78 HydrophobicContact CG2-CB 3.97Å; T38-R78 HydrophobicContact CG2-CG 3.88Å; K65-R78 WeakPolarHBondContact CA-O 3.34Å; I66-R78 PolarHBondContact N-O 3.49Å; I66-R78 PolarHBondContact O-N 2.83Å; A68-R78 HydrophobicContact CB-CB 4.23Å; A68-R78 HydrophobicContact CB-CG 3.41Å; A68-R78 VanDerWaalsContact CB-CG 3.41Å; R78-F80 HydrophobicContact CB-CD2 4.45Å; R78-F80 HydrophobicContact CB-CE2 3.54Å; R78-F80 HydrophobicContact CB-CZ 3.88Å; R78-D128 IonicContact CZ-OD2 2.71Å; R78-D128 IonicContact NH1-OD2 2.68Å; R78-D128 PolarHBondContact NH1-OD2 2.92Å
79	V	90.3	Very high	79.5	Confident	74 Å²	74	75.6 Å²	75.6	45%	0.448	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.7	179.8	-167.5	0	0	0	0	109.2	Y63 I64 K65	Y63-V79 HydrophobicContact CD2-CG1 4.19Å; Y63-V79 HydrophobicContact CG-CG1 4.33Å; I64-V79 WeakPolarHBondContact O-CA 3.45Å; K65-V79 HydrophobicContact CG-CG1 4.13Å; K65-V79 HydrophobicContact CG-CG2 4.14Å
80	F	91.4	Very high	78.4	Confident	1 Å²	1	80.8 Å²	80.8	0%	0.004	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.1	180	-58.4	-88.7	0	0	0	109	T34 A35 T38 Y63 I64 I66 R78 V123 T126	T34-F80 HydrophobicContact CG2-CE1 4.18Å; A35-F80 HydrophobicContact CB-CD1 3.8Å; A35-F80 HydrophobicContact CB-CD2 4.49Å; A35-F80 HydrophobicContact CB-CE1 3.85Å; A35-F80 HydrophobicContact CB-CG 4.16Å; A35-F80 HydrophobicContact CB-CZ 4.22Å; T38-F80 HydrophobicContact CG2-CE2 4.13Å; T38-F80 HydrophobicContact CG2-CZ 4.32Å; Y63-F80 CarbonylContact C-O 3.33Å; Y63-F80 WeakPolarHBondContact CA-O 3.43Å; I64-F80 PolarHBondContact N-O 3.46Å; I64-F80 PolarHBondContact O-N 2.79Å; I66-F80 HydrophobicContact CD1-CD2 4.1Å; I66-F80 HydrophobicContact CD1-CE2 3.84Å; I66-F80 HydrophobicContact CG1-CD2 4.45Å; I66-F80 HydrophobicContact CG1-CE2 4.35Å; R78-F80 HydrophobicContact CB-CD2 4.45Å; R78-F80 HydrophobicContact CB-CE2 3.54Å; R78-F80 HydrophobicContact CB-CZ 3.88Å; F80-V123 HydrophobicContact CB-CG1 3.7Å; F80-V123 HydrophobicContact CD1-CG1 4.48Å; F80-V123 HydrophobicContact CG-CG1 4.41Å; F80-T126 HydrophobicContact CD1-CG2 3.53Å; F80-T126 HydrophobicContact CE1-CG2 3.73Å; F80-T126 HydrophobicContact CG-CG2 4.36Å
81	S	92.1	Very high	77.5	Confident	64 Å²	64	85 Å²	85	45%	0.448	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	157.3	170.3	51.2	0	0	0	0	110.8	G62 C124	G62-S81 CarbonylContact O-C 3.52Å; G62-S81 WeakPolarHBondContact O-CA 3.46Å; S81-C124 WeakPolarHBondContact O-CB 3.37Å; S81-C124 PolarHBondContact O-N 2.84Å; S81-C124 PolarHBondContact O-SG 2.83Å; S81-C124 VanDerWaalsContact O-SG 3.41Å; S81-C124 WeakPolarHBondContact OG-CB 3.23Å; S81-C124 PolarHBondContact OG-SG 2.9Å; S81-C124 VanDerWaalsContact OG-SG 3.37Å
82	F	93.7	Very high	76.6	Confident	2 Å²	2	83.8 Å²	83.8	1%	0.009	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	159.2	173.8	67.4	-100.7	0	0	0	112.4	I55 F57 Q61 G62 I64 I121 T122 V123	I55-F82 HydrophobicContact CD1-CE1 3.89Å; I55-F82 HydrophobicContact CD1-CZ 4.02Å; I55-F82 HydrophobicContact CG1-CE1 3.71Å; I55-F82 HydrophobicContact CG1-CZ 4Å; F57-F82 AromaticContact CD1-CE2 3.75Å; F57-F82 HydrophobicContact CD1-CE2 3.75Å; F57-F82 AromaticContact CD1-CZ 3.64Å; F57-F82 HydrophobicContact CD1-CZ 3.64Å; F57-F82 AromaticContact CE1-CE2 3.73Å; F57-F82 HydrophobicContact CE1-CE2 3.73Å; F57-F82 AromaticContact CE1-CZ 3.65Å; F57-F82 HydrophobicContact CE1-CZ 3.65Å; F57-F82 HydrophobicContact CG-CZ 4.13Å; F57-F82 HydrophobicContact CZ-CZ 4.15Å; Q61-F82 CarbonylContact C-O 3.46Å; Q61-F82 VanDerWaalsContact CA-O 3.31Å; Q61-F82 WeakPolarHBondContact CA-O 3.33Å; G62-F82 VanDerWaalsContact C-CD1 3.44Å; G62-F82 VanDerWaalsContact C-CE1 3.42Å; G62-F82 PolarHBondContact N-O 2.96Å; G62-F82 PolarHBondContact O-N 2.98Å; I64-F82 HydrophobicContact CD1-CD1 4.42Å; I64-F82 HydrophobicContact CG1-CD1 4.04Å; I64-F82 HydrophobicContact CG1-CE1 4.11Å; F82-I121 HydrophobicContact CB-CG2 3.86Å; F82-I121 HydrophobicContact CD1-CG2 4.32Å; F82-I121 HydrophobicContact CD2-CG1 4.41Å; F82-I121 HydrophobicContact CD2-CG2 3.66Å; F82-I121 HydrophobicContact CE2-CG1 4.31Å; F82-I121 HydrophobicContact CE2-CG2 4.22Å; F82-I121 HydrophobicContact CG-CG2 3.71Å; F82-T122 VanDerWaalsContact CA-O 3.3Å; F82-T122 WeakPolarHBondContact CA-O 3.35Å; F82-T122 WeakPolarHBondContact CB-O 3.39Å; F82-V123 HydrophobicContact CB-CB 4.48Å; F82-V123 HydrophobicContact CB-CG2 4.13Å
83	Y	91.9	Very high	75.7	Confident	130 Å²	130	85 Å²	85	51%	0.51	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	145.3	167.7	-60.8	-84.2	0	0	0	109.8	Q61 I121 T122 C124	Q61-Y83 HydrophobicContact CG-CD1 3.69Å; Q61-Y83 HydrophobicContact CG-CE1 3.89Å; Y83-I121 WeakPolarHBondContact O-CA 3.39Å; Y83-T122 PolarHBondContact N-O 2.96Å; Y83-T122 PolarHBondContact O-N 2.83Å; Y83-C124 WeakPolarHBondContact CE2-SG 3.24Å
84	L	90	Very high	74.8	Confident	38 Å²	38	84.3 Å²	84.3	20%	0.199	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.2	172.6	-173.5	73.8	0	0	0	109	Y27 S60 D119 K120 I121	Y27-L84 HydrophobicContact CD1-CD1 3.78Å; Y27-L84 HydrophobicContact CE1-CD1 3.75Å; S60-L84 PolarHBondContact O-N 2.98Å; L84-D119 HydrophobicContact CD1-CB 4.23Å; L84-K120 WeakPolarHBondContact CA-O 3.33Å; L84-I121 HydrophobicContact CD1-CG1 3.58Å
85	S	86.1	Confident	74.3	Confident	48 Å²	48	81.9 Å²	81.9	34%	0.336	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.1	172	58.7	0	0	0	0	110	K120	S85-K120 PolarHBondContact N-O 3.38Å; S85-K120 PolarHBondContact O-N 2.79Å
86	S	79.1	Confident	74.2	Confident	61 Å²	61	81.9 Å²	81.9	43%	0.427	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.6	169.7	-158.7	0	0	0	0	108.6	S88 Q118 D119	S86-S88 PolarHBondContact O-N 3.45Å; S86-S88 PolarHBondContact OG-OG 3.29Å; S86-Q118 CarbonylContact C-O 3.29Å; S86-Q118 WeakPolarHBondContact CA-O 3.49Å; S86-Q118 PolarHBondContact OG-O 3.5Å; S86-D119 WeakPolarHBondContact CA-OD1 3.08Å; S86-D119 WeakPolarHBondContact CB-OD1 3.4Å; S86-D119 PolarHBondContact OG-OD1 3.38Å
87	D	65.5	Low	73.9	Confident	43 Å²	43	86.6 Å²	86.6	23%	0.23	45%	0.451	C	S	.	.			trans	-80	4.6	178.4	-67.4	-25.1	0	0	0	111.1	Q118 K120	D87-Q118 PolarHBondContact N-O 3.41Å; D87-K120 IonicContact OD2-NZ 3.64Å
88	S	59.3	Low	73.6	Confident	58 Å²	58	84.2 Å²	84.2	41%	0.406	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.1	-163.8	60.8	0	0	0	0	117.9	S86	S86-S88 PolarHBondContact O-N 3.45Å; S86-S88 PolarHBondContact OG-OG 3.29Å
89	K	54.1	Low	73.3	Confident	187 Å²	187	83.8 Å²	83.8	81%	0.813	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-40.7	-172.7	-72.1	-159.5	171.9	-169.6	0	115.9
90	D	53.9	Low	72.8	Confident	153 Å²	153	84.6 Å²	84.6	82%	0.818	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-9.5	-170	-60.8	-61.5	0	0	0	114.3
91	K	58.4	Low	72.4	Confident	147 Å²	147	87.1 Å²	87.1	64%	0.639	46%	0.458	S	S	*	.			trans	-145.5	85	-179.7	-67.6	-169.9	179.3	-178.6	0	112.9	Q93 S94	K91-Q93 PolarHBondContact O-N 3.28Å; K91-Q93 VanDerWaalsContact O-N 3.08Å; K91-S94 WeakPolarHBondContact O-CB 3.45Å; K91-S94 PolarHBondContact O-N 3.39Å
92	P	53.8	Low	71.7	Confident	116 Å²	116	87.5 Å²	87.5	75%	0.753	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-63	-17.7	-178.1	24.3	-34.1	0	0	0	114.9	S94	P92-S94 VanDerWaalsContact C-N 3.28Å; P92-S94 PolarHBondContact O-N 2.86Å
93	Q	52.1	Low	71	Confident	201 Å²	201	93 Å²	93	94%	0.939	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-83.6	5.7	172	-67.7	177	-73.2	0	0	113.9	K91	K91-Q93 PolarHBondContact O-N 3.28Å; K91-Q93 VanDerWaalsContact O-N 3.08Å
94	S	55.3	Low	70.1	Confident	36 Å²	36	88.9 Å²	88.9	25%	0.252	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-102.1	-2.4	-174.9	-164.4	0	0	0	0	114.8	K91 P92 F96	K91-S94 WeakPolarHBondContact O-CB 3.45Å; K91-S94 PolarHBondContact O-N 3.39Å; P92-S94 VanDerWaalsContact C-N 3.28Å; P92-S94 PolarHBondContact O-N 2.86Å; S94-F96 WeakPolarHBondContact O-CD2 3.41Å; S94-F96 WeakPolarHBondContact O-CE2 3.38Å
95	S	61.8	Low	69.2	Low	63 Å²	63	91.4 Å²	91.4	44%	0.441	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-75.2	125.8	176.9	55.7	0	0	0	0	111.1
96	F	72.1	Confident	68.7	Low	107 Å²	107	95.5 Å²	95.5	47%	0.469	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	117.8	177.4	-63.4	-90.5	0	0	0	110	S94 C98 I117	S94-F96 WeakPolarHBondContact O-CD2 3.41Å; S94-F96 WeakPolarHBondContact O-CE2 3.38Å; F96-C98 PolarHBondContact O-N 2.73Å; F96-I117 HydrophobicContact CB-CB 4.49Å; F96-I117 PolarHBondContact N-O 2.97Å; F96-I117 WeakPolarHBondContact O-CB 3.43Å; F96-I117 WeakPolarHBondContact O-CG1 3.48Å; F96-I117 PolarHBondContact O-N 2.76Å
97	D	77.7	Confident	68.3	Low	111 Å²	111	95.4 Å²	95.4	59%	0.594	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	123.9	169.8	-79.5	-39.5	0	0	0	111	I99 S116	D97-I99 PolarHBondContact O-N 2.86Å; D97-S116 WeakPolarHBondContact OD1-CA 3.46Å; D97-S116 WeakPolarHBondContact OD1-CB 3.34Å; D97-S116 PolarHBondContact OD1-N 2.61Å
98	C	78.6	Confident	68.7	Low	35 Å²	35	100.3 Å²	100.3	24%	0.236	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110.8	-180	-170.6	0	0	0	0	110.1	L26 F96 K114 G115 I117	L26-C98 HydrophobicContact CD1-CB 3.85Å; F96-C98 PolarHBondContact O-N 2.73Å; C98-K114 HydrophobicContact CB-CB 4.11Å; C98-K114 PolarHBondContact O-N 3.48Å; C98-G115 WeakPolarHBondContact CB-O 3.37Å; C98-G115 PolarHBondContact N-O 2.9Å; C98-I117 HydrophobicContact CB-CD1 3.92Å; C98-I117 HydrophobicContact CB-CG1 3.82Å
99	I	81.5	Confident	69.6	Low	84 Å²	84	100.2 Å²	100.2	43%	0.431	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.4	170.9	-55.2	177.4	0	0	0	108.7	D97 L111	D97-I99 PolarHBondContact O-N 2.86Å; I99-L111 HydrophobicContact CG2-CB 4.04Å; I99-L111 HydrophobicContact CG2-CD2 4.13Å
100	H	79.8	Confident	70.7	Confident	91 Å²	91	93.6 Å²	93.6	42%	0.421	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.7	173.9	-176.4	50.6	0	0	0	109.8	F102 L111 E112 K114	H100-F102 AromaticContact CD2-CD1 3.64Å; H100-L111 WeakPolarHBondContact O-CA 3.43Å; H100-E112 PolarHBondContact N-O 2.91Å; H100-E112 PolarHBondContact O-N 3.03Å; H100-K114 HydrophobicContact CB-CG 4.08Å
101	Q	82.8	Confident	71.9	Confident	55 Å²	55	86.7 Å²	86.7	26%	0.257	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.9	172.2	-176.9	176.4	6.4	0	0	109.1	A2 A3 H110 L111	A2-Q101 HydrophobicContact CB-CB 4.22Å; A3-Q101 VanDerWaalsContact N-OE1 3.13Å; Q101-H110 WeakPolarHBondContact CA-O 3.4Å; Q101-L111 HydrophobicContact CB-CD2 3.58Å; Q101-L111 HydrophobicContact CG-CD2 3.71Å
102	F	78.9	Confident	73	Confident	71 Å²	71	82.1 Å²	82.1	31%	0.311	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	157.4	173.9	65.9	-90.9	0	0	0	111	H100 H110 E112	H100-F102 AromaticContact CD2-CD1 3.64Å; F102-H110 HydrophobicContact CD2-CB 4.38Å; F102-H110 HydrophobicContact CE1-CB 4.43Å; F102-H110 AromaticContact CE1-CD2 3.67Å; F102-H110 HydrophobicContact CE2-CB 4.02Å; F102-H110 HydrophobicContact CZ-CB 4.06Å; F102-H110 AromaticContact CZ-CD2 3.43Å; F102-H110 VanDerWaalsContact CZ-CD2 3.43Å; F102-H110 WeakPolarHBondContact CZ-CD2 3.5Å; F102-H110 AromaticContact CZ-CG 3.98Å; F102-H110 PolarHBondContact N-O 3.49Å; F102-H110 PolarHBondContact O-N 3.31Å; F102-E112 HydrophobicContact CE1-CB 4.02Å
103	I	78.4	Confident	74.1	Confident	117 Å²	117	78.9 Å²	78.9	60%	0.6	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.7	171.7	-52.5	178.3	0	0	0	106.9
104	S	72.8	Confident	75.2	Confident	45 Å²	45	73.3 Å²	73.3	32%	0.315	41%	0.407	S	S	.	.			trans	-67	160.2	174	-175.2	0	0	0	0	110.8	E106 G107 R108	S104-E106 PolarHBondContact O-N 3.37Å; S104-G107 PolarHBondContact O-N 2.93Å; S104-R108 PolarHBondContact N-O 3.41Å
105	G	70.3	Confident	76.2	Confident	90 Å²	90	72.9 Å²	72.9	93%	0.928	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.5	176.2	0	0	0	0	0	114	G107	G105-G107 VanDerWaalsContact C-N 3.27Å; G105-G107 PolarHBondContact O-N 2.94Å
106	E	75.9	Confident	76.9	Confident	134 Å²	134	72.1 Å²	72.1	63%	0.626	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	15.9	172.9	-62.7	173.1	-140.6	0	0	113.7	S104 R108	S104-E106 PolarHBondContact O-N 3.37Å; E106-R108 VanDerWaalsContact C-N 3.26Å; E106-R108 PolarHBondContact O-N 2.92Å; E106-R108 IonicContact OE2-CZ 3.71Å; E106-R108 IonicContact OE2-NH1 2.69Å; E106-R108 PolarHBondContact OE2-NH1 3.39Å; E106-R108 IonicContact OE2-NH2 3.18Å; E106-R108 PolarHBondContact OE2-NH2 2.84Å
107	G	70.7	Confident	77.2	Confident	60 Å²	60	68.4 Å²	68.4	62%	0.619	39%	0.388	S	S	*	.	S	Bend	trans	72.9	5.2	174.7	0	0	0	0	0	116.2	S104 G105	S104-G107 PolarHBondContact O-N 2.93Å; G105-G107 VanDerWaalsContact C-N 3.27Å; G105-G107 PolarHBondContact O-N 2.94Å
108	R	75.1	Confident	77.2	Confident	145 Å²	145	67.7 Å²	67.7	55%	0.547	38%	0.381	S	S	.	.			trans	-92.3	136.1	180	-63.5	-166.9	-62.6	-77.9	-0.2	112.3	S104 E106 H110	S104-R108 PolarHBondContact N-O 3.41Å; E106-R108 VanDerWaalsContact C-N 3.26Å; E106-R108 PolarHBondContact O-N 2.92Å; E106-R108 IonicContact OE2-CZ 3.71Å; E106-R108 IonicContact OE2-NH1 2.69Å; E106-R108 PolarHBondContact OE2-NH1 3.39Å; E106-R108 IonicContact OE2-NH2 3.18Å; E106-R108 PolarHBondContact OE2-NH2 2.84Å; R108-H110 PolarHBondContact O-N 2.78Å
109	D	77.1	Confident	77.4	Confident	56 Å²	56	68.1 Å²	68.1	30%	0.299	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	125.1	170.4	-81.9	-27.2	0	0	0	111.1	Y10	Y10-D109 HydrophobicContact CD1-CB 3.71Å; Y10-D109 HydrophobicContact CE1-CB 3.63Å; Y10-D109 WeakPolarHBondContact CE1-OD2 3.37Å
110	H	77.7	Confident	77.7	Confident	48 Å²	48	66.7 Å²	66.7	22%	0.222	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.9	-178.1	-164	83.5	0	0	0	111.6	G11 S13 Q101 F102 R108	G11-H110 PolarHBondContact O-CE1 2.85Å; G11-H110 PolarHBondContact O-ND1 3.42Å; S13-H110 VanDerWaalsContact CB-NE2 3.31Å; S13-H110 WeakPolarHBondContact CB-NE2 3.3Å; S13-H110 PolarHBondContact OG-NE2 2.85Å; Q101-H110 WeakPolarHBondContact CA-O 3.4Å; F102-H110 HydrophobicContact CD2-CB 4.38Å; F102-H110 HydrophobicContact CE1-CB 4.43Å; F102-H110 AromaticContact CE1-CD2 3.67Å; F102-H110 HydrophobicContact CE2-CB 4.02Å; F102-H110 HydrophobicContact CZ-CB 4.06Å; F102-H110 AromaticContact CZ-CD2 3.43Å; F102-H110 VanDerWaalsContact CZ-CD2 3.43Å; F102-H110 WeakPolarHBondContact CZ-CD2 3.5Å; F102-H110 AromaticContact CZ-CG 3.98Å; F102-H110 PolarHBondContact N-O 3.49Å; F102-H110 PolarHBondContact O-N 3.31Å; R108-H110 PolarHBondContact O-N 2.78Å
111	L	79.8	Confident	78.2	Confident	8 Å²	8	62.5 Å²	62.5	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.9	-179.6	-63.3	178.7	0	0	0	110.2	L4 Y10 G11 L12 S13 I99 H100 Q101	L4-L111 HydrophobicContact CD2-CD1 3.89Å; L4-L111 HydrophobicContact CD2-CD2 4.1Å; Y10-L111 VanDerWaalsContact CB-CD1 3.49Å; Y10-L111 HydrophobicContact CD1-CD1 4.38Å; Y10-L111 HydrophobicContact CD1-CG 4.38Å; Y10-L111 HydrophobicContact CG-CD1 3.95Å; Y10-L111 HydrophobicContact CG-CG 4.4Å; G11-L111 PolarHBondContact O-N 3.14Å; L12-L111 WeakPolarHBondContact CA-O 3.31Å; L12-L111 HydrophobicContact CD2-CB 3.52Å; L12-L111 HydrophobicContact CD2-CD1 3.91Å; L12-L111 HydrophobicContact CD2-CG 4.38Å; L12-L111 HydrophobicContact CG-CB 4.06Å; L12-L111 HydrophobicContact CG-CD1 4.09Å; S13-L111 PolarHBondContact N-O 2.87Å; I99-L111 HydrophobicContact CG2-CB 4.04Å; I99-L111 HydrophobicContact CG2-CD2 4.13Å; H100-L111 WeakPolarHBondContact O-CA 3.43Å; Q101-L111 HydrophobicContact CB-CD2 3.58Å; Q101-L111 HydrophobicContact CG-CD2 3.71Å
112	E	80.9	Confident	78.6	Confident	52 Å²	52	62.2 Å²	62.2	24%	0.243	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.7	178.5	-172.8	-163.6	163	0	0	110.1	H100 F102 K114	H100-E112 PolarHBondContact N-O 2.91Å; H100-E112 PolarHBondContact O-N 3.03Å; F102-E112 HydrophobicContact CE1-CB 4.02Å; E112-K114 VanDerWaalsContact CD-CE 3.43Å; E112-K114 PolarHBondContact O-N 2.95Å; E112-K114 WeakPolarHBondContact OE1-CE 3.43Å; E112-K114 IonicContact OE1-NZ 3.14Å; E112-K114 PolarHBondContact OE1-NZ 2.85Å; E112-K114 WeakPolarHBondContact OE2-CE 3.44Å; E112-K114 IonicContact OE2-NZ 2.71Å; E112-K114 PolarHBondContact OE2-NZ 2.81Å
113	S	76.9	Confident	79.2	Confident	47 Å²	47	59.2 Å²	59.2	33%	0.329	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122.4	170.8	-175	0	0	0	0	110.2	G115	S113-G115 PolarHBondContact OG-N 3.5Å
114	K	75.7	Confident	79.7	Confident	84 Å²	84	55 Å²	55	37%	0.365	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-4.9	173.9	-59.8	-65.5	-176.3	-176.8	0	112.6	L26 C98 H100 E112	L26-K114 HydrophobicContact CD1-CB 3.86Å; L26-K114 WeakPolarHBondContact CD1-O 3.48Å; C98-K114 HydrophobicContact CB-CB 4.11Å; C98-K114 PolarHBondContact O-N 3.48Å; H100-K114 HydrophobicContact CB-CG 4.08Å; E112-K114 VanDerWaalsContact CD-CE 3.43Å; E112-K114 PolarHBondContact O-N 2.95Å; E112-K114 WeakPolarHBondContact OE1-CE 3.43Å; E112-K114 IonicContact OE1-NZ 3.14Å; E112-K114 PolarHBondContact OE1-NZ 2.85Å; E112-K114 WeakPolarHBondContact OE2-CE 3.44Å; E112-K114 IonicContact OE2-NZ 2.71Å; E112-K114 PolarHBondContact OE2-NZ 2.81Å
115	G	75.8	Confident	80.1	Confident	27 Å²	27	54.5 Å²	54.5	28%	0.278	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	94.8	-178.3	-179.8	0	0	0	0	0	114.2	C98 S113	C98-G115 WeakPolarHBondContact CB-O 3.37Å; C98-G115 PolarHBondContact N-O 2.9Å; S113-G115 PolarHBondContact OG-N 3.5Å
116	S	75.5	Confident	80.3	Confident	47 Å²	47	51.4 Å²	51.4	33%	0.329	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.7	-172	55	0	0	0	0	113.4	D97 Q118	D97-S116 WeakPolarHBondContact OD1-CA 3.46Å; D97-S116 WeakPolarHBondContact OD1-CB 3.34Å; D97-S116 PolarHBondContact OD1-N 2.61Å; S116-Q118 PolarHBondContact OG-NE2 2.88Å; S116-Q118 VanDerWaalsContact OG-NE2 3.09Å
117	I	79.3	Confident	79.9	Confident	30 Å²	30	49.2 Å²	49.2	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	114.3	169.5	-49.4	177.4	0	0	0	107.6	L26 H28 F96 C98	L26-I117 HydrophobicContact CB-CG1 4.15Å; L26-I117 HydrophobicContact CD1-CG1 4.47Å; H28-I117 HydrophobicContact CB-CG2 3.89Å; H28-I117 VanDerWaalsContact N-CG2 3.31Å; F96-I117 HydrophobicContact CB-CB 4.49Å; F96-I117 PolarHBondContact N-O 2.97Å; F96-I117 WeakPolarHBondContact O-CB 3.43Å; F96-I117 WeakPolarHBondContact O-CG1 3.48Å; F96-I117 PolarHBondContact O-N 2.76Å; C98-I117 HydrophobicContact CB-CD1 3.92Å; C98-I117 HydrophobicContact CB-CG1 3.82Å
118	Q	76.8	Confident	79.7	Confident	96 Å²	96	49.8 Å²	49.8	45%	0.449	27%	0.265	S	S	.	.			trans	-110.2	-25.7	-176.4	-62.6	-179.7	23.7	0	0	112.5	S86 D87 S116	S86-Q118 CarbonylContact C-O 3.29Å; S86-Q118 WeakPolarHBondContact CA-O 3.49Å; S86-Q118 PolarHBondContact OG-O 3.5Å; D87-Q118 PolarHBondContact N-O 3.41Å; S116-Q118 PolarHBondContact OG-NE2 2.88Å; S116-Q118 VanDerWaalsContact OG-NE2 3.09Å
119	D	82.9	Confident	79	Confident	43 Å²	43	43.6 Å²	43.6	23%	0.23	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	149	-179.4	-73.1	-14.6	0	0	0	111.9	Y27 H28 L84 S86	Y27-D119 WeakPolarHBondContact CA-O 3.21Å; Y27-D119 HydrophobicContact CD1-CB 3.45Å; Y27-D119 VanDerWaalsContact CD1-CB 3.45Å; Y27-D119 HydrophobicContact CE1-CB 3.45Å; Y27-D119 VanDerWaalsContact CE1-CB 3.45Å; H28-D119 PolarHBondContact N-O 2.85Å; L84-D119 HydrophobicContact CD1-CB 4.23Å; S86-D119 WeakPolarHBondContact CA-OD1 3.08Å; S86-D119 WeakPolarHBondContact CB-OD1 3.4Å; S86-D119 PolarHBondContact OG-OD1 3.38Å
120	K	87.8	Confident	78.4	Confident	55 Å²	55	47.1 Å²	47.1	24%	0.239	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	121.7	-169.9	-178.6	-178.4	-166.1	167.4	0	111.1	H28 L84 S85 D87	H28-K120 HydrophobicContact CB-CB 4.25Å; H28-K120 HydrophobicContact CB-CG 4.11Å; H28-K120 CarbonylContact O-C 3.5Å; H28-K120 WeakPolarHBondContact O-CA 3.3Å; H28-K120 WeakPolarHBondContact O-CG 3.5Å; L84-K120 WeakPolarHBondContact CA-O 3.33Å; S85-K120 PolarHBondContact N-O 3.38Å; S85-K120 PolarHBondContact O-N 2.79Å; D87-K120 IonicContact OD2-NZ 3.64Å
121	I	91.1	Very high	77.7	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.7	176.4	-67.8	172.6	0	0	0	107.3	Y27 H28 V29 K30 I55 F57 F82 Y83 L84 V123	Y27-I121 HydrophobicContact CD1-CD1 4.11Å; Y27-I121 HydrophobicContact CD1-CG1 4.14Å; Y27-I121 HydrophobicContact CD2-CD1 4.18Å; Y27-I121 HydrophobicContact CG-CD1 3.75Å; Y27-I121 HydrophobicContact CG-CG1 4.2Å; H28-I121 PolarHBondContact O-N 3.03Å; V29-I121 CarbonylContact C-O 3.57Å; V29-I121 WeakPolarHBondContact CA-O 3.39Å; V29-I121 HydrophobicContact CG1-CB 4.3Å; V29-I121 HydrophobicContact CG1-CG2 4.09Å; V29-I121 HydrophobicContact CG2-CB 4.3Å; V29-I121 HydrophobicContact CG2-CD1 4.33Å; K30-I121 PolarHBondContact N-O 3.09Å; I55-I121 HydrophobicContact CD1-CD1 4.19Å; F57-I121 HydrophobicContact CE1-CD1 3.76Å; F57-I121 HydrophobicContact CE1-CG1 4.37Å; F57-I121 HydrophobicContact CZ-CD1 3.76Å; F82-I121 HydrophobicContact CB-CG2 3.86Å; F82-I121 HydrophobicContact CD1-CG2 4.32Å; F82-I121 HydrophobicContact CD2-CG1 4.41Å; F82-I121 HydrophobicContact CD2-CG2 3.66Å; F82-I121 HydrophobicContact CE2-CG1 4.31Å; F82-I121 HydrophobicContact CE2-CG2 4.22Å; F82-I121 HydrophobicContact CG-CG2 3.71Å; Y83-I121 WeakPolarHBondContact O-CA 3.39Å; L84-I121 HydrophobicContact CD1-CG1 3.58Å; I121-V123 HydrophobicContact CG2-CG2 4.07Å
122	T	91.6	Very high	77	Confident	50 Å²	50	49.2 Å²	49.2	31%	0.307	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	107.5	172.2	-59.8	0	0	0	0	109	F82 Y83	F82-T122 VanDerWaalsContact CA-O 3.3Å; F82-T122 WeakPolarHBondContact CA-O 3.35Å; F82-T122 WeakPolarHBondContact CB-O 3.39Å; Y83-T122 PolarHBondContact N-O 2.96Å; Y83-T122 PolarHBondContact O-N 2.83Å
123	V	91.7	Very high	76.2	Confident	7 Å²	7	50.7 Å²	50.7	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.8	178.7	-177.2	0	0	0	0	110.1	V29 K30 L31 T32 A35 I64 F80 F82 I121	V29-V123 HydrophobicContact CG1-CG2 4.29Å; K30-V123 PolarHBondContact O-N 3.41Å; L31-V123 HydrophobicContact CD2-CG2 3.85Å; T32-V123 WeakPolarHBondContact CG2-O 3.32Å; A35-V123 HydrophobicContact CB-CG1 4.32Å; I64-V123 HydrophobicContact CD1-CG2 4.02Å; F80-V123 HydrophobicContact CB-CG1 3.7Å; F80-V123 HydrophobicContact CD1-CG1 4.48Å; F80-V123 HydrophobicContact CG-CG1 4.41Å; F82-V123 HydrophobicContact CB-CB 4.48Å; F82-V123 HydrophobicContact CB-CG2 4.13Å; I121-V123 HydrophobicContact CG2-CG2 4.07Å
124	C	88.9	Confident	75.7	Confident	28 Å²	28	49.7 Å²	49.7	19%	0.189	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-73.2	154.3	178.3	-59	0	0	0	0	111.5	S81 Y83	S81-C124 WeakPolarHBondContact O-CB 3.37Å; S81-C124 PolarHBondContact O-N 2.84Å; S81-C124 PolarHBondContact O-SG 2.83Å; S81-C124 VanDerWaalsContact O-SG 3.41Å; S81-C124 WeakPolarHBondContact OG-CB 3.23Å; S81-C124 PolarHBondContact OG-SG 2.9Å; S81-C124 VanDerWaalsContact OG-SG 3.37Å; Y83-C124 WeakPolarHBondContact CE2-SG 3.24Å
125	A	80.5	Confident	75.1	Confident	35 Å²	35	51.6 Å²	51.6	29%	0.289	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-75.5	135.4	163.1	0	0	0	0	0	109.8	T32 Y130	T32-A125 HydrophobicContact CG2-CB 4.34Å; A125-Y130 HydrophobicContact CB-CD2 4.2Å; A125-Y130 HydrophobicContact CB-CE1 4.46Å; A125-Y130 HydrophobicContact CB-CE2 3.46Å; A125-Y130 VanDerWaalsContact CB-CE2 3.46Å
126	T	75.5	Confident	74.9	Confident	26 Å²	26	57.7 Å²	57.7	16%	0.16	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-82.5	159.8	172.3	48.4	0	0	0	0	111.2	F80 D128 S129 Y130	F80-T126 HydrophobicContact CD1-CG2 3.53Å; F80-T126 HydrophobicContact CE1-CG2 3.73Å; F80-T126 HydrophobicContact CG-CG2 4.36Å; T126-D128 VanDerWaalsContact C-N 3.33Å; T126-D128 PolarHBondContact O-N 2.85Å; T126-S129 WeakPolarHBondContact O-CA 3.31Å; T126-S129 WeakPolarHBondContact O-CB 3.45Å; T126-S129 PolarHBondContact O-N 3.35Å; T126-Y130 WeakPolarHBondContact O-CD2 3.39Å; T126-Y130 PolarHBondContact O-N 3.49Å
127	D	67.2	Low	73.6	Confident	88 Å²	88	57.9 Å²	57.9	47%	0.471	29%	0.29	S	S	.	.	H	α-helix	trans	-59.3	-43.1	-179.5	-165.4	49.3	0	0	0	112.2	S129 Y130 Q131	D127-S129 PolarHBondContact O-N 3.21Å; D127-Y130 PolarHBondContact O-N 2.6Å; D127-Q131 WeakPolarHBondContact O-CB 3.1Å; D127-Q131 PolarHBondContact O-N 3.08Å
128	D	65.3	Low	73	Confident	71 Å²	71	58 Å²	58	38%	0.38	29%	0.293	S	S	.	.	H	α-helix	trans	-44.8	-38	168.1	-62.8	-9.4	0	0	0	113	R78 T126 T132	R78-D128 IonicContact CZ-OD2 2.71Å; R78-D128 IonicContact NH1-OD2 2.68Å; R78-D128 PolarHBondContact NH1-OD2 2.92Å; T126-D128 VanDerWaalsContact C-N 3.33Å; T126-D128 PolarHBondContact O-N 2.85Å; D128-T132 VanDerWaalsContact O-CB 3.24Å; D128-T132 WeakPolarHBondContact O-CB 3.37Å; D128-T132 PolarHBondContact O-N 2.89Å; D128-T132 PolarHBondContact O-OG1 2.8Å
129	S	60.4	Low	71.8	Confident	16 Å²	16	59.2 Å²	59.2	11%	0.112	30%	0.299	C	S	.	.	H	α-helix	trans	-72	-44.2	-179.1	-157.6	0	0	0	0	111.6	T34 T126 D127 T133	T34-S129 WeakPolarHBondContact OG1-CB 3.22Å; T34-S129 PolarHBondContact OG1-OG 3.16Å; T126-S129 WeakPolarHBondContact O-CA 3.31Å; T126-S129 WeakPolarHBondContact O-CB 3.45Å; T126-S129 PolarHBondContact O-N 3.35Å; D127-S129 PolarHBondContact O-N 3.21Å; S129-T133 WeakPolarHBondContact O-CB 3.44Å; S129-T133 PolarHBondContact O-N 2.71Å; S129-T133 PolarHBondContact O-OG1 3.38Å; S129-T133 VanDerWaalsContact O-OG1 3.13Å
130	Y	65.9	Low	70.4	Confident	129 Å²	129	61.1 Å²	61.1	51%	0.506	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-41.9	175.5	-68.6	-75.6	0	0	0	111.5	A125 T126 D127 R134	A125-Y130 HydrophobicContact CB-CD2 4.2Å; A125-Y130 HydrophobicContact CB-CE1 4.46Å; A125-Y130 HydrophobicContact CB-CE2 3.46Å; A125-Y130 VanDerWaalsContact CB-CE2 3.46Å; T126-Y130 WeakPolarHBondContact O-CD2 3.39Å; T126-Y130 PolarHBondContact O-N 3.49Å; D127-Y130 PolarHBondContact O-N 2.6Å; Y130-R134 VanDerWaalsContact O-CB 3.26Å; Y130-R134 WeakPolarHBondContact O-CB 3.43Å; Y130-R134 PolarHBondContact O-N 3.2Å; Y130-R134 VanDerWaalsContact O-N 3.08Å
131	Q	61.3	Low	68.7	Low	55 Å²	55	61.7 Å²	61.7	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-58.2	-53.4	173.8	177.6	66.8	41.8	0	0	111.4	D127 T133 R134 E135	D127-Q131 WeakPolarHBondContact O-CB 3.1Å; D127-Q131 PolarHBondContact O-N 3.08Å; Q131-T133 PolarHBondContact O-N 3.14Å; Q131-R134 VanDerWaalsContact CD-NH2 3.33Å; Q131-R134 PolarHBondContact O-N 3.13Å; Q131-E135 PolarHBondContact NE2-OE2 3.05Å; Q131-E135 VanDerWaalsContact O-CB 3.31Å; Q131-E135 WeakPolarHBondContact O-CB 3.41Å; Q131-E135 PolarHBondContact O-N 3.16Å
132	T	65.3	Low	67.1	Low	45 Å²	45	66.6 Å²	66.6	28%	0.276	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-42.9	-177.3	-57	0	0	0	0	112.4	D128 R136	D128-T132 VanDerWaalsContact O-CB 3.24Å; D128-T132 WeakPolarHBondContact O-CB 3.37Å; D128-T132 PolarHBondContact O-N 2.89Å; D128-T132 PolarHBondContact O-OG1 2.8Å; T132-R136 WeakPolarHBondContact O-CG 3.44Å; T132-R136 PolarHBondContact O-N 3.02Å
133	T	65.6	Low	65.2	Low	84 Å²	84	67.5 Å²	67.5	52%	0.515	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-46.8	177.8	-65.7	0	0	0	0	111	S129 Q131 E135 R136 M137	S129-T133 WeakPolarHBondContact O-CB 3.44Å; S129-T133 PolarHBondContact O-N 2.71Å; S129-T133 PolarHBondContact O-OG1 3.38Å; S129-T133 VanDerWaalsContact O-OG1 3.13Å; Q131-T133 PolarHBondContact O-N 3.14Å; T133-E135 VanDerWaalsContact C-N 3.35Å; T133-E135 PolarHBondContact O-N 3.42Å; T133-R136 PolarHBondContact O-N 2.91Å; T133-M137 PolarHBondContact O-N 3.48Å
134	R	66.3	Low	63.2	Low	26 Å²	26	72.1 Å²	72.1	10%	0.098	36%	0.364	C	S	.	.	H	α-helix	trans	-64.1	-38.1	179.3	-170.6	179.9	68.8	-122.1	-7.7	112.9	Y130 Q131 M137 S138 K451 D453	Y130-R134 VanDerWaalsContact O-CB 3.26Å; Y130-R134 WeakPolarHBondContact O-CB 3.43Å; Y130-R134 PolarHBondContact O-N 3.2Å; Y130-R134 VanDerWaalsContact O-N 3.08Å; Q131-R134 VanDerWaalsContact CD-NH2 3.33Å; Q131-R134 PolarHBondContact O-N 3.13Å; R134-M137 PolarHBondContact O-N 2.87Å; R134-S138 WeakPolarHBondContact O-CB 3.08Å; R134-S138 PolarHBondContact O-N 3.48Å; R134-K451 VanDerWaalsContact CD-CB 3.44Å; R134-K451 VanDerWaalsContact CD-O 3.29Å; R134-K451 WeakPolarHBondContact CD-O 3.42Å; R134-K451 PolarHBondContact NH1-O 3.42Å; R134-D453 VanDerWaalsContact CD-OD2 3.28Å; R134-D453 WeakPolarHBondContact CD-OD2 3.38Å; R134-D453 HydrophobicContact CG-CB 4.04Å; R134-D453 WeakPolarHBondContact CG-OD2 3.41Å
135	E	63.3	Low	60.9	Low	123 Å²	123	76.9 Å²	76.9	58%	0.575	38%	0.378	S	S	*	.	H	α-helix	trans	-69	-40.8	178.5	-172	149.4	-136.6	0	0	112	Q131 T133 S138 Q139	Q131-E135 PolarHBondContact NE2-OE2 3.05Å; Q131-E135 VanDerWaalsContact O-CB 3.31Å; Q131-E135 WeakPolarHBondContact O-CB 3.41Å; Q131-E135 PolarHBondContact O-N 3.16Å; T133-E135 VanDerWaalsContact C-N 3.35Å; T133-E135 PolarHBondContact O-N 3.42Å; E135-S138 PolarHBondContact O-N 2.68Å; E135-Q139 WeakPolarHBondContact O-CB 3.45Å; E135-Q139 PolarHBondContact O-N 2.99Å
136	R	69.8	Low	59.3	Low	156 Å²	156	79 Å²	79	59%	0.589	39%	0.39	S	S	*	.	H	α-helix	trans	-63.6	-43.6	171.1	-72.3	175.2	-177.7	167.1	0.9	112.1	T132 T133 S138 Q139 V140	T132-R136 WeakPolarHBondContact O-CG 3.44Å; T132-R136 PolarHBondContact O-N 3.02Å; T133-R136 PolarHBondContact O-N 2.91Å; R136-S138 PolarHBondContact O-N 2.94Å; R136-Q139 PolarHBondContact O-N 3.04Å; R136-Q139 VanDerWaalsContact O-N 3.15Å; R136-V140 WeakPolarHBondContact O-CG2 3.5Å; R136-V140 PolarHBondContact O-N 3.37Å
137	M	49.8	Very low	58	Low	50 Å²	50	86.4 Å²	86.4	25%	0.246	42%	0.415	C	S	.	.	H	α-helix	trans	-58.6	-49.4	176	-135.8	65.3	-169.7	0	0	110.7	T133 R134 Q139 V140 E141 I455	T133-M137 PolarHBondContact O-N 3.48Å; R134-M137 PolarHBondContact O-N 2.87Å; M137-Q139 PolarHBondContact O-N 3.06Å; M137-V140 PolarHBondContact O-N 3.35Å; M137-V140 VanDerWaalsContact O-N 3.15Å; M137-E141 WeakPolarHBondContact O-CG 3.26Å; M137-E141 PolarHBondContact O-N 2.9Å; M137-I455 HydrophobicContact CE-CB 3.69Å; M137-I455 HydrophobicContact CE-CG2 3.39Å; M137-I455 HydrophobicContact CG-CB 4.22Å
138	S	65.1	Low	57.1	Low	32 Å²	32	86.6 Å²	86.6	22%	0.224	42%	0.42	C	S	.	.	H	α-helix	trans	-66.7	-22	178.8	-160.9	0	0	0	0	113.6	R134 E135 R136 K142	R134-S138 WeakPolarHBondContact O-CB 3.08Å; R134-S138 PolarHBondContact O-N 3.48Å; E135-S138 PolarHBondContact O-N 2.68Å; R136-S138 PolarHBondContact O-N 2.94Å; S138-K142 WeakPolarHBondContact O-CG 3.45Å; S138-K142 PolarHBondContact O-N 3.29Å; S138-K142 PolarHBondContact O-NZ 2.72Å; S138-K142 PolarHBondContact OG-NZ 3.14Å
139	Q	52.3	Low	55.8	Low	122 Å²	122	87.3 Å²	87.3	57%	0.57	44%	0.436	S	S	*	.	H	α-helix	trans	-77.7	-40.2	172.8	-169.9	61.5	22	0	0	111.4	E135 R136 M137 K142 D143	E135-Q139 WeakPolarHBondContact O-CB 3.45Å; E135-Q139 PolarHBondContact O-N 2.99Å; R136-Q139 PolarHBondContact O-N 3.04Å; R136-Q139 VanDerWaalsContact O-N 3.15Å; M137-Q139 PolarHBondContact O-N 3.06Å; Q139-K142 PolarHBondContact O-N 3.13Å; Q139-D143 PolarHBondContact O-N 2.94Å; Q139-D143 VanDerWaalsContact O-N 3.13Å
140	V	53.9	Low	54.9	Low	83 Å²	83	92.2 Å²	92.2	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-68.9	-43.9	175.9	173.8	0	0	0	0	111.3	R136 M137 K142 D143 I144	R136-V140 WeakPolarHBondContact O-CG2 3.5Å; R136-V140 PolarHBondContact O-N 3.37Å; M137-V140 PolarHBondContact O-N 3.35Å; M137-V140 VanDerWaalsContact O-N 3.15Å; V140-K142 VanDerWaalsContact C-N 3.26Å; V140-K142 PolarHBondContact O-N 2.73Å; V140-D143 PolarHBondContact O-N 3.12Å; V140-I144 HydrophobicContact CG1-CD1 3.84Å; V140-I144 HydrophobicContact CG1-CG1 4.45Å; V140-I144 WeakPolarHBondContact O-CG1 3.4Å; V140-I144 PolarHBondContact O-N 3.49Å
141	E	52.5	Low	53.7	Low	68 Å²	68	94.5 Å²	94.5	32%	0.318	48%	0.475	S	S	.	.	H	α-helix	trans	-52	-45.2	172.7	-76.4	-176.5	131.6	0	0	111.9	M137 W145 I455	M137-E141 WeakPolarHBondContact O-CG 3.26Å; M137-E141 PolarHBondContact O-N 2.9Å; E141-W145 WeakPolarHBondContact O-CB 3.47Å; E141-W145 PolarHBondContact O-N 3.32Å; E141-I455 HydrophobicContact CG-CD1 4.28Å; E141-I455 WeakPolarHBondContact OE1-CD1 3.12Å
142	K	57.5	Low	52.5	Low	105 Å²	105	97.3 Å²	97.3	46%	0.457	49%	0.49	S	S	.	.	H	α-helix	trans	-70	-35.7	-179.4	-72.7	179.8	-158.1	91.3	0	113	S138 Q139 V140 W145 S146	S138-K142 WeakPolarHBondContact O-CG 3.45Å; S138-K142 PolarHBondContact O-N 3.29Å; S138-K142 PolarHBondContact O-NZ 2.72Å; S138-K142 PolarHBondContact OG-NZ 3.14Å; Q139-K142 PolarHBondContact O-N 3.13Å; V140-K142 VanDerWaalsContact C-N 3.26Å; V140-K142 PolarHBondContact O-N 2.73Å; K142-W145 WeakPolarHBondContact O-CB 3.23Å; K142-W145 PolarHBondContact O-N 3.44Å; K142-S146 WeakPolarHBondContact O-CB 3.17Å; K142-S146 PolarHBondContact O-N 2.75Å
143	D	50.3	Low	51.2	Low	68 Å²	68	103.5 Å²	103.5	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-77.1	-27.1	179	-157.9	65.8	0	0	0	112.7	Q139 V140 W145 S146 R147	Q139-D143 PolarHBondContact O-N 2.94Å; Q139-D143 VanDerWaalsContact O-N 3.13Å; V140-D143 PolarHBondContact O-N 3.12Å; D143-W145 VanDerWaalsContact C-N 3.34Å; D143-S146 PolarHBondContact O-OG 3.36Å; D143-S146 VanDerWaalsContact O-OG 3.05Å; D143-R147 WeakPolarHBondContact O-CD 3.37Å; D143-R147 WeakPolarHBondContact O-CG 3.46Å; D143-R147 PolarHBondContact O-NE 3.06Å; D143-R147 IonicContact OD1-NE 2.71Å; D143-R147 IonicContact OD1-NH2 2.68Å; D143-R147 IonicContact OD2-CZ 3.88Å; D143-R147 IonicContact OD2-NE 2.81Å; D143-R147 PolarHBondContact OD2-NE 3.47Å; D143-R147 IonicContact OD2-NH2 2.67Å; D143-R147 PolarHBondContact OD2-NH2 2.82Å
144	I	50.4	Low	49.9	Very low	105 Å²	105	105.7 Å²	105.7	54%	0.538	53%	0.529	S	S	.	.	H	α-helix	trans	-66.5	-40.3	165.2	-67.2	166.6	0	0	0	110	V140	V140-I144 HydrophobicContact CG1-CD1 3.84Å; V140-I144 HydrophobicContact CG1-CG1 4.45Å; V140-I144 WeakPolarHBondContact O-CG1 3.4Å; V140-I144 PolarHBondContact O-N 3.49Å
145	W	41.2	Very low	48.3	Very low	128 Å²	128	106.8 Å²	106.8	49%	0.485	55%	0.548	S	S	.	.	H	α-helix	trans	-66.6	-33.6	178.5	-142.9	-44.5	0	0	0	113.3	E141 K142 D143 R147 T529	E141-W145 WeakPolarHBondContact O-CB 3.47Å; E141-W145 PolarHBondContact O-N 3.32Å; K142-W145 WeakPolarHBondContact O-CB 3.23Å; K142-W145 PolarHBondContact O-N 3.44Å; D143-W145 VanDerWaalsContact C-N 3.34Å; W145-R147 VanDerWaalsContact C-N 3.35Å; W145-R147 PolarHBondContact O-N 3.36Å; W145-T529 HydrophobicContact CZ2-CG2 3.69Å
146	S	46.3	Very low	47.2	Very low	79 Å²	79	107.2 Å²	107.2	55%	0.552	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-14.5	-172.1	67.2	0	0	0	0	114.6	K142 D143	K142-S146 WeakPolarHBondContact O-CB 3.17Å; K142-S146 PolarHBondContact O-N 2.75Å; D143-S146 PolarHBondContact O-OG 3.36Å; D143-S146 VanDerWaalsContact O-OG 3.05Å
147	R	49.3	Very low	45.6	Very low	182 Å²	182	105.1 Å²	105.1	69%	0.687	57%	0.571	S	S	*	*	S	Bend	trans	-98.8	-16.3	-166.8	-69.6	173.5	-174	-95.5	0.6	115.8	D143 W145 A149	D143-R147 WeakPolarHBondContact O-CD 3.37Å; D143-R147 WeakPolarHBondContact O-CG 3.46Å; D143-R147 PolarHBondContact O-NE 3.06Å; D143-R147 IonicContact OD1-NE 2.71Å; D143-R147 IonicContact OD1-NH2 2.68Å; D143-R147 IonicContact OD2-CZ 3.88Å; D143-R147 IonicContact OD2-NE 2.81Å; D143-R147 PolarHBondContact OD2-NE 3.47Å; D143-R147 IonicContact OD2-NH2 2.67Å; D143-R147 PolarHBondContact OD2-NH2 2.82Å; W145-R147 VanDerWaalsContact C-N 3.35Å; W145-R147 PolarHBondContact O-N 3.36Å; R147-A149 PolarHBondContact O-N 3.05Å; R147-A149 VanDerWaalsContact O-N 3.15Å
148	T	47.1	Very low	44.9	Very low	92 Å²	92	111.6 Å²	111.6	56%	0.564	60%	0.598	S	S	*	*			trans	-90.2	65.9	-178.8	58	0	0	0	0	112.3
149	A	37.8	Very low	43.6	Very low	86 Å²	86	115.3 Å²	115.3	71%	0.711	62%	0.623	S	S	*	*			trans	-142.7	107.8	174	0	0	0	0	0	111	R147	R147-A149 PolarHBondContact O-N 3.05Å; R147-A149 VanDerWaalsContact O-N 3.15Å
150	I	41.8	Very low	42.8	Very low	118 Å²	118	114.4 Å²	114.4	61%	0.605	63%	0.625	S	S	*	*			trans	-126.2	92.8	168.2	-59.3	-179.4	0	0	0	107.6	I152	I150-I152 HydrophobicContact CG2-CD1 4.29Å; I150-I152 HydrophobicContact CG2-CG1 4.2Å
151	E	40.4	Very low	42	Very low	178 Å²	178	118.9 Å²	118.9	83%	0.832	64%	0.638	S	S	*	*			trans	-79.8	118	170.3	-172.4	-173.6	157.6	0	0	109.3
152	I	36.6	Very low	41.2	Very low	113 Å²	113	122.2 Å²	122.2	58%	0.579	66%	0.662	S	S	*	*			trans	-116.9	123.3	163.9	-66.7	173.6	0	0	0	107	I150	I150-I152 HydrophobicContact CG2-CD1 4.29Å; I150-I152 HydrophobicContact CG2-CG1 4.2Å
153	K	38.4	Very low	40.1	Very low	176 Å²	176	126 Å²	126	77%	0.765	68%	0.682	S	S	*	*			trans	-54.4	141.2	-174.5	-61.1	175.1	-176.9	175	0	111.5	G155	K153-G155 PolarHBondContact O-N 3.22Å; K153-G155 VanDerWaalsContact O-N 3.09Å
154	P	38.2	Very low	39.1	Very low	129 Å²	129	134.3 Å²	134.3	84%	0.838	71%	0.708	S	S	*	*			trans	-70.9	105	175.1	28.7	-33.5	0	0	0	111
155	G	32.8	Very low	38.5	Very low	50 Å²	50	137.9 Å²	137.9	52%	0.515	72%	0.72	S	S	.	*			trans	-70	152.5	158.3	0	0	0	0	0	110.6	K153 S157	K153-G155 PolarHBondContact O-N 3.22Å; K153-G155 VanDerWaalsContact O-N 3.09Å; G155-S157 PolarHBondContact O-N 2.97Å
156	P	40.7	Very low	38.1	Very low	132 Å²	132	140.7 Å²	140.7	86%	0.857	74%	0.738	S	S	*	*			trans	-81.6	46.9	-170.6	34.3	-37.6	0	0	0	114.2	K158	P156-K158 PolarHBondContact O-N 3.4Å
157	S	34.9	Very low	37.2	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	75%	0.75	S	S	*	*			trans	-75.1	104	170.9	44	0	0	0	0	110.5	G155 C159	G155-S157 PolarHBondContact O-N 2.97Å; S157-C159 PolarHBondContact O-N 2.81Å
158	K	36.5	Very low	36.4	Very low	187 Å²	187	140 Å²	140	81%	0.813	76%	0.76	S	S	*	*			trans	-69.8	111.2	-179.4	-62.1	171.4	-174.5	170.2	0	110.2	P156 V160	P156-K158 PolarHBondContact O-N 3.4Å; K158-V160 VanDerWaalsContact C-N 3.28Å; K158-V160 HydrophobicContact CB-CG2 3.87Å; K158-V160 PolarHBondContact O-N 3.05Å
159	C	35.8	Very low	35.5	Very low	110 Å²	110	141.7 Å²	141.7	74%	0.743	77%	0.769	S	S	*	*			trans	-70.9	87.7	163.4	-173.1	0	0	0	0	109	S157 K161	S157-C159 PolarHBondContact O-N 2.81Å; C159-K161 PolarHBondContact O-N 3.34Å
160	V	35.9	Very low	35	Very low	103 Å²	103	143.1 Å²	143.1	62%	0.624	77%	0.774	S	S	*	*			trans	-78.8	107.5	-177.1	178.1	0	0	0	0	109.4	K158 V162	K158-V160 VanDerWaalsContact C-N 3.28Å; K158-V160 HydrophobicContact CB-CG2 3.87Å; K158-V160 PolarHBondContact O-N 3.05Å; V160-V162 PolarHBondContact O-N 2.84Å
161	K	38	Very low	34.3	Very low	177 Å²	177	142.9 Å²	142.9	77%	0.77	78%	0.783	S	S	*	*			trans	-65.2	102.5	166.8	-73.8	-172.1	174.7	-176.9	0	109.6	C159 Q163	C159-K161 PolarHBondContact O-N 3.34Å; K161-Q163 PolarHBondContact O-N 3.29Å
162	V	35.3	Very low	33.8	Very low	137 Å²	137	140.1 Å²	140.1	83%	0.83	78%	0.783	S	S	*	*			trans	-72.5	93.7	172.9	-179.9	0	0	0	0	108.8	V160	V160-V162 PolarHBondContact O-N 2.84Å
163	Q	34	Very low	33.4	Very low	185 Å²	185	142.3 Å²	142.3	86%	0.864	80%	0.796	S	S	*	*			trans	-103.6	117.1	172.5	-145.1	167.6	-1.1	0	0	109.2	K161	K161-Q163 PolarHBondContact O-N 3.29Å
164	R	30.2	Very low	33	Very low	242 Å²	242	139.1 Å²	139.1	91%	0.913	80%	0.796	S	S	*	*			trans	-81.1	140.1	-172.8	-157.5	169.8	-178.1	163.7	-1.4	109.9
165	K	38	Very low	32.7	Very low	181 Å²	181	137.7 Å²	137.7	79%	0.787	79%	0.789	S	S	*	*			trans	-29.3	153.1	176.5	-60.9	177.9	177	180	0	114.9
166	Q	31.3	Very low	32.5	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	80%	0.802	S	S	*	*			cis	-170.2	159.6	39.1	-142.6	146.9	-23.6	0	0	111.2
167	G	27.7	Very low	32.1	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	80%	0.8	S	S	*	*			trans	158.3	153.4	171.6	0	0	0	0	0	114.2
168	L	33.1	Very low	31.8	Very low	170 Å²	170	147.6 Å²	147.6	89%	0.89	80%	0.8	S	S	*	*			trans	-146.2	162.3	-172.3	-170.3	69.5	0	0	0	111.8
169	V	28.6	Very low	31.5	Very low	127 Å²	127	144.2 Å²	144.2	77%	0.77	80%	0.8	S	S	*	*			trans	102.7	116.6	157.3	-174.1	0	0	0	0	119
170	S	27.5	Very low	31.4	Very low	115 Å²	115	145.4 Å²	145.4	80%	0.804	81%	0.806	S	S	*	*			trans	68.9	150.6	147.2	-152.8	0	0	0	0	123.2
171	S	27.2	Very low	31.1	Very low	114 Å²	114	145 Å²	145	80%	0.797	81%	0.808	S	S	*	*			trans	-92.9	156.2	178.7	-39.7	0	0	0	0	113.2
172	S	29.6	Very low	30.9	Very low	120 Å²	120	144.9 Å²	144.9	84%	0.839	82%	0.815	S	S	*	*			trans	-164.6	159.6	132.3	59.6	0	0	0	0	111.4
173	D	28	Very low	30.8	Very low	158 Å²	158	147 Å²	147	85%	0.845	81%	0.813	S	S	*	*			trans	-83.3	151	175.9	-76.9	-72	0	0	0	113
174	S	30.9	Very low	30.7	Very low	110 Å²	110	149.4 Å²	149.4	77%	0.769	82%	0.815	S	S	*	*				179	126.4	125.4	37.8	0	0	0	0	116.4
175	S	30.8	Very low	30.9	Very low	99 Å²	99	143.4 Å²	143.4	69%	0.692	81%	0.807	S	S	*	*			trans	34	125.2	143.6	64.9	0	0	0	0	124.2
176	N	27.7	Very low	31.3	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	81%	0.805	S	S	*	*			trans	55.3	135.3	136.6	-64.5	-33.1	0	0	0	120.3
177	K	33.9	Very low	31.8	Very low	187 Å²	187	140.2 Å²	140.2	81%	0.813	80%	0.803	S	S	*	*				-159.6	144.4	58.7	-79.8	173.5	-178.2	169.3	0	114.9
178	H	28.6	Very low	32.8	Very low	168 Å²	168	140.3 Å²	140.3	78%	0.778	79%	0.789	S	S	*	*			trans	23.5	123.1	152.1	-53.6	-73.6	0	0	0	123.4
179	S	28.8	Very low	33.9	Very low	116 Å²	116	134.1 Å²	134.1	81%	0.811	76%	0.76	S	S	*	*				-154.4	151.1	119	-86.5	0	0	0	0	111.1	S181	S179-S181 PolarHBondContact O-N 3.07Å
180	P	34.4	Very low	35.5	Very low	135 Å²	135	132 Å²	132	88%	0.877	75%	0.749	S	S	*	*			trans	-84.6	117.6	-159.8	31.1	-34.9	0	0	0	114.2
181	S	29.4	Very low	37.3	Very low	94 Å²	94	126.7 Å²	126.7	66%	0.657	71%	0.712	S	S	*	*			trans	-117.4	129.7	163.1	-175.2	0	0	0	0	109.5	S179 K183	S179-S181 PolarHBondContact O-N 3.07Å; S181-K183 PolarHBondContact O-N 3.48Å
182	N	33.7	Very low	39.4	Very low	174 Å²	174	122.7 Å²	122.7	93%	0.93	69%	0.686	S	S	*	*			trans	-74.1	66.1	-177.8	-86.1	-31.1	0	0	0	112.5	R184	N182-R184 PolarHBondContact O-N 3.34Å
183	K	34.1	Very low	41.3	Very low	182 Å²	182	124.4 Å²	124.4	79%	0.791	68%	0.68	S	S	*	*			trans	-78.5	95.9	165.4	-68.7	-172.6	178.3	-178.5	0	109	S181	S181-K183 PolarHBondContact O-N 3.48Å
184	R	31.9	Very low	43.9	Very low	235 Å²	235	122.4 Å²	122.4	89%	0.887	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-61.4	126.6	168.1	-162.3	178.5	-65.4	169	-0.5	107.7	N182	N182-R184 PolarHBondContact O-N 3.34Å
185	P	34	Very low	46.5	Very low	116 Å²	116	120.9 Å²	120.9	75%	0.753	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-60.9	157.9	-169.3	-28.3	36.3	0	0	0	115.1	L187	P185-L187 PolarHBondContact O-N 2.6Å
186	L	46.4	Very low	49.2	Very low	144 Å²	144	117 Å²	117	75%	0.754	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-64.6	120.4	166.6	-94.5	59.8	0	0	0	109.6
187	L	40.6	Very low	52.2	Low	156 Å²	156	113.7 Å²	113.7	82%	0.817	60%	0.596	S	S	*	*			trans	-139.8	138.2	157.9	-155.2	73.2	0	0	0	107.1	P185	P185-L187 PolarHBondContact O-N 2.6Å
188	P	49.4	Very low	54.9	Low	80 Å²	80	106.9 Å²	106.9	52%	0.519	57%	0.569	S	S	.	*			trans	-56.3	146.5	168	-23.3	34.3	0	0	0	110.6
189	S	57.2	Low	57.8	Low	40 Å²	40	99.1 Å²	99.1	28%	0.28	53%	0.533	S	S	.	.			trans	-56.8	132.7	167.4	177.9	0	0	0	0	108.4	V191 A192 E221	S189-V191 PolarHBondContact O-N 2.88Å; S189-V191 WeakPolarHBondContact OG-CB 3.24Å; S189-V191 PolarHBondContact OG-N 3.21Å; S189-A192 WeakPolarHBondContact O-CB 3.35Å; S189-A192 PolarHBondContact O-N 2.98Å; S189-E221 WeakPolarHBondContact CB-OE1 3.27Å; S189-E221 PolarHBondContact OG-OE1 2.94Å
190	P	61	Low	60.8	Low	82 Å²	82	93.6 Å²	93.6	53%	0.532	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.6	175.6	26.3	-34.4	0	0	0	112.5	P263	P190-P263 HydrophobicContact CB-CB 4.28Å; P190-P263 HydrophobicContact CG-CB 4.06Å
191	V	66.6	Low	63.5	Low	5 Å²	5	87.1 Å²	87.1	3%	0.03	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-32.5	170.5	-178.6	0	0	0	0	112.2	S189 H193 R194 R199 W262	S189-V191 PolarHBondContact O-N 2.88Å; S189-V191 WeakPolarHBondContact OG-CB 3.24Å; S189-V191 PolarHBondContact OG-N 3.21Å; V191-H193 PolarHBondContact O-N 3.16Å; V191-R194 VanDerWaalsContact O-CB 3.3Å; V191-R194 WeakPolarHBondContact O-CB 3.37Å; V191-R194 PolarHBondContact O-N 2.62Å; V191-R199 HydrophobicContact CG1-CG 3.79Å; V191-R199 VanDerWaalsContact O-CD 3.27Å; V191-R199 WeakPolarHBondContact O-CD 3.41Å; V191-W262 HydrophobicContact CG1-CZ2 3.98Å
192	A	69.9	Low	66.4	Low	30 Å²	30	82.8 Å²	82.8	25%	0.248	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.1	-172.7	0	0	0	0	0	114.2	S189 R194	S189-A192 WeakPolarHBondContact O-CB 3.35Å; S189-A192 PolarHBondContact O-N 2.98Å; A192-R194 VanDerWaalsContact C-N 3.32Å
193	H	70.8	Confident	69.1	Low	155 Å²	155	75 Å²	75	72%	0.718	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.7	174	-64.4	-79	0	0	0	113.7	V191	V191-H193 PolarHBondContact O-N 3.16Å
194	R	81.5	Confident	71.8	Confident	116 Å²	116	66.4 Å²	66.4	44%	0.438	34%	0.343	S	S	.	.	S	Bend	trans	-87.1	151.3	175.3	-59.8	-66.5	-172.1	-176.3	1.8	110.4	V191 A192 R199 W262	V191-R194 VanDerWaalsContact O-CB 3.3Å; V191-R194 WeakPolarHBondContact O-CB 3.37Å; V191-R194 PolarHBondContact O-N 2.62Å; A192-R194 VanDerWaalsContact C-N 3.32Å; R194-R199 HydrophobicContact CB-CG 3.97Å; R194-R199 WeakPolarHBondContact O-CD 3.48Å; R194-W262 HydrophobicContact CB-CH2 3.74Å; R194-W262 HydrophobicContact CB-CZ2 4.29Å; R194-W262 HydrophobicContact CG-CH2 3.58Å; R194-W262 HydrophobicContact CG-CZ2 4.16Å; R194-W262 HydrophobicContact CG-CZ3 4.15Å
195	P	86.1	Confident	74.6	Confident	78 Å²	78	55.4 Å²	55.4	51%	0.506	30%	0.302	S	S	.	.			trans	-60.1	146.6	176.4	27	-35.3	0	0	0	110.7	R197 D198 R199	P195-R197 PolarHBondContact O-N 3.43Å; P195-D198 HydrophobicContact CG-CB 4.13Å; P195-D198 WeakPolarHBondContact CG-OD2 3.48Å; P195-D198 PolarHBondContact O-N 3.26Å; P195-D198 VanDerWaalsContact O-N 3.14Å; P195-R199 PolarHBondContact O-N 3.15Å
196	L	87.2	Confident	77.3	Confident	19 Å²	19	51.3 Å²	51.3	10%	0.099	27%	0.274	C	S	.	.	H	α-helix	trans	-51.9	-43.3	-177.8	177.9	62	0	0	0	112	D198 R199 I200 L218 D227 D230 V234	L196-D198 PolarHBondContact O-N 2.67Å; L196-R199 WeakPolarHBondContact O-CB 3.03Å; L196-R199 PolarHBondContact O-N 3.14Å; L196-R199 VanDerWaalsContact O-N 3.14Å; L196-I200 HydrophobicContact CD1-CD1 3.85Å; L196-I200 HydrophobicContact CD1-CG1 3.83Å; L196-I200 HydrophobicContact CG-CG1 4.13Å; L196-I200 WeakPolarHBondContact O-CG1 3.5Å; L196-I200 PolarHBondContact O-N 3.47Å; L196-L218 HydrophobicContact CD1-CD1 4.23Å; L196-L218 HydrophobicContact CD1-CD2 3.7Å; L196-D227 HydrophobicContact CD1-CB 4.33Å; L196-D227 HydrophobicContact CD2-CB 4.27Å; L196-D227 VanDerWaalsContact CD2-O 3.24Å; L196-D227 WeakPolarHBondContact CD2-O 3.41Å; L196-D230 HydrophobicContact CD2-CB 3.92Å; L196-V234 HydrophobicContact CD2-CB 4.4Å; L196-V234 HydrophobicContact CD2-CG2 3.94Å; L196-V234 HydrophobicContact CG-CG1 4.43Å; L196-V234 HydrophobicContact CG-CG2 4.23Å
197	R	90.7	Very high	79.3	Confident	75 Å²	75	50 Å²	50	28%	0.283	26%	0.262	S	S	.	.	H	α-helix	trans	-50.1	-52.6	177.7	-170.3	-179.1	-176	-87.1	-0.9	112.9	P195 R199 I200 I201 V234 E237 V238	P195-R197 PolarHBondContact O-N 3.43Å; R197-R199 PolarHBondContact O-N 3.07Å; R197-I200 PolarHBondContact O-N 3.38Å; R197-I201 HydrophobicContact CG-CD1 4.08Å; R197-I201 VanDerWaalsContact O-CG1 3.31Å; R197-I201 WeakPolarHBondContact O-CG1 3.01Å; R197-I201 PolarHBondContact O-N 2.89Å; R197-V234 HydrophobicContact CB-CG1 4.47Å; R197-E237 WeakPolarHBondContact CD-OE2 3.34Å; R197-E237 IonicContact CZ-OE1 3.72Å; R197-E237 IonicContact CZ-OE2 2.7Å; R197-E237 VanDerWaalsContact NE-CD 3.27Å; R197-E237 IonicContact NE-OE1 3.5Å; R197-E237 PolarHBondContact NE-OE1 2.84Å; R197-E237 IonicContact NE-OE2 2.96Å; R197-E237 PolarHBondContact NE-OE2 3.15Å; R197-E237 IonicContact NH2-OE1 2.69Å; R197-E237 PolarHBondContact NH2-OE1 3.13Å; R197-V238 HydrophobicContact CG-CG1 3.88Å
198	D	89.9	Confident	81.7	Confident	44 Å²	44	46.1 Å²	46.1	24%	0.235	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-39.6	-179.5	-64.2	-4.9	0	0	0	111.1	P195 L196 I200 I201 H202 W262	P195-D198 HydrophobicContact CG-CB 4.13Å; P195-D198 WeakPolarHBondContact CG-OD2 3.48Å; P195-D198 PolarHBondContact O-N 3.26Å; P195-D198 VanDerWaalsContact O-N 3.14Å; L196-D198 PolarHBondContact O-N 2.67Å; D198-I200 VanDerWaalsContact C-N 3.34Å; D198-I200 PolarHBondContact O-N 3.43Å; D198-I201 PolarHBondContact O-N 2.92Å; D198-H202 PolarHBondContact O-N 3.08Å; D198-H202 PolarHBondContact O-ND1 2.68Å; D198-W262 HydrophobicContact CB-CH2 3.85Å; D198-W262 HydrophobicContact CB-CZ3 4.41Å
199	R	90.1	Very high	83.6	Confident	5 Å²	5	44.2 Å²	44.2	2%	0.019	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-44.7	175.6	-68.7	167.4	63.8	-154.1	-0.1	111.4	V191 R194 P195 L196 R197 L203 W217 E221 D227 W262	V191-R199 HydrophobicContact CG1-CG 3.79Å; V191-R199 VanDerWaalsContact O-CD 3.27Å; V191-R199 WeakPolarHBondContact O-CD 3.41Å; R194-R199 HydrophobicContact CB-CG 3.97Å; R194-R199 WeakPolarHBondContact O-CD 3.48Å; P195-R199 PolarHBondContact O-N 3.15Å; L196-R199 WeakPolarHBondContact O-CB 3.03Å; L196-R199 PolarHBondContact O-N 3.14Å; L196-R199 VanDerWaalsContact O-N 3.14Å; R197-R199 PolarHBondContact O-N 3.07Å; R199-L203 VanDerWaalsContact O-CB 3.32Å; R199-L203 WeakPolarHBondContact O-CB 3.32Å; R199-L203 PolarHBondContact O-N 3.44Å; R199-W217 HydrophobicContact CB-CH2 4.08Å; R199-W217 HydrophobicContact CB-CZ3 4.41Å; R199-E221 IonicContact CZ-OE2 3.91Å; R199-E221 IonicContact NE-OE2 3.99Å; R199-E221 PolarHBondContact NE-OE2 2.92Å; R199-E221 VanDerWaalsContact NE-OE2 3.16Å; R199-E221 IonicContact NH2-OE2 3.98Å; R199-E221 PolarHBondContact NH2-OE2 3.01Å; R199-D227 IonicContact CZ-OD2 2.71Å; R199-D227 IonicContact NH1-OD2 3.51Å; R199-D227 PolarHBondContact NH1-OD2 2.91Å; R199-W262 HydrophobicContact CG-CZ2 4.23Å
200	I	91.3	Very high	85.2	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.4	-39.2	176.8	-59.3	-41	0	0	0	111.7	L196 R197 D198 H202 L203 L204 M214 W217 L231 V234 L235 V238	L196-I200 HydrophobicContact CD1-CD1 3.85Å; L196-I200 HydrophobicContact CD1-CG1 3.83Å; L196-I200 HydrophobicContact CG-CG1 4.13Å; L196-I200 WeakPolarHBondContact O-CG1 3.5Å; L196-I200 PolarHBondContact O-N 3.47Å; R197-I200 PolarHBondContact O-N 3.38Å; D198-I200 VanDerWaalsContact C-N 3.34Å; D198-I200 PolarHBondContact O-N 3.43Å; I200-H202 PolarHBondContact O-N 3.44Å; I200-L203 PolarHBondContact O-N 2.92Å; I200-L204 HydrophobicContact CG2-CD1 3.97Å; I200-L204 HydrophobicContact CG2-CG 4.08Å; I200-L204 WeakPolarHBondContact O-CB 3.2Å; I200-L204 WeakPolarHBondContact O-CG 3.34Å; I200-L204 PolarHBondContact O-N 3.08Å; I200-M214 HydrophobicContact CD1-CE 4.21Å; I200-M214 HydrophobicContact CG2-CE 3.87Å; I200-W217 HydrophobicContact CD1-CZ3 4.3Å; I200-L231 HydrophobicContact CD1-CD1 3.77Å; I200-L231 HydrophobicContact CG1-CD1 4.02Å; I200-V234 HydrophobicContact CB-CG1 3.98Å; I200-V234 HydrophobicContact CG1-CG1 3.86Å; I200-V234 HydrophobicContact CG2-CG1 4.33Å; I200-L235 HydrophobicContact CG2-CD2 3.78Å; I200-V238 HydrophobicContact CB-CG2 4.19Å; I200-V238 HydrophobicContact CG2-CG2 3.51Å
201	I	92.3	Very high	86.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-48.8	175.8	-74.8	166.3	0	0	0	111.2	R197 D198 A205 V238 L250 L254 L257 V258	R197-I201 HydrophobicContact CG-CD1 4.08Å; R197-I201 VanDerWaalsContact O-CG1 3.31Å; R197-I201 WeakPolarHBondContact O-CG1 3.01Å; R197-I201 PolarHBondContact O-N 2.89Å; D198-I201 PolarHBondContact O-N 2.92Å; I201-A205 WeakPolarHBondContact O-CB 3.47Å; I201-A205 PolarHBondContact O-N 3.49Å; I201-V238 HydrophobicContact CD1-CG1 4.13Å; I201-V238 HydrophobicContact CG1-CB 4Å; I201-V238 HydrophobicContact CG1-CG1 3.93Å; I201-V238 HydrophobicContact CG1-CG2 4.3Å; I201-L250 HydrophobicContact CB-CD1 4.28Å; I201-L250 HydrophobicContact CG1-CD1 4.08Å; I201-L250 HydrophobicContact CG2-CD1 4.2Å; I201-L250 HydrophobicContact CG2-CD2 4.27Å; I201-L254 HydrophobicContact CD1-CD1 4.48Å; I201-L254 HydrophobicContact CG1-CD1 4.44Å; I201-L257 HydrophobicContact CD1-CD1 4.13Å; I201-L257 HydrophobicContact CG2-CB 4.47Å; I201-V258 HydrophobicContact CG2-CG2 3.72Å
202	H	90.3	Very high	87.5	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-35.7	-179.8	-68.6	79.7	0	0	0	112.1	D198 I200 A205 Q259 W262 Y265	D198-H202 PolarHBondContact O-N 3.08Å; D198-H202 PolarHBondContact O-ND1 2.68Å; I200-H202 PolarHBondContact O-N 3.44Å; H202-A205 PolarHBondContact O-N 2.85Å; H202-Q259 WeakPolarHBondContact NE2-CB 3.48Å; H202-Q259 PolarHBondContact NE2-N 3.24Å; H202-W262 HydrophobicContact CB-CD2 4.12Å; H202-W262 HydrophobicContact CB-CG 4.12Å; H202-W262 HydrophobicContact CB-CZ2 4.31Å; H202-W262 AromaticContact CD2-CD1 3.98Å; H202-W262 AromaticContact CD2-CD2 3.44Å; H202-W262 VanDerWaalsContact CD2-CD2 3.44Å; H202-W262 AromaticContact CD2-CE3 3.7Å; H202-W262 AromaticContact CD2-CG 3.41Å; H202-W262 VanDerWaalsContact CD2-CG 3.41Å; H202-W262 AromaticContact CE1-CD2 3.96Å; H202-W262 AromaticContact CE1-CE3 3.51Å; H202-W262 AromaticContact CE1-CZ3 3.57Å; H202-W262 AromaticContact CG-CD1 3.98Å; H202-W262 AromaticContact CG-CD2 3.53Å; H202-W262 AromaticContact CG-CE2 3.62Å; H202-W262 AromaticContact CG-CE3 3.91Å; H202-W262 AromaticContact CG-CG 3.77Å; H202-W262 AromaticContact CG-NE1 3.92Å; H202-W262 AromaticContact ND1-CD2 3.84Å; H202-W262 AromaticContact ND1-CE2 3.89Å; H202-W262 AromaticContact ND1-CE3 3.79Å; H202-W262 AromaticContact ND1-CH2 3.81Å; H202-W262 AromaticContact ND1-CZ2 3.89Å; H202-W262 AromaticContact ND1-CZ3 3.78Å; H202-W262 AromaticContact NE2-CD2 3.74Å; H202-W262 AromaticContact NE2-CE3 3.45Å; H202-Y265 WeakPolarHBondContact CA-OH 3.44Å; H202-Y265 HydrophobicContact CB-CE1 4.12Å; H202-Y265 WeakPolarHBondContact CB-OH 3.49Å; H202-Y265 AromaticContact CD2-CZ 3.81Å; H202-Y265 PolarHBondContact CD2-OH 3.12Å; H202-Y265 VanDerWaalsContact CD2-OH 3.31Å; H202-Y265 PolarHBondContact O-OH 3.24Å
203	L	90.3	Very high	88.5	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.052	25%	0.252	C	S	.	.	H	α-helix	trans	-64.7	-47	175.2	-172.1	63	0	0	0	112.1	R199 I200 A205 L206 Y209 M214 W217	R199-L203 VanDerWaalsContact O-CB 3.32Å; R199-L203 WeakPolarHBondContact O-CB 3.32Å; R199-L203 PolarHBondContact O-N 3.44Å; I200-L203 PolarHBondContact O-N 2.92Å; L203-A205 VanDerWaalsContact C-N 3.29Å; L203-A205 PolarHBondContact O-N 2.81Å; L203-L206 PolarHBondContact O-N 3.27Å; L203-Y209 HydrophobicContact CD1-CD2 4.43Å; L203-Y209 HydrophobicContact CD1-CE1 4.14Å; L203-Y209 HydrophobicContact CD1-CE2 3.64Å; L203-Y209 VanDerWaalsContact CD1-CZ 3.45Å; L203-Y209 WeakPolarHBondContact CD1-OH 3.48Å; L203-Y209 HydrophobicContact CG-CD2 4.03Å; L203-Y209 HydrophobicContact CG-CE1 4.48Å; L203-Y209 HydrophobicContact CG-CE2 3.72Å; L203-Y209 WeakPolarHBondContact O-CE2 3.43Å; L203-M214 HydrophobicContact CD2-CE 3.75Å; L203-M214 HydrophobicContact CD2-CG 4.47Å; L203-M214 HydrophobicContact CG-CE 4.35Å; L203-W217 HydrophobicContact CD1-CD2 4.4Å; L203-W217 HydrophobicContact CD1-CZ2 4.46Å; L203-W217 HydrophobicContact CD2-CD2 3.63Å; L203-W217 HydrophobicContact CD2-CE3 3.66Å; L203-W217 HydrophobicContact CD2-CG 4.07Å; L203-W217 HydrophobicContact CD2-CH2 4.44Å; L203-W217 HydrophobicContact CD2-CZ2 4.41Å; L203-W217 HydrophobicContact CD2-CZ3 4.07Å
204	L	91.3	Very high	89.2	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-73.2	-18	178	-67.1	-171.7	0	0	0	113.8	I200 L206 Y209 M214 L235 V238 Y248 L250	I200-L204 HydrophobicContact CG2-CD1 3.97Å; I200-L204 HydrophobicContact CG2-CG 4.08Å; I200-L204 WeakPolarHBondContact O-CB 3.2Å; I200-L204 WeakPolarHBondContact O-CG 3.34Å; I200-L204 PolarHBondContact O-N 3.08Å; L204-L206 VanDerWaalsContact C-N 3.33Å; L204-Y209 HydrophobicContact CD2-CD2 4.2Å; L204-M214 HydrophobicContact CD2-CE 3.47Å; L204-M214 VanDerWaalsContact CD2-CE 3.47Å; L204-M214 HydrophobicContact CD2-SD 4.11Å; L204-M214 HydrophobicContact CG-CE 3.87Å; L204-L235 HydrophobicContact CD1-CD2 4.18Å; L204-V238 HydrophobicContact CD1-CG2 4.21Å; L204-Y248 WeakPolarHBondContact CD2-O 3.3Å; L204-L250 HydrophobicContact CB-CB 3.9Å; L204-L250 HydrophobicContact CB-CD1 4.34Å
205	A	90.1	Very high	89.5	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-68.6	-32.3	172.4	0	0	0	0	0	112.3	I201 H202 L203 L250 V258 I273 L276	I201-A205 WeakPolarHBondContact O-CB 3.47Å; I201-A205 PolarHBondContact O-N 3.49Å; H202-A205 PolarHBondContact O-N 2.85Å; L203-A205 VanDerWaalsContact C-N 3.29Å; L203-A205 PolarHBondContact O-N 2.81Å; A205-L250 HydrophobicContact CB-CD2 4Å; A205-V258 HydrophobicContact CB-CB 4.45Å; A205-V258 HydrophobicContact CB-CG1 3.82Å; A205-V258 HydrophobicContact CB-CG2 3.71Å; A205-I273 HydrophobicContact CB-CD1 3.61Å; A205-L276 WeakPolarHBondContact O-CD2 3.33Å
206	L	89.5	Confident	89.5	Confident	30 Å²	30	44 Å²	44	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-71.3	-45.6	178.8	-66.1	170.1	0	0	0	112.1	L203 L204 Y265 E269 L272 I273	L203-L206 PolarHBondContact O-N 3.27Å; L204-L206 VanDerWaalsContact C-N 3.33Å; L206-Y265 HydrophobicContact CD1-CD1 3.99Å; L206-Y265 HydrophobicContact CD1-CE1 3.78Å; L206-Y265 HydrophobicContact CD2-CD1 4.04Å; L206-Y265 HydrophobicContact CD2-CE1 3.84Å; L206-Y265 HydrophobicContact CG-CD1 4.29Å; L206-Y265 HydrophobicContact CG-CE1 3.78Å; L206-E269 HydrophobicContact CD2-CB 3.74Å; L206-E269 HydrophobicContact CD2-CG 3.98Å; L206-L272 HydrophobicContact CD2-CD2 4.46Å; L206-I273 HydrophobicContact CD2-CD1 3.87Å; L206-I273 HydrophobicContact CD2-CG1 3.74Å; L206-I273 HydrophobicContact CG-CD1 4.37Å
207	K	89.7	Confident	89.5	Confident	117 Å²	117	45.8 Å²	45.8	51%	0.509	22%	0.222	S	C	.	.	S	Bend	trans	-167.2	166.4	178.6	60.4	179.1	-179.4	-178.6	0	111.2	Y209	K207-Y209 HydrophobicContact CD-CE2 4.14Å; K207-Y209 WeakPolarHBondContact CE-OH 3.29Å; K207-Y209 HydrophobicContact CG-CD2 3.91Å; K207-Y209 HydrophobicContact CG-CE2 3.42Å; K207-Y209 VanDerWaalsContact CG-CE2 3.42Å; K207-Y209 VanDerWaalsContact O-CD2 3.27Å; K207-Y209 WeakPolarHBondContact O-CD2 3.26Å
208	P	89.9	Confident	89.3	Confident	74 Å²	74	42.2 Å²	42.2	48%	0.481	21%	0.208	S	C	.	.			trans	-64.1	147.3	166.1	-19.2	32.8	0	0	0	112.4	Y248	P208-Y248 WeakPolarHBondContact CA-O 3.25Å; P208-Y248 WeakPolarHBondContact CB-O 3.34Å
209	Y	90.2	Very high	89	Confident	40 Å²	40	45.4 Å²	45.4	16%	0.157	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	151.2	177.3	-80.8	-99.8	0	0	0	110.8	L203 L204 K207 D213 M214 S247 Y248	L203-Y209 HydrophobicContact CD1-CD2 4.43Å; L203-Y209 HydrophobicContact CD1-CE1 4.14Å; L203-Y209 HydrophobicContact CD1-CE2 3.64Å; L203-Y209 VanDerWaalsContact CD1-CZ 3.45Å; L203-Y209 WeakPolarHBondContact CD1-OH 3.48Å; L203-Y209 HydrophobicContact CG-CD2 4.03Å; L203-Y209 HydrophobicContact CG-CE1 4.48Å; L203-Y209 HydrophobicContact CG-CE2 3.72Å; L203-Y209 WeakPolarHBondContact O-CE2 3.43Å; L204-Y209 HydrophobicContact CD2-CD2 4.2Å; K207-Y209 HydrophobicContact CD-CE2 4.14Å; K207-Y209 WeakPolarHBondContact CE-OH 3.29Å; K207-Y209 HydrophobicContact CG-CD2 3.91Å; K207-Y209 HydrophobicContact CG-CE2 3.42Å; K207-Y209 VanDerWaalsContact CG-CE2 3.42Å; K207-Y209 VanDerWaalsContact O-CD2 3.27Å; K207-Y209 WeakPolarHBondContact O-CD2 3.26Å; Y209-D213 HydrophobicContact CD1-CB 4.19Å; Y209-M214 VanDerWaalsContact CB-SD 3.55Å; Y209-M214 HydrophobicContact CD1-CG 4.25Å; Y209-M214 HydrophobicContact CG-CG 4.15Å; Y209-S247 CarbonylContact O-C 3.56Å; Y209-S247 WeakPolarHBondContact O-CA 3.31Å; Y209-Y248 PolarHBondContact N-O 2.88Å; Y209-Y248 VanDerWaalsContact N-O 3.12Å; Y209-Y248 PolarHBondContact O-N 3.33Å
210	R	91.3	Very high	88.8	Confident	118 Å²	118	56 Å²	56	45%	0.445	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	152.5	170.4	-52.1	-173.9	179.6	95.4	-3.5	111.1	P212 D213 M214 D245	R210-P212 HydrophobicContact CB-CG 4.15Å; R210-D213 VanDerWaalsContact CB-OD2 3.28Å; R210-D213 WeakPolarHBondContact CB-OD2 3.28Å; R210-D213 PolarHBondContact N-OD2 2.9Å; R210-D213 VanDerWaalsContact N-OD2 3.12Å; R210-D213 WeakPolarHBondContact O-CB 3.37Å; R210-D213 PolarHBondContact O-N 3.21Å; R210-M214 WeakPolarHBondContact O-CG 3.13Å; R210-M214 PolarHBondContact O-N 2.88Å; R210-M214 VanDerWaalsContact O-N 3.13Å; R210-D245 WeakPolarHBondContact CD-O 3.37Å; R210-D245 PolarHBondContact NE-O 3.45Å
211	K	88.7	Confident	88	Confident	68 Å²	68	57.6 Å²	57.6	30%	0.296	27%	0.269	S	S	.	.	H	α-helix	trans	-45.8	-47.9	175.9	-169.1	176	-174.7	177.7	0	114.8	M214 L215 T232 L235 Y248	K211-M214 PolarHBondContact O-N 3Å; K211-L215 PolarHBondContact O-N 2.93Å; K211-T232 VanDerWaalsContact CE-OG1 3.26Å; K211-T232 WeakPolarHBondContact CE-OG1 3.3Å; K211-T232 VanDerWaalsContact NZ-CG2 3.28Å; K211-T232 PolarHBondContact NZ-OG1 3.18Å; K211-L235 HydrophobicContact CB-CD1 4.46Å; K211-L235 HydrophobicContact CG-CD1 4.22Å; K211-Y248 HydrophobicContact CB-CE2 4.19Å
212	P	87.6	Confident	87.3	Confident	76 Å²	76	67 Å²	67	49%	0.494	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-40.7	176.1	23.8	-35.1	0	0	0	113.6	R210 M214 L215 L216	R210-P212 HydrophobicContact CB-CG 4.15Å; P212-M214 PolarHBondContact O-N 2.81Å; P212-L215 PolarHBondContact O-N 3.34Å; P212-L216 WeakPolarHBondContact O-CG 3.21Å; P212-L216 PolarHBondContact O-N 3.36Å
213	D	89.6	Confident	86.6	Confident	63 Å²	63	67.6 Å²	67.6	34%	0.337	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-34.5	177.8	-48.4	-30.1	0	0	0	111.1	Y209 R210 W217	Y209-D213 HydrophobicContact CD1-CB 4.19Å; R210-D213 VanDerWaalsContact CB-OD2 3.28Å; R210-D213 WeakPolarHBondContact CB-OD2 3.28Å; R210-D213 PolarHBondContact N-OD2 2.9Å; R210-D213 VanDerWaalsContact N-OD2 3.12Å; R210-D213 WeakPolarHBondContact O-CB 3.37Å; R210-D213 PolarHBondContact O-N 3.21Å; D213-W217 WeakPolarHBondContact O-CB 3.36Å; D213-W217 PolarHBondContact O-N 2.85Å
214	M	86.3	Confident	86	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-80.1	-32.6	180	-58.7	177.5	92.9	0	0	112.7	I200 L203 L204 Y209 R210 K211 P212 W217 L218 L231 L235	I200-M214 HydrophobicContact CD1-CE 4.21Å; I200-M214 HydrophobicContact CG2-CE 3.87Å; L203-M214 HydrophobicContact CD2-CE 3.75Å; L203-M214 HydrophobicContact CD2-CG 4.47Å; L203-M214 HydrophobicContact CG-CE 4.35Å; L204-M214 HydrophobicContact CD2-CE 3.47Å; L204-M214 VanDerWaalsContact CD2-CE 3.47Å; L204-M214 HydrophobicContact CD2-SD 4.11Å; L204-M214 HydrophobicContact CG-CE 3.87Å; Y209-M214 VanDerWaalsContact CB-SD 3.55Å; Y209-M214 HydrophobicContact CD1-CG 4.25Å; Y209-M214 HydrophobicContact CG-CG 4.15Å; R210-M214 WeakPolarHBondContact O-CG 3.13Å; R210-M214 PolarHBondContact O-N 2.88Å; R210-M214 VanDerWaalsContact O-N 3.13Å; K211-M214 PolarHBondContact O-N 3Å; P212-M214 PolarHBondContact O-N 2.81Å; M214-W217 PolarHBondContact O-N 2.79Å; M214-L218 WeakPolarHBondContact O-CG 3.37Å; M214-L218 PolarHBondContact O-N 3.12Å; M214-L231 HydrophobicContact CB-CD2 4.21Å; M214-L235 HydrophobicContact CE-CD2 3.74Å; M214-L235 HydrophobicContact SD-CD1 4.09Å; M214-L235 HydrophobicContact SD-CD2 3.58Å; M214-L235 VanDerWaalsContact SD-CD2 3.58Å; M214-L235 HydrophobicContact SD-CG 4.46Å
215	L	86.8	Confident	85.5	Confident	63 Å²	63	74.6 Å²	74.6	33%	0.33	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-42.8	169.4	-74.9	167.5	0	0	0	111.3	K211 P212 W217 L218 E219 K228 L231	K211-L215 PolarHBondContact O-N 2.93Å; P212-L215 PolarHBondContact O-N 3.34Å; L215-W217 VanDerWaalsContact C-N 3.34Å; L215-L218 PolarHBondContact O-N 3.44Å; L215-E219 WeakPolarHBondContact O-CB 3.5Å; L215-E219 PolarHBondContact O-N 3.42Å; L215-K228 HydrophobicContact CD2-CB 4.44Å; L215-L231 HydrophobicContact CD2-CD2 3.62Å; L215-L231 HydrophobicContact CG-CD2 3.75Å
216	L	86.8	Confident	85.1	Confident	112 Å²	112	81.1 Å²	81.1	59%	0.586	39%	0.385	S	S	*	.	H	α-helix	trans	-65.1	-36.3	173.8	-69.1	170.4	0	0	0	112.1	P212 R220	P212-L216 WeakPolarHBondContact O-CG 3.21Å; P212-L216 PolarHBondContact O-N 3.36Å; L216-R220 WeakPolarHBondContact O-CB 3.18Å; L216-R220 PolarHBondContact O-N 3.48Å
217	W	87.1	Confident	85	Confident	58 Å²	58	81.1 Å²	81.1	22%	0.22	39%	0.385	C	S	.	.	H	α-helix	trans	-65.3	-47.1	173.9	-179.4	84	0	0	0	112.3	R199 I200 L203 D213 M214 L215 E219 R220 E221	R199-W217 HydrophobicContact CB-CH2 4.08Å; R199-W217 HydrophobicContact CB-CZ3 4.41Å; I200-W217 HydrophobicContact CD1-CZ3 4.3Å; L203-W217 HydrophobicContact CD1-CD2 4.4Å; L203-W217 HydrophobicContact CD1-CZ2 4.46Å; L203-W217 HydrophobicContact CD2-CD2 3.63Å; L203-W217 HydrophobicContact CD2-CE3 3.66Å; L203-W217 HydrophobicContact CD2-CG 4.07Å; L203-W217 HydrophobicContact CD2-CH2 4.44Å; L203-W217 HydrophobicContact CD2-CZ2 4.41Å; L203-W217 HydrophobicContact CD2-CZ3 4.07Å; D213-W217 WeakPolarHBondContact O-CB 3.36Å; D213-W217 PolarHBondContact O-N 2.85Å; M214-W217 PolarHBondContact O-N 2.79Å; L215-W217 VanDerWaalsContact C-N 3.34Å; W217-E219 VanDerWaalsContact C-N 3.32Å; W217-E219 PolarHBondContact O-N 3.07Å; W217-R220 WeakPolarHBondContact O-CB 3.47Å; W217-R220 PolarHBondContact O-N 3.26Å; W217-E221 HydrophobicContact CD2-CG 4.48Å; W217-E221 HydrophobicContact CH2-CG 4.32Å; W217-E221 WeakPolarHBondContact CH2-OE2 3.38Å; W217-E221 HydrophobicContact CZ2-CG 4.01Å; W217-E221 WeakPolarHBondContact CZ2-OE2 3.25Å; W217-E221 PolarHBondContact O-N 2.76Å
218	L	86.8	Confident	84.8	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-59.3	-42.1	174.4	-76.6	-176.6	0	0	0	112	L196 M214 L215 E221 R222 A223 D227 K228 L231	L196-L218 HydrophobicContact CD1-CD1 4.23Å; L196-L218 HydrophobicContact CD1-CD2 3.7Å; M214-L218 WeakPolarHBondContact O-CG 3.37Å; M214-L218 PolarHBondContact O-N 3.12Å; L215-L218 PolarHBondContact O-N 3.44Å; L218-E221 PolarHBondContact O-N 3.29Å; L218-R222 PolarHBondContact O-N 3.16Å; L218-A223 HydrophobicContact CB-CB 3.69Å; L218-A223 HydrophobicContact CD2-CB 3.67Å; L218-A223 HydrophobicContact CG-CB 4.18Å; L218-A223 WeakPolarHBondContact O-CB 3.39Å; L218-A223 PolarHBondContact O-N 3.26Å; L218-D227 HydrophobicContact CD1-CB 4.41Å; L218-K228 HydrophobicContact CD1-CG 4.43Å; L218-L231 HydrophobicContact CD1-CB 4.11Å; L218-L231 HydrophobicContact CD1-CD1 4.2Å; L218-L231 HydrophobicContact CD1-CD2 3.92Å; L218-L231 HydrophobicContact CD1-CG 4.29Å
219	E	84.2	Confident	84.7	Confident	111 Å²	111	78.6 Å²	78.6	52%	0.519	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-42.3	175.4	-177.7	148.7	-88.5	0	0	112.4	L215 W217 E221 R222 K228	L215-E219 WeakPolarHBondContact O-CB 3.5Å; L215-E219 PolarHBondContact O-N 3.42Å; W217-E219 VanDerWaalsContact C-N 3.32Å; W217-E219 PolarHBondContact O-N 3.07Å; E219-E221 VanDerWaalsContact C-N 3.34Å; E219-E221 PolarHBondContact O-N 3.29Å; E219-R222 PolarHBondContact O-N 3.39Å; E219-K228 IonicContact OE1-NZ 3.17Å; E219-K228 PolarHBondContact OE1-NZ 2.97Å
220	R	84.1	Confident	84.7	Confident	227 Å²	227	79.9 Å²	79.9	86%	0.857	39%	0.389	S	S	*	.	H	α-helix	trans	-65	-34.3	175.8	-169.8	176.8	-174	166	3.6	113	L216 W217 R222	L216-R220 WeakPolarHBondContact O-CB 3.18Å; L216-R220 PolarHBondContact O-N 3.48Å; W217-R220 WeakPolarHBondContact O-CB 3.47Å; W217-R220 PolarHBondContact O-N 3.26Å; R220-R222 PolarHBondContact O-N 3.12Å
221	E	75.9	Confident	84.7	Confident	33 Å²	33	74.2 Å²	74.2	15%	0.154	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-5.5	172.4	-74.6	-138.6	123.3	0	0	113.9	S189 R199 W217 L218 E219 A223	S189-E221 WeakPolarHBondContact CB-OE1 3.27Å; S189-E221 PolarHBondContact OG-OE1 2.94Å; R199-E221 IonicContact CZ-OE2 3.91Å; R199-E221 IonicContact NE-OE2 3.99Å; R199-E221 PolarHBondContact NE-OE2 2.92Å; R199-E221 VanDerWaalsContact NE-OE2 3.16Å; R199-E221 IonicContact NH2-OE2 3.98Å; R199-E221 PolarHBondContact NH2-OE2 3.01Å; W217-E221 HydrophobicContact CD2-CG 4.48Å; W217-E221 HydrophobicContact CH2-CG 4.32Å; W217-E221 WeakPolarHBondContact CH2-OE2 3.38Å; W217-E221 HydrophobicContact CZ2-CG 4.01Å; W217-E221 WeakPolarHBondContact CZ2-OE2 3.25Å; W217-E221 PolarHBondContact O-N 2.76Å; L218-E221 PolarHBondContact O-N 3.29Å; E219-E221 VanDerWaalsContact C-N 3.34Å; E219-E221 PolarHBondContact O-N 3.29Å; E221-A223 VanDerWaalsContact C-N 3.25Å; E221-A223 PolarHBondContact O-N 3.38Å
222	R	75.9	Confident	84.7	Confident	198 Å²	198	74 Å²	74	75%	0.747	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	38.2	-168.3	-56	-178.7	173.9	-166.6	-3.3	112.9	L218 E219 R220	L218-R222 PolarHBondContact O-N 3.16Å; E219-R222 PolarHBondContact O-N 3.39Å; R220-R222 PolarHBondContact O-N 3.12Å
223	A	76.6	Confident	84.9	Confident	15 Å²	15	74.4 Å²	74.4	12%	0.124	38%	0.376	C	S	.	.			trans	-54.9	152.9	173.4	0	0	0	0	0	111.9	L218 E221 D227	L218-A223 HydrophobicContact CB-CB 3.69Å; L218-A223 HydrophobicContact CD2-CB 3.67Å; L218-A223 HydrophobicContact CG-CB 4.18Å; L218-A223 WeakPolarHBondContact O-CB 3.39Å; L218-A223 PolarHBondContact O-N 3.26Å; E221-A223 VanDerWaalsContact C-N 3.25Å; E221-A223 PolarHBondContact O-N 3.38Å; A223-D227 HydrophobicContact CB-CB 3.94Å; A223-D227 WeakPolarHBondContact CB-OD2 3.28Å
224	S	78.4	Confident	85	Confident	46 Å²	46	72.2 Å²	72.2	32%	0.322	37%	0.365	S	S	.	.			trans	-66.8	157.1	-176.6	90	0	0	0	0	112	K226 D227 K228	S224-K226 PolarHBondContact O-N 2.99Å; S224-K226 WeakPolarHBondContact OG-CB 3.3Å; S224-K226 PolarHBondContact OG-N 3.49Å; S224-D227 WeakPolarHBondContact CB-OD1 3.37Å; S224-D227 PolarHBondContact N-OD2 3.49Å; S224-D227 WeakPolarHBondContact O-CB 3.46Å; S224-D227 PolarHBondContact O-N 3.32Å; S224-D227 PolarHBondContact OG-N 2.97Å; S224-D227 PolarHBondContact OG-OD1 3.17Å; S224-K228 PolarHBondContact O-N 3.42Å
225	P	78.9	Confident	85.3	Confident	114 Å²	114	72.2 Å²	72.2	74%	0.74	37%	0.365	S	S	*	.	H	α-helix	trans	-57.7	-30.1	171.7	-25.2	35.4	0	0	0	112.9	K228 A229	P225-K228 PolarHBondContact O-N 3.48Å; P225-A229 PolarHBondContact O-N 3.46Å
226	K	83.3	Confident	85.4	Confident	141 Å²	141	76.3 Å²	76.3	61%	0.613	38%	0.382	S	S	*	.	H	α-helix	trans	-67	-43.4	172.9	178.6	174.6	176.9	177.8	0	111.4	S224 K228 A229 D230	S224-K226 PolarHBondContact O-N 2.99Å; S224-K226 WeakPolarHBondContact OG-CB 3.3Å; S224-K226 PolarHBondContact OG-N 3.49Å; K226-K228 PolarHBondContact O-N 3.41Å; K226-A229 PolarHBondContact O-N 2.91Å; K226-D230 WeakPolarHBondContact CE-OD2 3.48Å; K226-D230 VanDerWaalsContact CG-OD2 3.31Å; K226-D230 WeakPolarHBondContact CG-OD2 3.42Å; K226-D230 WeakPolarHBondContact O-CB 3.17Å; K226-D230 PolarHBondContact O-N 3.05Å
227	D	87.1	Confident	85.6	Confident	29 Å²	29	75.1 Å²	75.1	16%	0.155	37%	0.374	C	S	.	.	H	α-helix	trans	-55.6	-39.8	176.9	-58.6	18.3	0	0	0	111.3	L196 R199 L218 A223 S224 L231	L196-D227 HydrophobicContact CD1-CB 4.33Å; L196-D227 HydrophobicContact CD2-CB 4.27Å; L196-D227 VanDerWaalsContact CD2-O 3.24Å; L196-D227 WeakPolarHBondContact CD2-O 3.41Å; R199-D227 IonicContact CZ-OD2 2.71Å; R199-D227 IonicContact NH1-OD2 3.51Å; R199-D227 PolarHBondContact NH1-OD2 2.91Å; L218-D227 HydrophobicContact CD1-CB 4.41Å; A223-D227 HydrophobicContact CB-CB 3.94Å; A223-D227 WeakPolarHBondContact CB-OD2 3.28Å; S224-D227 WeakPolarHBondContact CB-OD1 3.37Å; S224-D227 PolarHBondContact N-OD2 3.49Å; S224-D227 WeakPolarHBondContact O-CB 3.46Å; S224-D227 PolarHBondContact O-N 3.32Å; S224-D227 PolarHBondContact OG-N 2.97Å; S224-D227 PolarHBondContact OG-OD1 3.17Å; D227-L231 WeakPolarHBondContact O-CB 3.43Å; D227-L231 PolarHBondContact O-N 2.71Å
228	K	86.2	Confident	85.8	Confident	71 Å²	71	72.3 Å²	72.3	31%	0.309	36%	0.363	S	S	.	.	H	α-helix	trans	-68	-31.7	178.9	-73	-178	170.2	-172.4	0	113.3	L215 L218 E219 S224 P225 K226	L215-K228 HydrophobicContact CD2-CB 4.44Å; L218-K228 HydrophobicContact CD1-CG 4.43Å; E219-K228 IonicContact OE1-NZ 3.17Å; E219-K228 PolarHBondContact OE1-NZ 2.97Å; S224-K228 PolarHBondContact O-N 3.42Å; P225-K228 PolarHBondContact O-N 3.48Å; K226-K228 PolarHBondContact O-N 3.41Å
229	A	87.3	Confident	86	Confident	67 Å²	67	72.6 Å²	72.6	55%	0.554	37%	0.366	S	S	*	.	H	α-helix	trans	-75.4	-52.7	173.8	0	0	0	0	0	110.8	P225 K226 L231 T232	P225-A229 PolarHBondContact O-N 3.46Å; K226-A229 PolarHBondContact O-N 2.91Å; A229-L231 PolarHBondContact O-N 2.7Å; A229-T232 PolarHBondContact O-N 2.81Å
230	D	89.7	Confident	86.3	Confident	67 Å²	67	73.7 Å²	73.7	36%	0.358	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-24.4	-176.3	-67.4	-5.3	0	0	0	112.6	L196 K226 T232 S233 V234	L196-D230 HydrophobicContact CD2-CB 3.92Å; K226-D230 WeakPolarHBondContact CE-OD2 3.48Å; K226-D230 VanDerWaalsContact CG-OD2 3.31Å; K226-D230 WeakPolarHBondContact CG-OD2 3.42Å; K226-D230 WeakPolarHBondContact O-CB 3.17Å; K226-D230 PolarHBondContact O-N 3.05Å; D230-T232 PolarHBondContact O-N 3.49Å; D230-S233 PolarHBondContact O-N 3.45Å; D230-V234 PolarHBondContact O-N 3.45Å
231	L	90.5	Very high	86.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-48	-36.7	177.9	177.9	66.8	0	0	0	113.5	I200 M214 L215 L218 D227 A229 L235	I200-L231 HydrophobicContact CD1-CD1 3.77Å; I200-L231 HydrophobicContact CG1-CD1 4.02Å; M214-L231 HydrophobicContact CB-CD2 4.21Å; L215-L231 HydrophobicContact CD2-CD2 3.62Å; L215-L231 HydrophobicContact CG-CD2 3.75Å; L218-L231 HydrophobicContact CD1-CB 4.11Å; L218-L231 HydrophobicContact CD1-CD1 4.2Å; L218-L231 HydrophobicContact CD1-CD2 3.92Å; L218-L231 HydrophobicContact CD1-CG 4.29Å; D227-L231 WeakPolarHBondContact O-CB 3.43Å; D227-L231 PolarHBondContact O-N 2.71Å; A229-L231 PolarHBondContact O-N 2.7Å; L231-L235 HydrophobicContact CD1-CD1 3.82Å; L231-L235 HydrophobicContact CD1-CD2 4.49Å; L231-L235 HydrophobicContact CD1-CG 3.84Å; L231-L235 HydrophobicContact CD2-CD1 4.35Å; L231-L235 HydrophobicContact CG-CD1 3.8Å; L231-L235 HydrophobicContact CG-CG 4.23Å; L231-L235 VanDerWaalsContact O-CB 3.3Å; L231-L235 WeakPolarHBondContact O-CB 3.31Å; L231-L235 VanDerWaalsContact O-CG 3.25Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 3.28Å
232	T	89.3	Confident	87.2	Confident	64 Å²	64	68 Å²	68	39%	0.393	36%	0.356	S	S	.	.	H	α-helix	trans	-65.7	-47.4	-179.3	-52.2	0	0	0	0	111.4	K211 A229 D230 L235 E236	K211-T232 VanDerWaalsContact CE-OG1 3.26Å; K211-T232 WeakPolarHBondContact CE-OG1 3.3Å; K211-T232 VanDerWaalsContact NZ-CG2 3.28Å; K211-T232 PolarHBondContact NZ-OG1 3.18Å; A229-T232 PolarHBondContact O-N 2.81Å; D230-T232 PolarHBondContact O-N 3.49Å; T232-L235 PolarHBondContact O-N 3.13Å; T232-E236 PolarHBondContact O-N 3.24Å
233	S	92.1	Very high	87.5	Confident	83 Å²	83	64.3 Å²	64.3	58%	0.58	36%	0.358	S	S	*	.	H	α-helix	trans	-66.5	-44.3	178.1	177.1	0	0	0	0	111	D230 L235 E236 E237	D230-S233 PolarHBondContact O-N 3.45Å; S233-L235 VanDerWaalsContact C-N 3.31Å; S233-L235 PolarHBondContact O-N 2.82Å; S233-E236 PolarHBondContact O-N 2.79Å; S233-E237 PolarHBondContact O-N 3.15Å
234	V	92.6	Very high	87.6	Confident	18 Å²	18	72.8 Å²	72.8	11%	0.109	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-39.3	176.4	173.9	0	0	0	0	111.8	L196 R197 I200 D230 E237 V238	L196-V234 HydrophobicContact CD2-CB 4.4Å; L196-V234 HydrophobicContact CD2-CG2 3.94Å; L196-V234 HydrophobicContact CG-CG1 4.43Å; L196-V234 HydrophobicContact CG-CG2 4.23Å; R197-V234 HydrophobicContact CB-CG1 4.47Å; I200-V234 HydrophobicContact CB-CG1 3.98Å; I200-V234 HydrophobicContact CG1-CG1 3.86Å; I200-V234 HydrophobicContact CG2-CG1 4.33Å; D230-V234 PolarHBondContact O-N 3.45Å; V234-E237 PolarHBondContact O-N 2.96Å; V234-V238 HydrophobicContact CG1-CG1 4.35Å; V234-V238 HydrophobicContact CG1-CG2 4.33Å; V234-V238 WeakPolarHBondContact O-CG2 3.43Å; V234-V238 PolarHBondContact O-N 3.17Å
235	L	91.7	Very high	87.9	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-68.3	-31.8	177.4	-78.9	173.9	0	0	0	113.6	I200 L204 K211 M214 L231 T232 S233 G239 Y248	I200-L235 HydrophobicContact CG2-CD2 3.78Å; L204-L235 HydrophobicContact CD1-CD2 4.18Å; K211-L235 HydrophobicContact CB-CD1 4.46Å; K211-L235 HydrophobicContact CG-CD1 4.22Å; M214-L235 HydrophobicContact CE-CD2 3.74Å; M214-L235 HydrophobicContact SD-CD1 4.09Å; M214-L235 HydrophobicContact SD-CD2 3.58Å; M214-L235 VanDerWaalsContact SD-CD2 3.58Å; M214-L235 HydrophobicContact SD-CG 4.46Å; L231-L235 HydrophobicContact CD1-CD1 3.82Å; L231-L235 HydrophobicContact CD1-CD2 4.49Å; L231-L235 HydrophobicContact CD1-CG 3.84Å; L231-L235 HydrophobicContact CD2-CD1 4.35Å; L231-L235 HydrophobicContact CG-CD1 3.8Å; L231-L235 HydrophobicContact CG-CG 4.23Å; L231-L235 VanDerWaalsContact O-CB 3.3Å; L231-L235 WeakPolarHBondContact O-CB 3.31Å; L231-L235 VanDerWaalsContact O-CG 3.25Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 3.28Å; T232-L235 PolarHBondContact O-N 3.13Å; S233-L235 VanDerWaalsContact C-N 3.31Å; S233-L235 PolarHBondContact O-N 2.82Å; L235-G239 WeakPolarHBondContact O-CA 3.19Å; L235-G239 PolarHBondContact O-N 3.35Å; L235-Y248 HydrophobicContact CB-CD1 3.84Å; L235-Y248 HydrophobicContact CB-CE1 3.8Å; L235-Y248 HydrophobicContact CB-CG 4.37Å; L235-Y248 HydrophobicContact CD1-CD2 4.3Å; L235-Y248 HydrophobicContact CD1-CE2 4.33Å; L235-Y248 HydrophobicContact CD2-CD1 4.18Å; L235-Y248 HydrophobicContact CD2-CD2 4.45Å; L235-Y248 HydrophobicContact CD2-CG 3.96Å; L235-Y248 HydrophobicContact CG-CD1 4.46Å; L235-Y248 WeakPolarHBondContact O-CD1 3.47Å
236	E	89.4	Confident	88.4	Confident	148 Å²	148	71.6 Å²	71.6	69%	0.692	38%	0.382	S	S	*	.	H	α-helix	trans	-73.5	-34.5	172.2	-173.8	164.6	-152.2	0	0	111.6	T232 S233 K251	T232-E236 PolarHBondContact O-N 3.24Å; S233-E236 PolarHBondContact O-N 2.79Å; E236-K251 WeakPolarHBondContact O-CE 3.4Å; E236-K251 PolarHBondContact O-NZ 3.07Å
237	E	91	Very high	88.8	Confident	87 Å²	87	65.4 Å²	65.4	41%	0.407	36%	0.356	S	S	.	.	H	α-helix	trans	-69.6	-48.2	175.6	-159.1	-129.2	133	0	0	112.3	R197 S233 V234 K251	R197-E237 WeakPolarHBondContact CD-OE2 3.34Å; R197-E237 IonicContact CZ-OE1 3.72Å; R197-E237 IonicContact CZ-OE2 2.7Å; R197-E237 VanDerWaalsContact NE-CD 3.27Å; R197-E237 IonicContact NE-OE1 3.5Å; R197-E237 PolarHBondContact NE-OE1 2.84Å; R197-E237 IonicContact NE-OE2 2.96Å; R197-E237 PolarHBondContact NE-OE2 3.15Å; R197-E237 IonicContact NH2-OE1 2.69Å; R197-E237 PolarHBondContact NH2-OE1 3.13Å; S233-E237 PolarHBondContact O-N 3.15Å; V234-E237 PolarHBondContact O-N 2.96Å; E237-K251 WeakPolarHBondContact O-CD 3.39Å; E237-K251 VanDerWaalsContact O-CE 3.26Å; E237-K251 WeakPolarHBondContact O-CE 3.32Å; E237-K251 PolarHBondContact O-NZ 3.31Å
238	V	91.6	Very high	89	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-103.4	-18.4	-171.6	-45	0	0	0	0	115	R197 I200 I201 L204 V234 K251 L254	R197-V238 HydrophobicContact CG-CG1 3.88Å; I200-V238 HydrophobicContact CB-CG2 4.19Å; I200-V238 HydrophobicContact CG2-CG2 3.51Å; I201-V238 HydrophobicContact CD1-CG1 4.13Å; I201-V238 HydrophobicContact CG1-CB 4Å; I201-V238 HydrophobicContact CG1-CG1 3.93Å; I201-V238 HydrophobicContact CG1-CG2 4.3Å; L204-V238 HydrophobicContact CD1-CG2 4.21Å; V234-V238 HydrophobicContact CG1-CG1 4.35Å; V234-V238 HydrophobicContact CG1-CG2 4.33Å; V234-V238 WeakPolarHBondContact O-CG2 3.43Å; V234-V238 PolarHBondContact O-N 3.17Å; V238-K251 WeakPolarHBondContact O-CG 3.43Å; V238-K251 PolarHBondContact O-N 3.49Å; V238-L254 VanDerWaalsContact CA-CD1 3.47Å; V238-L254 HydrophobicContact CB-CD1 3.53Å; V238-L254 HydrophobicContact CG1-CD1 3.91Å
239	G	90.1	Very high	89.3	Confident	5 Å²	5	64.1 Å²	64.1	5%	0.052	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.1	-175.3	0	0	0	0	0	113.6	L235 S249 K251	L235-G239 WeakPolarHBondContact O-CA 3.19Å; L235-G239 PolarHBondContact O-N 3.35Å; G239-S249 CarbonylContact C-O 3.52Å; G239-S249 WeakPolarHBondContact CA-O 3.42Å; G239-K251 WeakPolarHBondContact O-CE 3.49Å
240	K	91.3	Very high	89.6	Confident	135 Å²	135	61.2 Å²	61.2	59%	0.587	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.4	161.9	-178.3	174.8	-176.6	172.1	0	108.3	S249 K251	K240-S249 PolarHBondContact N-O 2.92Å; K240-S249 PolarHBondContact O-N 3.44Å; K240-S249 PolarHBondContact O-OG 3.42Å; K240-S249 VanDerWaalsContact O-OG 3.05Å; K240-K251 HydrophobicContact CB-CG 4.37Å
241	L	91.3	Very high	89.6	Confident	88 Å²	88	61.4 Å²	61.4	46%	0.461	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	130.3	176.1	177.7	60.2	0	0	0	110.7	S247 Y248	L241-S247 CarbonylContact C-O 3.6Å; L241-S247 WeakPolarHBondContact CA-O 3.38Å; L241-Y248 HydrophobicContact CB-CD1 4.39Å; L241-Y248 HydrophobicContact CB-CE1 4.14Å; L241-Y248 HydrophobicContact CD1-CD2 4.35Å; L241-Y248 HydrophobicContact CD1-CE1 4.26Å; L241-Y248 HydrophobicContact CD1-CE2 3.88Å
242	N	87	Confident	89.5	Confident	53 Å²	53	66.1 Å²	66.1	28%	0.283	35%	0.351	S	S	.	.			trans	-93.2	114.5	169.7	177.8	10.7	0	0	0	109.6	K244 D245 S246 S247	N242-K244 PolarHBondContact O-N 3.05Å; N242-K244 VanDerWaalsContact O-N 3.13Å; N242-K244 PolarHBondContact OD1-N 3.4Å; N242-K244 VanDerWaalsContact OD1-N 3.16Å; N242-D245 WeakPolarHBondContact CB-OD1 3.4Å; N242-D245 PolarHBondContact ND2-OD1 2.91Å; N242-D245 PolarHBondContact ND2-OD2 2.97Å; N242-D245 PolarHBondContact O-N 3.05Å; N242-S246 WeakPolarHBondContact O-CA 3.34Å; N242-S246 PolarHBondContact O-N 2.92Å; N242-S246 VanDerWaalsContact O-N 3.07Å; N242-S247 PolarHBondContact N-O 3.33Å
243	P	83	Confident	89.4	Confident	119 Å²	119	70.2 Å²	70.2	77%	0.773	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-8.7	-177.1	29.1	-36.1	0	0	0	114
244	K	78.8	Confident	89.3	Confident	193 Å²	193	67.2 Å²	67.2	84%	0.839	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-24.2	-179.7	-65	-170.4	176.1	-173.1	0	114.6	N242	N242-K244 PolarHBondContact O-N 3.05Å; N242-K244 VanDerWaalsContact O-N 3.13Å; N242-K244 PolarHBondContact OD1-N 3.4Å; N242-K244 VanDerWaalsContact OD1-N 3.16Å
245	D	84.8	Confident	89.1	Confident	61 Å²	61	67.4 Å²	67.4	33%	0.326	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	3.1	-172.4	62.1	18.6	0	0	0	114.4	R210 N242 S247	R210-D245 WeakPolarHBondContact CD-O 3.37Å; R210-D245 PolarHBondContact NE-O 3.45Å; N242-D245 WeakPolarHBondContact CB-OD1 3.4Å; N242-D245 PolarHBondContact ND2-OD1 2.91Å; N242-D245 PolarHBondContact ND2-OD2 2.97Å; N242-D245 PolarHBondContact O-N 3.05Å; D245-S247 VanDerWaalsContact CG-OG 3.28Å; D245-S247 PolarHBondContact O-N 2.93Å; D245-S247 WeakPolarHBondContact OD1-CB 3.43Å; D245-S247 PolarHBondContact OD1-N 3.26Å; D245-S247 PolarHBondContact OD1-OG 2.89Å; D245-S247 PolarHBondContact OD2-OG 3.47Å
246	S	88.1	Confident	88.9	Confident	75 Å²	75	75.2 Å²	75.2	52%	0.524	38%	0.376	S	S	.	.			trans	54	27.7	-175.3	-60.3	0	0	0	0	114.5	N242	N242-S246 WeakPolarHBondContact O-CA 3.34Å; N242-S246 PolarHBondContact O-N 2.92Å; N242-S246 VanDerWaalsContact O-N 3.07Å
247	S	91.4	Very high	88.7	Confident	10 Å²	10	72 Å²	72	7%	0.07	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	149	170.9	69.4	0	0	0	0	111.9	Y209 L241 N242 D245	Y209-S247 CarbonylContact O-C 3.56Å; Y209-S247 WeakPolarHBondContact O-CA 3.31Å; L241-S247 CarbonylContact C-O 3.6Å; L241-S247 WeakPolarHBondContact CA-O 3.38Å; N242-S247 PolarHBondContact N-O 3.33Å; D245-S247 VanDerWaalsContact CG-OG 3.28Å; D245-S247 PolarHBondContact O-N 2.93Å; D245-S247 WeakPolarHBondContact OD1-CB 3.43Å; D245-S247 PolarHBondContact OD1-N 3.26Å; D245-S247 PolarHBondContact OD1-OG 2.89Å; D245-S247 PolarHBondContact OD2-OG 3.47Å
248	Y	92.6	Very high	88.6	Confident	36 Å²	36	68.2 Å²	68.2	14%	0.141	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.2	170.4	-65.6	-102	0	0	0	107.8	L204 P208 Y209 K211 L235 L241	L204-Y248 WeakPolarHBondContact CD2-O 3.3Å; P208-Y248 WeakPolarHBondContact CA-O 3.25Å; P208-Y248 WeakPolarHBondContact CB-O 3.34Å; Y209-Y248 PolarHBondContact N-O 2.88Å; Y209-Y248 VanDerWaalsContact N-O 3.12Å; Y209-Y248 PolarHBondContact O-N 3.33Å; K211-Y248 HydrophobicContact CB-CE2 4.19Å; L235-Y248 HydrophobicContact CB-CD1 3.84Å; L235-Y248 HydrophobicContact CB-CE1 3.8Å; L235-Y248 HydrophobicContact CB-CG 4.37Å; L235-Y248 HydrophobicContact CD1-CD2 4.3Å; L235-Y248 HydrophobicContact CD1-CE2 4.33Å; L235-Y248 HydrophobicContact CD2-CD1 4.18Å; L235-Y248 HydrophobicContact CD2-CD2 4.45Å; L235-Y248 HydrophobicContact CD2-CG 3.96Å; L235-Y248 HydrophobicContact CG-CD1 4.46Å; L235-Y248 WeakPolarHBondContact O-CD1 3.47Å; L241-Y248 HydrophobicContact CB-CD1 4.39Å; L241-Y248 HydrophobicContact CB-CE1 4.14Å; L241-Y248 HydrophobicContact CD1-CD2 4.35Å; L241-Y248 HydrophobicContact CD1-CE1 4.26Å; L241-Y248 HydrophobicContact CD1-CE2 3.88Å
249	S	91.4	Very high	88.3	Confident	38 Å²	38	72.4 Å²	72.4	27%	0.266	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	147.1	174.8	55	0	0	0	0	109.3	G239 K240 K251	G239-S249 CarbonylContact C-O 3.52Å; G239-S249 WeakPolarHBondContact CA-O 3.42Å; K240-S249 PolarHBondContact N-O 2.92Å; K240-S249 PolarHBondContact O-N 3.44Å; K240-S249 PolarHBondContact O-OG 3.42Å; K240-S249 VanDerWaalsContact O-OG 3.05Å; S249-K251 PolarHBondContact O-N 2.76Å
250	L	93.4	Very high	88	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.031	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	131.6	-177	-172.2	62.5	0	0	0	111.2	I201 L204 A205 L254 Y255 V258	I201-L250 HydrophobicContact CB-CD1 4.28Å; I201-L250 HydrophobicContact CG1-CD1 4.08Å; I201-L250 HydrophobicContact CG2-CD1 4.2Å; I201-L250 HydrophobicContact CG2-CD2 4.27Å; L204-L250 HydrophobicContact CB-CB 3.9Å; L204-L250 HydrophobicContact CB-CD1 4.34Å; A205-L250 HydrophobicContact CB-CD2 4Å; L250-L254 HydrophobicContact CD1-CB 3.86Å; L250-L254 HydrophobicContact CD1-CD1 4.22Å; L250-L254 HydrophobicContact CG-CB 4.17Å; L250-Y255 HydrophobicContact CB-CE1 4.44Å; L250-Y255 HydrophobicContact CD2-CD1 3.81Å; L250-Y255 HydrophobicContact CD2-CE1 3.79Å; L250-Y255 HydrophobicContact CD2-CG 4.31Å; L250-V258 HydrophobicContact CD2-CG2 3.66Å
251	K	91.3	Very high	87.4	Confident	70 Å²	70	77.2 Å²	77.2	30%	0.304	39%	0.388	S	S	.	.			trans	-61.2	137.6	173.2	-69.7	178.8	-171.8	175.6	0	110.5	E236 E237 V238 G239 K240 S249 E253 L254	E236-K251 WeakPolarHBondContact O-CE 3.4Å; E236-K251 PolarHBondContact O-NZ 3.07Å; E237-K251 WeakPolarHBondContact O-CD 3.39Å; E237-K251 VanDerWaalsContact O-CE 3.26Å; E237-K251 WeakPolarHBondContact O-CE 3.32Å; E237-K251 PolarHBondContact O-NZ 3.31Å; V238-K251 WeakPolarHBondContact O-CG 3.43Å; V238-K251 PolarHBondContact O-N 3.49Å; G239-K251 WeakPolarHBondContact O-CE 3.49Å; K240-K251 HydrophobicContact CB-CG 4.37Å; S249-K251 PolarHBondContact O-N 2.76Å; K251-E253 PolarHBondContact O-N 3.2Å; K251-E253 VanDerWaalsContact O-N 3.14Å; K251-L254 HydrophobicContact CB-CD1 4.25Å; K251-L254 HydrophobicContact CB-CG 4.36Å; K251-L254 PolarHBondContact O-N 3.02Å
252	D	87.4	Confident	87.1	Confident	100 Å²	100	73.4 Å²	73.4	54%	0.535	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-58.6	-33.2	-170.2	-80.9	-57.7	0	0	0	114.3	L254 Y255 K280	D252-L254 PolarHBondContact O-N 3.49Å; D252-Y255 WeakPolarHBondContact O-CD2 3.36Å; D252-Y255 PolarHBondContact O-N 2.8Å; D252-K280 IonicContact OD1-NZ 2.69Å; D252-K280 PolarHBondContact OD1-NZ 3.2Å
253	E	88	Confident	86.6	Confident	150 Å²	150	74.1 Å²	74.1	70%	0.701	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-61.1	-31.8	175.9	-68.2	153.1	-140.4	0	0	113.2	K251 K256	K251-E253 PolarHBondContact O-N 3.2Å; K251-E253 VanDerWaalsContact O-N 3.14Å; E253-K256 WeakPolarHBondContact O-CG 3.39Å
254	L	89.6	Confident	86.3	Confident	19 Å²	19	70.2 Å²	70.2	10%	0.099	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-86.3	-6.7	-171.7	-58.3	179.6	0	0	0	113.6	I201 V238 L250 K251 D252 K256 L257	I201-L254 HydrophobicContact CD1-CD1 4.48Å; I201-L254 HydrophobicContact CG1-CD1 4.44Å; V238-L254 VanDerWaalsContact CA-CD1 3.47Å; V238-L254 HydrophobicContact CB-CD1 3.53Å; V238-L254 HydrophobicContact CG1-CD1 3.91Å; L250-L254 HydrophobicContact CD1-CB 3.86Å; L250-L254 HydrophobicContact CD1-CD1 4.22Å; L250-L254 HydrophobicContact CG-CB 4.17Å; K251-L254 HydrophobicContact CB-CD1 4.25Å; K251-L254 HydrophobicContact CB-CG 4.36Å; K251-L254 PolarHBondContact O-N 3.02Å; D252-L254 PolarHBondContact O-N 3.49Å; L254-K256 PolarHBondContact O-N 3.31Å; L254-K256 VanDerWaalsContact O-N 3.12Å; L254-L257 HydrophobicContact CD2-CD1 3.94Å; L254-L257 PolarHBondContact O-N 3.13Å
255	Y	87.6	Confident	86.5	Confident	23 Å²	23	61.9 Å²	61.9	9%	0.09	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-58.5	-21.7	167.2	-75.1	-64.9	0	0	0	112.5	L250 D252 L257 V258 L276 L277 K280	L250-Y255 HydrophobicContact CB-CE1 4.44Å; L250-Y255 HydrophobicContact CD2-CD1 3.81Å; L250-Y255 HydrophobicContact CD2-CE1 3.79Å; L250-Y255 HydrophobicContact CD2-CG 4.31Å; D252-Y255 WeakPolarHBondContact O-CD2 3.36Å; D252-Y255 PolarHBondContact O-N 2.8Å; Y255-L257 PolarHBondContact O-N 2.91Å; Y255-V258 HydrophobicContact CD1-CG2 4.39Å; Y255-V258 PolarHBondContact O-N 2.7Å; Y255-L276 HydrophobicContact CD1-CD2 4.44Å; Y255-L276 HydrophobicContact CE1-CD2 3.75Å; Y255-L276 HydrophobicContact CE1-CG 4.13Å; Y255-L277 WeakPolarHBondContact O-CD2 3.26Å; Y255-K280 HydrophobicContact CD1-CG 4.3Å; Y255-K280 HydrophobicContact CD2-CB 4.11Å; Y255-K280 HydrophobicContact CD2-CD 3.68Å; Y255-K280 HydrophobicContact CD2-CG 3.84Å; Y255-K280 HydrophobicContact CE1-CG 4.41Å; Y255-K280 HydrophobicContact CE2-CD 3.62Å; Y255-K280 HydrophobicContact CE2-CG 3.97Å; Y255-K280 HydrophobicContact CG-CB 4.02Å; Y255-K280 HydrophobicContact CG-CD 4.39Å; Y255-K280 HydrophobicContact CG-CG 4.03Å
256	K	87.2	Confident	86.5	Confident	164 Å²	164	63.9 Å²	63.9	71%	0.713	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-64.8	-23	171.9	-63.3	175.7	-177.3	174.6	0	113.7	E253 L254 L281	E253-K256 WeakPolarHBondContact O-CG 3.39Å; L254-K256 PolarHBondContact O-N 3.31Å; L254-K256 VanDerWaalsContact O-N 3.12Å; K256-L281 HydrophobicContact CG-CD2 3.96Å
257	L	86.1	Confident	86.1	Confident	79 Å²	79	66 Å²	66	41%	0.414	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-97.9	-4.2	-177.6	-56.8	-175.7	0	0	0	113.5	I201 L254 Y255 Q259	I201-L257 HydrophobicContact CD1-CD1 4.13Å; I201-L257 HydrophobicContact CG2-CB 4.47Å; L254-L257 HydrophobicContact CD2-CD1 3.94Å; L254-L257 PolarHBondContact O-N 3.13Å; Y255-L257 PolarHBondContact O-N 2.91Å; L257-Q259 PolarHBondContact O-N 3.01Å
258	V	89.1	Confident	85.7	Confident	9 Å²	9	72.3 Å²	72.3	6%	0.055	36%	0.36	C	S	.	.			trans	-80.4	115.7	-179.2	177.7	0	0	0	0	109.7	I201 A205 L250 Y255 I273 L277	I201-V258 HydrophobicContact CG2-CG2 3.72Å; A205-V258 HydrophobicContact CB-CB 4.45Å; A205-V258 HydrophobicContact CB-CG1 3.82Å; A205-V258 HydrophobicContact CB-CG2 3.71Å; L250-V258 HydrophobicContact CD2-CG2 3.66Å; Y255-V258 HydrophobicContact CD1-CG2 4.39Å; Y255-V258 PolarHBondContact O-N 2.7Å; V258-I273 HydrophobicContact CG1-CD1 4.19Å; V258-I273 HydrophobicContact CG1-CG2 3.74Å; V258-L277 HydrophobicContact CB-CD2 4.11Å; V258-L277 HydrophobicContact CG1-CD1 4.41Å; V258-L277 HydrophobicContact CG1-CD2 4.46Å
259	Q	85	Confident	85.5	Confident	88 Å²	88	73 Å²	73	41%	0.411	37%	0.365	S	S	.	.			trans	-79.9	138.8	-179.7	-57.3	174.8	13	0	0	110	H202 L257 Y265	H202-Q259 WeakPolarHBondContact NE2-CB 3.48Å; H202-Q259 PolarHBondContact NE2-N 3.24Å; L257-Q259 PolarHBondContact O-N 3.01Å; Q259-Y265 WeakPolarHBondContact O-CE2 3.38Å
260	R	82.8	Confident	85.3	Confident	109 Å²	109	74 Å²	74	41%	0.411	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-40	177.5	-70.6	172.9	174.5	81.3	0.2	111.4	W262 L277	R260-W262 PolarHBondContact O-N 3.04Å; R260-L277 HydrophobicContact CG-CD1 3.8Å
261	D	79.5	Confident	84.9	Confident	131 Å²	131	79.6 Å²	79.6	70%	0.701	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	32.5	-172.7	-50.7	-75.2	0	0	0	112.7
262	W	84.6	Confident	84.7	Confident	8 Å²	8	79.7 Å²	79.7	3%	0.03	39%	0.394	C	S	.	.			trans	-59.5	127.8	-179.9	-176.5	-112.4	0	0	0	111	V191 R194 D198 R199 H202 R260 G264 Y265	V191-W262 HydrophobicContact CG1-CZ2 3.98Å; R194-W262 HydrophobicContact CB-CH2 3.74Å; R194-W262 HydrophobicContact CB-CZ2 4.29Å; R194-W262 HydrophobicContact CG-CH2 3.58Å; R194-W262 HydrophobicContact CG-CZ2 4.16Å; R194-W262 HydrophobicContact CG-CZ3 4.15Å; D198-W262 HydrophobicContact CB-CH2 3.85Å; D198-W262 HydrophobicContact CB-CZ3 4.41Å; R199-W262 HydrophobicContact CG-CZ2 4.23Å; H202-W262 HydrophobicContact CB-CD2 4.12Å; H202-W262 HydrophobicContact CB-CG 4.12Å; H202-W262 HydrophobicContact CB-CZ2 4.31Å; H202-W262 AromaticContact CD2-CD1 3.98Å; H202-W262 AromaticContact CD2-CD2 3.44Å; H202-W262 VanDerWaalsContact CD2-CD2 3.44Å; H202-W262 AromaticContact CD2-CE3 3.7Å; H202-W262 AromaticContact CD2-CG 3.41Å; H202-W262 VanDerWaalsContact CD2-CG 3.41Å; H202-W262 AromaticContact CE1-CD2 3.96Å; H202-W262 AromaticContact CE1-CE3 3.51Å; H202-W262 AromaticContact CE1-CZ3 3.57Å; H202-W262 AromaticContact CG-CD1 3.98Å; H202-W262 AromaticContact CG-CD2 3.53Å; H202-W262 AromaticContact CG-CE2 3.62Å; H202-W262 AromaticContact CG-CE3 3.91Å; H202-W262 AromaticContact CG-CG 3.77Å; H202-W262 AromaticContact CG-NE1 3.92Å; H202-W262 AromaticContact ND1-CD2 3.84Å; H202-W262 AromaticContact ND1-CE2 3.89Å; H202-W262 AromaticContact ND1-CE3 3.79Å; H202-W262 AromaticContact ND1-CH2 3.81Å; H202-W262 AromaticContact ND1-CZ2 3.89Å; H202-W262 AromaticContact ND1-CZ3 3.78Å; H202-W262 AromaticContact NE2-CD2 3.74Å; H202-W262 AromaticContact NE2-CE3 3.45Å; R260-W262 PolarHBondContact O-N 3.04Å; W262-G264 PolarHBondContact O-N 2.84Å; W262-Y265 HydrophobicContact CB-CD2 3.59Å; W262-Y265 HydrophobicContact CB-CE2 3.57Å; W262-Y265 HydrophobicContact CB-CG 4.07Å; W262-Y265 AromaticContact CD1-CE1 3.95Å; W262-Y265 HydrophobicContact CG-CE2 4.35Å; W262-Y265 PolarHBondContact O-N 2.93Å
263	P	76.8	Confident	84.8	Confident	68 Å²	68	75 Å²	75	44%	0.442	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-12.3	-176	-27.5	35.8	0	0	0	115.9	P190	P190-P263 HydrophobicContact CB-CB 4.28Å; P190-P263 HydrophobicContact CG-CB 4.06Å
264	G	76.3	Confident	84.7	Confident	38 Å²	38	72.3 Å²	72.3	39%	0.392	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-8.5	176.2	0	0	0	0	0	115.4	W262	W262-G264 PolarHBondContact O-N 2.84Å
265	Y	84	Confident	84.6	Confident	17 Å²	17	79.3 Å²	79.3	7%	0.067	38%	0.381	C	S	.	.			trans	-90.7	129.4	-176.7	-64.6	-25.7	0	0	0	112.8	H202 L206 Q259 W262 E269 K270 I273	H202-Y265 WeakPolarHBondContact CA-OH 3.44Å; H202-Y265 HydrophobicContact CB-CE1 4.12Å; H202-Y265 WeakPolarHBondContact CB-OH 3.49Å; H202-Y265 AromaticContact CD2-CZ 3.81Å; H202-Y265 PolarHBondContact CD2-OH 3.12Å; H202-Y265 VanDerWaalsContact CD2-OH 3.31Å; H202-Y265 PolarHBondContact O-OH 3.24Å; L206-Y265 HydrophobicContact CD1-CD1 3.99Å; L206-Y265 HydrophobicContact CD1-CE1 3.78Å; L206-Y265 HydrophobicContact CD2-CD1 4.04Å; L206-Y265 HydrophobicContact CD2-CE1 3.84Å; L206-Y265 HydrophobicContact CG-CD1 4.29Å; L206-Y265 HydrophobicContact CG-CE1 3.78Å; Q259-Y265 WeakPolarHBondContact O-CE2 3.38Å; W262-Y265 HydrophobicContact CB-CD2 3.59Å; W262-Y265 HydrophobicContact CB-CE2 3.57Å; W262-Y265 HydrophobicContact CB-CG 4.07Å; W262-Y265 AromaticContact CD1-CE1 3.95Å; W262-Y265 HydrophobicContact CG-CE2 4.35Å; W262-Y265 PolarHBondContact O-N 2.93Å; Y265-E269 WeakPolarHBondContact CA-OE2 3.49Å; Y265-E269 HydrophobicContact CD1-CB 4.4Å; Y265-E269 HydrophobicContact CG-CB 4.35Å; Y265-K270 HydrophobicContact CD2-CG 4.46Å; Y265-I273 HydrophobicContact CD2-CG1 4.16Å; Y265-I273 HydrophobicContact CE1-CG1 4.33Å; Y265-I273 HydrophobicContact CE2-CB 4.1Å; Y265-I273 HydrophobicContact CE2-CD1 4.23Å; Y265-I273 HydrophobicContact CE2-CG1 3.62Å; Y265-I273 HydrophobicContact CE2-CG2 3.93Å; Y265-I273 WeakPolarHBondContact OH-CD1 3.38Å
266	L	83.9	Confident	84.6	Confident	104 Å²	104	79.8 Å²	79.8	55%	0.545	39%	0.385	S	S	.	.			trans	-62.2	159.1	161.6	-63.8	166.6	0	0	0	110.7	E268 E269 K270	L266-E268 HydrophobicContact CB-CG 3.97Å; L266-E268 PolarHBondContact O-N 2.88Å; L266-E269 HydrophobicContact CB-CB 4.34Å; L266-E269 HydrophobicContact CB-CG 4.08Å; L266-E269 WeakPolarHBondContact CB-OE2 3.23Å; L266-E269 PolarHBondContact N-OE2 2.84Å; L266-E269 CarbonylContact O-C 3.6Å; L266-E269 WeakPolarHBondContact O-CA 3.45Å; L266-E269 WeakPolarHBondContact O-CB 3.36Å; L266-E269 PolarHBondContact O-N 3.28Å; L266-K270 PolarHBondContact O-N 3.37Å
267	E	79.6	Confident	84.6	Confident	120 Å²	120	72.1 Å²	72.1	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-62.2	-33.6	-176.2	-154.8	58.3	-138.3	0	0	112.9	K270 Q271	E267-K270 IonicContact OE1-NZ 3.54Å; E267-K270 WeakPolarHBondContact OE2-CE 3.47Å; E267-K270 IonicContact OE2-NZ 3.59Å; E267-K270 PolarHBondContact OE2-NZ 3.34Å; E267-Q271 WeakPolarHBondContact O-CG 3.35Å; E267-Q271 PolarHBondContact O-N 3.09Å
268	E	83.3	Confident	84.6	Confident	141 Å²	141	72.6 Å²	72.6	66%	0.659	35%	0.354	S	S	*	.	H	α-helix	trans	-67.1	-34.3	171.1	58.3	-166.6	-153.1	0	0	113.1	L266 Q271 L272	L266-E268 HydrophobicContact CB-CG 3.97Å; L266-E268 PolarHBondContact O-N 2.88Å; E268-Q271 PolarHBondContact O-N 3.3Å; E268-L272 PolarHBondContact O-N 2.8Å; E268-L272 VanDerWaalsContact O-N 3.07Å
269	E	87.8	Confident	84.3	Confident	50 Å²	50	80.9 Å²	80.9	23%	0.234	38%	0.384	C	S	.	.	H	α-helix	trans	-74.1	-38.7	176.9	-68.5	177	142.3	0	0	111.4	L206 Y265 L266 Q271 L272 I273	L206-E269 HydrophobicContact CD2-CB 3.74Å; L206-E269 HydrophobicContact CD2-CG 3.98Å; Y265-E269 WeakPolarHBondContact CA-OE2 3.49Å; Y265-E269 HydrophobicContact CD1-CB 4.4Å; Y265-E269 HydrophobicContact CG-CB 4.35Å; L266-E269 HydrophobicContact CB-CB 4.34Å; L266-E269 HydrophobicContact CB-CG 4.08Å; L266-E269 WeakPolarHBondContact CB-OE2 3.23Å; L266-E269 PolarHBondContact N-OE2 2.84Å; L266-E269 CarbonylContact O-C 3.6Å; L266-E269 WeakPolarHBondContact O-CA 3.45Å; L266-E269 WeakPolarHBondContact O-CB 3.36Å; L266-E269 PolarHBondContact O-N 3.28Å; E269-Q271 VanDerWaalsContact C-N 3.3Å; E269-Q271 PolarHBondContact O-N 3.38Å; E269-L272 WeakPolarHBondContact O-CB 3.33Å; E269-L272 PolarHBondContact O-N 3.27Å; E269-L272 VanDerWaalsContact O-N 3.16Å; E269-I273 WeakPolarHBondContact O-CB 3.5Å; E269-I273 VanDerWaalsContact O-CG1 3.3Å; E269-I273 WeakPolarHBondContact O-CG1 3.44Å; E269-I273 PolarHBondContact O-N 3.4Å
270	K	87	Confident	84.2	Confident	59 Å²	59	80 Å²	80	26%	0.257	38%	0.379	S	S	.	.	H	α-helix	trans	-57.7	-42.9	170.8	-63.5	178.6	-164.7	165.8	0	111.4	Y265 L266 E267 I273 H274	Y265-K270 HydrophobicContact CD2-CG 4.46Å; L266-K270 PolarHBondContact O-N 3.37Å; E267-K270 IonicContact OE1-NZ 3.54Å; E267-K270 WeakPolarHBondContact OE2-CE 3.47Å; E267-K270 IonicContact OE2-NZ 3.59Å; E267-K270 PolarHBondContact OE2-NZ 3.34Å; K270-I273 PolarHBondContact O-N 2.96Å; K270-H274 VanDerWaalsContact O-CB 3.25Å; K270-H274 WeakPolarHBondContact O-CB 3.3Å; K270-H274 PolarHBondContact O-N 3.27Å
271	Q	85.5	Confident	83.9	Confident	124 Å²	124	78.4 Å²	78.4	58%	0.579	38%	0.378	S	S	*	.	H	α-helix	trans	-66.9	-35.3	176.4	-69	179.5	21.9	0	0	112.8	E267 E268 E269 R275	E267-Q271 WeakPolarHBondContact O-CG 3.35Å; E267-Q271 PolarHBondContact O-N 3.09Å; E268-Q271 PolarHBondContact O-N 3.3Å; E269-Q271 VanDerWaalsContact C-N 3.3Å; E269-Q271 PolarHBondContact O-N 3.38Å; Q271-R275 WeakPolarHBondContact O-CB 3.49Å; Q271-R275 PolarHBondContact O-N 2.91Å
272	L	87.7	Confident	83.5	Confident	73 Å²	73	78.9 Å²	78.9	38%	0.382	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-51.1	171.1	176.3	61.6	0	0	0	110.9	L206 E268 E269 R275 L276	L206-L272 HydrophobicContact CD2-CD2 4.46Å; E268-L272 PolarHBondContact O-N 2.8Å; E268-L272 VanDerWaalsContact O-N 3.07Å; E269-L272 WeakPolarHBondContact O-CB 3.33Å; E269-L272 PolarHBondContact O-N 3.27Å; E269-L272 VanDerWaalsContact O-N 3.16Å; L272-R275 PolarHBondContact O-N 3.21Å; L272-L276 WeakPolarHBondContact O-CB 3.34Å; L272-L276 PolarHBondContact O-N 3.24Å
273	I	90	Very high	82.1	Confident	0 Å²	0	84.4 Å²	84.4	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-64.4	-42.1	-178.6	-68.1	-72.5	0	0	0	111.4	A205 L206 V258 Y265 E269 K270 R275 L276 L277	A205-I273 HydrophobicContact CB-CD1 3.61Å; L206-I273 HydrophobicContact CD2-CD1 3.87Å; L206-I273 HydrophobicContact CD2-CG1 3.74Å; L206-I273 HydrophobicContact CG-CD1 4.37Å; V258-I273 HydrophobicContact CG1-CD1 4.19Å; V258-I273 HydrophobicContact CG1-CG2 3.74Å; Y265-I273 HydrophobicContact CD2-CG1 4.16Å; Y265-I273 HydrophobicContact CE1-CG1 4.33Å; Y265-I273 HydrophobicContact CE2-CB 4.1Å; Y265-I273 HydrophobicContact CE2-CD1 4.23Å; Y265-I273 HydrophobicContact CE2-CG1 3.62Å; Y265-I273 HydrophobicContact CE2-CG2 3.93Å; Y265-I273 WeakPolarHBondContact OH-CD1 3.38Å; E269-I273 WeakPolarHBondContact O-CB 3.5Å; E269-I273 VanDerWaalsContact O-CG1 3.3Å; E269-I273 WeakPolarHBondContact O-CG1 3.44Å; E269-I273 PolarHBondContact O-N 3.4Å; K270-I273 PolarHBondContact O-N 2.96Å; I273-R275 PolarHBondContact O-N 3.45Å; I273-L276 HydrophobicContact CD1-CD2 4.34Å; I273-L276 PolarHBondContact O-N 3.4Å; I273-L277 HydrophobicContact CG2-CD1 3.66Å; I273-L277 HydrophobicContact CG2-CG 4.17Å; I273-L277 WeakPolarHBondContact O-CB 3.32Å; I273-L277 VanDerWaalsContact O-CG 3.24Å; I273-L277 WeakPolarHBondContact O-CG 3.36Å; I273-L277 PolarHBondContact O-N 2.89Å
274	H	85.1	Confident	80.3	Confident	95 Å²	95	89.1 Å²	89.1	44%	0.44	43%	0.434	S	S	.	.	H	α-helix	trans	-55.7	-49.3	175.4	-175.7	-109.4	0	0	0	111.8	K270 L277 I278	K270-H274 VanDerWaalsContact O-CB 3.25Å; K270-H274 WeakPolarHBondContact O-CB 3.3Å; K270-H274 PolarHBondContact O-N 3.27Å; H274-L277 PolarHBondContact O-N 2.92Å; H274-I278 WeakPolarHBondContact O-CG1 3.44Å; H274-I278 PolarHBondContact O-N 2.96Å
275	R	87.8	Confident	78.6	Confident	166 Å²	166	95.2 Å²	95.2	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-68	-36.7	177	170.9	168.1	42.9	173.6	-7.5	112.9	Q271 L272 I273 R279	Q271-R275 WeakPolarHBondContact O-CB 3.49Å; Q271-R275 PolarHBondContact O-N 2.91Å; L272-R275 PolarHBondContact O-N 3.21Å; I273-R275 PolarHBondContact O-N 3.45Å; R275-R279 PolarHBondContact O-N 3.25Å; R275-R279 VanDerWaalsContact O-N 3.08Å
276	L	88.3	Confident	76.1	Confident	33 Å²	33	100.2 Å²	100.2	17%	0.173	48%	0.479	C	S	.	.	H	α-helix	trans	-65.1	-44.3	175.5	179.7	61	0	0	0	111.3	A205 Y255 L272 I273 R279 K280	A205-L276 WeakPolarHBondContact O-CD2 3.33Å; Y255-L276 HydrophobicContact CD1-CD2 4.44Å; Y255-L276 HydrophobicContact CE1-CD2 3.75Å; Y255-L276 HydrophobicContact CE1-CG 4.13Å; L272-L276 WeakPolarHBondContact O-CB 3.34Å; L272-L276 PolarHBondContact O-N 3.24Å; I273-L276 HydrophobicContact CD1-CD2 4.34Å; I273-L276 PolarHBondContact O-N 3.4Å; L276-R279 CarbonylContact O-C 3.56Å; L276-R279 PolarHBondContact O-N 3.04Å; L276-R279 VanDerWaalsContact O-N 3.14Å; L276-K280 HydrophobicContact CD1-CG 3.9Å; L276-K280 HydrophobicContact CG-CG 4.33Å; L276-K280 VanDerWaalsContact O-CB 3.32Å; L276-K280 WeakPolarHBondContact O-CB 3.47Å; L276-K280 WeakPolarHBondContact O-CG 3.46Å; L276-K280 PolarHBondContact O-N 3.14Å
277	L	86.9	Confident	73.9	Confident	2 Å²	2	102.2 Å²	102.2	1%	0.01	49%	0.491	C	S	.	.	H	α-helix	trans	-66.1	-38	177.3	-70	170.8	0	0	0	112	Y255 V258 R260 I273 H274 R279 K280 L281	Y255-L277 WeakPolarHBondContact O-CD2 3.26Å; V258-L277 HydrophobicContact CB-CD2 4.11Å; V258-L277 HydrophobicContact CG1-CD1 4.41Å; V258-L277 HydrophobicContact CG1-CD2 4.46Å; R260-L277 HydrophobicContact CG-CD1 3.8Å; I273-L277 HydrophobicContact CG2-CD1 3.66Å; I273-L277 HydrophobicContact CG2-CG 4.17Å; I273-L277 WeakPolarHBondContact O-CB 3.32Å; I273-L277 VanDerWaalsContact O-CG 3.24Å; I273-L277 WeakPolarHBondContact O-CG 3.36Å; I273-L277 PolarHBondContact O-N 2.89Å; H274-L277 PolarHBondContact O-N 2.92Å; L277-R279 VanDerWaalsContact C-N 3.34Å; L277-R279 PolarHBondContact O-N 2.96Å; L277-K280 PolarHBondContact O-N 3.37Å; L277-L281 HydrophobicContact CB-CD1 4.29Å; L277-L281 HydrophobicContact CD2-CD1 3.82Å; L277-L281 HydrophobicContact CD2-CG 4.3Å; L277-L281 VanDerWaalsContact O-CB 3.23Å; L277-L281 WeakPolarHBondContact O-CB 3.21Å; L277-L281 WeakPolarHBondContact O-CG 3.37Å; L277-L281 PolarHBondContact O-N 3.18Å
278	I	85.1	Confident	71.9	Confident	89 Å²	89	104.7 Å²	104.7	46%	0.456	50%	0.502	S	S	.	.	H	α-helix	trans	-56.9	-49.4	168.8	-69.8	163.8	0	0	0	110	H274 K280 Q282	H274-I278 WeakPolarHBondContact O-CG1 3.44Å; H274-I278 PolarHBondContact O-N 2.96Å; I278-K280 VanDerWaalsContact C-N 3.34Å; I278-K280 PolarHBondContact O-N 3.19Å; I278-Q282 VanDerWaalsContact O-CB 3.23Å; I278-Q282 WeakPolarHBondContact O-CB 3.48Å; I278-Q282 PolarHBondContact O-N 3.01Å
279	R	84.1	Confident	69.4	Low	184 Å²	184	102.6 Å²	102.6	69%	0.694	50%	0.503	S	S	*	.	H	α-helix	trans	-69	-25.6	-179.2	-156.3	-175.2	82.8	87.1	-8.6	114.5	R275 L276 L277	R275-R279 PolarHBondContact O-N 3.25Å; R275-R279 VanDerWaalsContact O-N 3.08Å; L276-R279 CarbonylContact O-C 3.56Å; L276-R279 PolarHBondContact O-N 3.04Å; L276-R279 VanDerWaalsContact O-N 3.14Å; L277-R279 VanDerWaalsContact C-N 3.34Å; L277-R279 PolarHBondContact O-N 2.96Å
280	K	81.3	Confident	66.7	Low	69 Å²	69	111.8 Å²	111.8	30%	0.3	54%	0.536	S	S	.	.	H	α-helix	trans	-100.1	-23.1	-174.9	-75	-72.8	-169.6	170.8	0	114.3	D252 Y255 L276 L277 I278	D252-K280 IonicContact OD1-NZ 2.69Å; D252-K280 PolarHBondContact OD1-NZ 3.2Å; Y255-K280 HydrophobicContact CD1-CG 4.3Å; Y255-K280 HydrophobicContact CD2-CB 4.11Å; Y255-K280 HydrophobicContact CD2-CD 3.68Å; Y255-K280 HydrophobicContact CD2-CG 3.84Å; Y255-K280 HydrophobicContact CE1-CG 4.41Å; Y255-K280 HydrophobicContact CE2-CD 3.62Å; Y255-K280 HydrophobicContact CE2-CG 3.97Å; Y255-K280 HydrophobicContact CG-CB 4.02Å; Y255-K280 HydrophobicContact CG-CD 4.39Å; Y255-K280 HydrophobicContact CG-CG 4.03Å; L276-K280 HydrophobicContact CD1-CG 3.9Å; L276-K280 HydrophobicContact CG-CG 4.33Å; L276-K280 VanDerWaalsContact O-CB 3.32Å; L276-K280 WeakPolarHBondContact O-CB 3.47Å; L276-K280 WeakPolarHBondContact O-CG 3.46Å; L276-K280 PolarHBondContact O-N 3.14Å; L277-K280 PolarHBondContact O-N 3.37Å; I278-K280 VanDerWaalsContact C-N 3.34Å; I278-K280 PolarHBondContact O-N 3.19Å
281	L	77.9	Confident	63.8	Low	75 Å²	75	114 Å²	114	39%	0.393	56%	0.559	S	S	.	*	H	α-helix	trans	-111.2	-1.6	-178.3	-55.5	179.1	0	0	0	113.5	K256 L277 P283	K256-L281 HydrophobicContact CG-CD2 3.96Å; L277-L281 HydrophobicContact CB-CD1 4.29Å; L277-L281 HydrophobicContact CD2-CD1 3.82Å; L277-L281 HydrophobicContact CD2-CG 4.3Å; L277-L281 VanDerWaalsContact O-CB 3.23Å; L277-L281 WeakPolarHBondContact O-CB 3.21Å; L277-L281 WeakPolarHBondContact O-CG 3.37Å; L277-L281 PolarHBondContact O-N 3.18Å; L281-P283 WeakPolarHBondContact O-CD 3.24Å
282	Q	69.9	Low	62	Low	142 Å²	142	113.1 Å²	113.1	66%	0.664	56%	0.564	S	S	*	*	S	Bend	trans	-66.1	123.9	169.8	-178.7	173.1	15.2	0	0	110	I278 L284	I278-Q282 VanDerWaalsContact O-CB 3.23Å; I278-Q282 WeakPolarHBondContact O-CB 3.48Å; I278-Q282 PolarHBondContact O-N 3.01Å; Q282-L284 PolarHBondContact O-N 2.89Å
283	P	55	Low	59.1	Low	123 Å²	123	117.8 Å²	117.8	80%	0.799	58%	0.584	S	S	*	*			trans	-74.6	115.5	177.1	29.4	-32.6	0	0	0	110	L281	L281-P283 WeakPolarHBondContact O-CD 3.24Å
284	L	40.2	Very low	56.2	Low	167 Å²	167	122.8 Å²	122.8	87%	0.874	62%	0.618	S	S	*	*			trans	-119.9	129.2	161.1	-173.3	62.1	0	0	0	109.6	Q282 N286	Q282-L284 PolarHBondContact O-N 2.89Å; L284-N286 PolarHBondContact O-N 3.14Å
285	H	40.2	Very low	53.5	Low	167 Å²	167	124.2 Å²	124.2	77%	0.773	63%	0.628	S	S	*	*			trans	-78	110.4	-174.2	175.6	-78	0	0	0	111.9
286	N	32.4	Very low	50.7	Low	121 Å²	121	124.3 Å²	124.3	65%	0.647	64%	0.635	S	S	*	*			trans	64.5	144.5	157.8	-157.1	20.3	0	0	0	118.8	L284	L284-N286 PolarHBondContact O-N 3.14Å
287	N	36.5	Very low	48	Very low	146 Å²	146	127.7 Å²	127.7	78%	0.781	66%	0.662	S	S	*	*			trans	-92.4	119.5	168.6	-67.4	-59.2	0	0	0	109.6
288	Q	38.2	Very low	45.3	Very low	172 Å²	172	134.2 Å²	134.2	80%	0.804	70%	0.696	S	S	*	*			trans	-168.1	133.7	147.3	-112.3	161.3	46	0	0	115.5
289	S	31	Very low	42.6	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	72%	0.715	S	S	*	*			trans	30.8	139.6	144	61.6	0	0	0	0	124.4
290	R	29.8	Very low	40	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	72%	0.72	S	S	*	*			trans	73.4	111.9	141.9	-79.8	-178.2	172.7	176.8	-2.4	120.4
291	S	26.1	Very low	37.5	Very low	107 Å²	107	141.3 Å²	141.3	75%	0.748	74%	0.742	S	S	*	*			trans	-65.1	174.4	147.2	88.9	0	0	0	0	111.5
292	P	49.2	Very low	35.1	Very low	105 Å²	105	146.3 Å²	146.3	68%	0.682	77%	0.767	S	S	*	*			cis	-136.9	-164.5	-8.6	37.7	-17.2	0	0	0	114.2
293	Q	27.3	Very low	33	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	77%	0.768	S	S	*	*			trans	79.6	116.6	155.9	-74.1	-177.6	-14.4	0	0	121.7
294	S	28.5	Very low	31.6	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	77%	0.772	S	S	*	*				72.6	164.5	127.1	87.4	0	0	0	0	119.2
295	I	27.1	Very low	31	Very low	126 Å²	126	141.4 Å²	141.4	65%	0.646	76%	0.763	S	S	*	*			cis	-154.6	153.4	6.9	-147.9	167.3	0	0	0	113.2
296	H	30.7	Very low	31.4	Very low	168 Å²	168	138.9 Å²	138.9	78%	0.778	76%	0.762	S	S	*	*			trans	55.5	174.7	165.1	-56.9	-43.2	0	0	0	116.9
297	S	31.1	Very low	31.2	Very low	104 Å²	104	137.8 Å²	137.8	73%	0.727	76%	0.763	S	S	*	*			cis	-152.6	169.3	5.8	85.6	0	0	0	0	108.8
298	L	28.8	Very low	30.8	Very low	138 Å²	138	141.7 Å²	141.7	72%	0.723	77%	0.767	S	S	*	*			cis	-167.6	156.4	-11.1	-132	176.4	0	0	0	107.6
299	H	29.5	Very low	30.4	Very low	185 Å²	185	141.3 Å²	141.3	86%	0.856	77%	0.77	S	S	*	*			trans	-155.4	154.2	142.4	-124.8	-95.2	0	0	0	112.2
300	K	30.3	Very low	30.2	Very low	183 Å²	183	142 Å²	142	80%	0.796	78%	0.775	S	S	*	*			trans	-75.2	127.9	-164.6	-83.1	-178	176.9	179.1	0	114.1
301	T	28.5	Very low	30.8	Very low	124 Å²	124	136.2 Å²	136.2	76%	0.761	77%	0.768	S	S	*	*				65.3	115.1	77.5	68.4	0	0	0	0	117.1
302	L	26.7	Very low	30.9	Very low	179 Å²	179	135 Å²	135	94%	0.937	77%	0.765	S	S	*	*				-172.7	161.9	119.4	-169.8	54.6	0	0	0	109.1
303	G	26	Very low	30.2	Very low	65 Å²	65	138.7 Å²	138.7	67%	0.67	77%	0.77	S	S	*	*			trans	-173.1	168.9	173.6	0	0	0	0	0	113
304	D	25.8	Very low	30.3	Very low	164 Å²	164	137.1 Å²	137.1	88%	0.877	77%	0.768	S	S	*	*			trans	-153.5	173	171.3	-151.7	-14.4	0	0	0	110.9
305	S	28.4	Very low	30.3	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	77%	0.772	S	S	*	*			trans	-121.6	-162.4	-175.3	-51.3	0	0	0	0	110.5
306	P	46.6	Very low	30.5	Very low	114 Å²	114	138.9 Å²	138.9	74%	0.74	78%	0.778	S	S	*	*			cis	-131.9	-176.3	-18.2	34.5	-14.6	0	0	0	114.2
307	S	29.7	Very low	30.5	Very low	98 Å²	98	136.9 Å²	136.9	69%	0.685	78%	0.777	S	S	*	*			trans	129.2	130.6	135.3	-64.1	0	0	0	0	119.3
308	R	27.9	Very low	30.4	Very low	229 Å²	229	140.3 Å²	140.3	86%	0.864	78%	0.779	S	S	*	*			trans	36.8	125	140.8	-42.3	-72.9	-176.6	176.1	0.4	117.4
309	L	29.2	Very low	30.4	Very low	164 Å²	164	143.6 Å²	143.6	86%	0.859	78%	0.782	S	S	*	*				-158.5	172.2	60.1	-85.9	166.9	0	0	0	112.8
310	S	27.7	Very low	30.1	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	78%	0.781	S	S	*	*			trans	-140.5	167.9	168.3	-49.5	0	0	0	0	108.8
311	P	42.4	Very low	30	Very low	121 Å²	121	139.3 Å²	139.3	79%	0.786	78%	0.783	S	S	*	*				-152	160.4	94.6	38.8	-21.9	0	0	0	117.3
312	A	28.2	Very low	29.9	Very low	83 Å²	83	139.7 Å²	139.7	69%	0.686	79%	0.785	S	S	*	*			trans	68.5	142.2	149.8	0	0	0	0	0	120.3
313	K	33.5	Very low	30	Very low	181 Å²	181	139.3 Å²	139.3	79%	0.787	78%	0.783	S	S	*	*			cis	-161.7	136.9	-10.4	-110.7	165.7	-170.3	175.8	0	108.7
314	N	30.2	Very low	29.9	Very low	139 Å²	139	143.3 Å²	143.3	74%	0.743	79%	0.789	S	S	*	*			trans	44.2	147.9	137.6	-59.1	-3.8	0	0	0	121.5
315	L	28.3	Very low	29.9	Very low	155 Å²	155	139.9 Å²	139.9	81%	0.812	78%	0.783	S	S	*	*			cis	-172.3	176.4	-16.4	-116.7	166	0	0	0	107.2
316	S	31.2	Very low	29.8	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	79%	0.787	S	S	*	*			trans	92.2	141.3	173	-161.3	0	0	0	0	117
317	V	30.1	Very low	28.7	Very low	125 Å²	125	140.2 Å²	140.2	76%	0.758	79%	0.788	S	S	*	*			cis	-157.8	147.7	-41.8	120.2	0	0	0	0	109.5
318	K	30.2	Very low	28.6	Very low	176 Å²	176	142.7 Å²	142.7	77%	0.765	79%	0.792	S	S	*	*			trans	2	124.9	166.8	-69.4	173.4	177.1	170.9	0	121.2
319	R	29	Very low	28.6	Very low	207 Å²	207	139.8 Å²	139.8	78%	0.781	79%	0.788	S	S	*	*				61.5	107.6	118.7	-173.4	-176.4	-68.9	167.2	-4.5	119
320	S	22.7	Very low	28.7	Very low	121 Å²	121	138.7 Å²	138.7	85%	0.846	79%	0.789	S	S	*	*			trans	-66.3	145.7	150.3	-41.1	0	0	0	0	111.5
321	L	27	Very low	29.5	Very low	158 Å²	158	138.3 Å²	138.3	83%	0.827	78%	0.784	S	S	*	*			trans	-139.8	163.2	160.7	-150.1	83.4	0	0	0	109.7
322	V	26.7	Very low	28.8	Very low	131 Å²	131	141.6 Å²	141.6	79%	0.794	79%	0.785	S	S	*	*			trans	-72.9	144.5	-173.4	171.7	0	0	0	0	112.2
323	L	28.3	Very low	28.9	Very low	171 Å²	171	146 Å²	146	90%	0.895	79%	0.789	S	S	*	*			trans	-81.9	130.5	162.2	-77.9	165.5	0	0	0	109.8
324	D	24.6	Very low	28.6	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	78%	0.784	S	S	*	*			trans	-123.1	151.3	163.6	-172.1	16	0	0	0	108.6
325	A	26.8	Very low	28.4	Very low	92 Å²	92	145.3 Å²	145.3	76%	0.76	78%	0.782	S	S	*	*			trans	-149.3	125.4	-171.1	0	0	0	0	0	112.2
326	S	26.5	Very low	28.3	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	78%	0.778	S	S	*	*			trans	-157.2	173.4	175.9	59.7	0	0	0	0	112.5
327	S	23.2	Very low	28	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	76%	0.764	S	S	*	*			trans	76.2	143.3	-169.5	-132.7	0	0	0	0	113.5
328	I	27.7	Very low	27.9	Very low	149 Å²	149	144.5 Å²	144.5	76%	0.764	77%	0.765	S	S	*	*			cis	-138.2	125.5	12	-60	167.3	0	0	0	106.8
329	Q	27.6	Very low	27.7	Very low	168 Å²	168	144.4 Å²	144.4	79%	0.785	77%	0.767	S	S	*	*				69.4	124.6	75.3	-135.1	-166.2	101.9	0	0	117.7
330	T	29.8	Very low	27.4	Very low	141 Å²	141	138.9 Å²	138.9	87%	0.865	76%	0.759	S	S	*	*			trans	-150.1	158.8	159.1	45.5	0	0	0	0	111.8
331	P	46.5	Very low	27.5	Very low	103 Å²	103	140.8 Å²	140.8	67%	0.669	76%	0.759	S	S	*	*			trans	-136.2	164.2	-154.4	41.1	-24.6	0	0	0	118.7
332	K	27.1	Very low	28.2	Very low	190 Å²	190	138 Å²	138	83%	0.826	75%	0.75	S	S	*	*				167.4	128	126.4	-93.3	161.7	-178.2	173.7	0	115.9
333	K	30.6	Very low	28.1	Very low	176 Å²	176	138.9 Å²	138.9	77%	0.765	75%	0.75	S	S	*	*			trans	57.5	150.7	144	-67.3	-172.6	158.2	-146.8	0	119.2
334	Q	26.5	Very low	28	Very low	145 Å²	145	139 Å²	139	68%	0.678	75%	0.745	S	S	*	*			cis	-167.7	176.6	-0.3	-113.8	176	-140.6	0	0	106.9
335	K	26.2	Very low	27.9	Very low	160 Å²	160	137 Å²	137	70%	0.696	74%	0.743	S	S	*	*			cis	-168.1	136.5	-6.7	161.3	-180	173.1	-171.4	0	108.6
336	L	25.2	Very low	28.7	Very low	141 Å²	141	138 Å²	138	74%	0.738	74%	0.742	S	S	*	*			trans	62.6	160.9	167.8	-67.3	-178.2	0	0	0	117.3
337	S	25.8	Very low	28.7	Very low	70 Å²	70	137.2 Å²	137.2	49%	0.49	74%	0.737	S	S	.	*			cis	-154.4	153	-5.5	-118.7	0	0	0	0	112.3
338	E	26.9	Very low	28.9	Very low	165 Å²	165	140.9 Å²	140.9	77%	0.771	74%	0.741	S	S	*	*			trans	40.7	150.8	131.7	-58.9	159.6	141.3	0	0	121.5
339	H	26	Very low	28.9	Very low	174 Å²	174	137.7 Å²	137.7	81%	0.806	74%	0.737	S	S	*	*			cis	-148.3	-172.8	3.8	-148.5	-98.7	0	0	0	112
340	C	23.7	Very low	28.9	Very low	91 Å²	91	136.5 Å²	136.5	62%	0.615	74%	0.736	S	S	*	*			trans	-108.4	144.6	-161	-56.4	0	0	0	0	117.9
341	L	23.8	Very low	28.7	Very low	160 Å²	160	135.7 Å²	135.7	84%	0.838	74%	0.735	S	S	*	*			trans	64.1	-176.8	130.9	-66.4	177.5	0	0	0	118.9
342	P	43.1	Very low	27.8	Very low	101 Å²	101	134 Å²	134	66%	0.656	74%	0.736	S	S	*	*				-141	-176.6	-59.7	42.1	-27	0	0	0	116.5
343	L	25.2	Very low	28	Very low	149 Å²	149	131 Å²	131	78%	0.78	73%	0.734	S	S	*	*			trans	70.5	122.4	140	-131	76.1	0	0	0	121.5
344	Q	24.7	Very low	27.9	Very low	172 Å²	172	130.5 Å²	130.5	80%	0.804	74%	0.739	S	S	*	*				179.1	171	100.1	-93.1	-174.9	39.5	0	0	114.1
345	S	22.7	Very low	28	Very low	109 Å²	109	127 Å²	127	76%	0.762	74%	0.742	S	S	*	*			trans	-128.6	-158.2	-178.3	-47.5	0	0	0	0	107.9
346	P	43.5	Very low	28.2	Very low	112 Å²	112	124 Å²	124	73%	0.727	75%	0.747	S	S	*	*			cis	-139.5	-154.1	-10.1	41.2	-19.6	0	0	0	114
347	S	26.5	Very low	28.5	Very low	96 Å²	96	128.6 Å²	128.6	67%	0.671	76%	0.755	S	S	*	*			trans	73.4	130.7	163.2	28	0	0	0	0	118.6
348	H	27.7	Very low	28.7	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.866	77%	0.771	S	S	*	*			cis	72.5	138.2	46.3	-74.8	-82.7	0	0	0	114
349	A	28.5	Very low	28.8	Very low	81 Å²	81	130.1 Å²	130.1	67%	0.669	77%	0.771	S	S	*	*			cis	-169.5	-176.2	-14.5	0	0	0	0	0	107.9
350	D	26.7	Very low	28.9	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	77%	0.77	S	S	*	*			cis	-159.3	-168.2	-0.8	-150.1	-83.4	0	0	0	109.6
351	C	27	Very low	29.3	Very low	125 Å²	125	128.4 Å²	128.4	85%	0.845	78%	0.78	S	S	*	*			trans	68.5	144.2	173.3	-58.1	0	0	0	0	116.6
352	G	26	Very low	29.7	Very low	67 Å²	67	130.2 Å²	130.2	69%	0.691	78%	0.784	S	S	*	*			cis	175.2	-175.5	-0.8	0	0	0	0	0	108.6
353	T	32	Very low	28.9	Very low	126 Å²	126	129 Å²	129	77%	0.773	79%	0.79	S	S	*	*			cis	-168.2	164	-9.3	-7	0	0	0	0	109.6
354	N	28.8	Very low	29	Very low	166 Å²	166	129.8 Å²	129.8	89%	0.888	79%	0.794	S	S	*	*			trans	71.2	139.2	170.5	-51	-36.9	0	0	0	118.3
355	G	28.5	Very low	29.2	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	79%	0.792	S	S	*	*			cis	168.7	158.4	-12.5	0	0	0	0	0	115.2
356	A	29.8	Very low	29.4	Very low	97 Å²	97	126 Å²	126	80%	0.802	79%	0.787	S	S	*	*			trans	63	149.2	160.4	0	0	0	0	0	120.2
357	R	32.6	Very low	28.8	Very low	239 Å²	239	125.4 Å²	125.4	90%	0.902	79%	0.792	S	S	*	*			cis	-157.7	162.9	-13.4	-113.5	168.2	108.5	179.8	4.4	110.1
358	N	28.7	Very low	28.9	Very low	157 Å²	157	125.4 Å²	125.4	84%	0.84	80%	0.797	S	S	*	*			trans	-86.3	157.1	-175	-42.1	-11.4	0	0	0	113.3
359	S	30.2	Very low	28.8	Very low	110 Å²	110	122 Å²	122	77%	0.769	79%	0.79	S	S	*	*				179.2	133.8	118.5	58.4	0	0	0	0	116.3
360	S	28.4	Very low	28.8	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	80%	0.799	S	S	*	*			trans	0.1	149.4	147.5	59.1	0	0	0	0	123.1
361	S	31.3	Very low	28.9	Very low	119 Å²	119	126.6 Å²	126.6	83%	0.832	80%	0.798	S	S	*	*				-175.4	177.9	106.2	65	0	0	0	0	114.4
362	H	31.3	Very low	28.7	Very low	197 Å²	197	128 Å²	128	91%	0.912	79%	0.793	S	S	*	*			trans	-77.3	167.7	174.8	-73.8	-5.1	0	0	0	114
363	G	27.2	Very low	28.8	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	80%	0.797	S	S	*	*			trans	-162.9	136.4	162	0	0	0	0	0	111.9
364	N	28	Very low	28.5	Very low	165 Å²	165	133.6 Å²	133.6	88%	0.882	79%	0.794	S	S	*	*			trans	-132.9	143.4	-175.1	-123.6	5.4	0	0	0	110.6
365	S	27.9	Very low	28.7	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	79%	0.785	S	S	*	*			trans	70.9	139.4	152.2	-158.1	0	0	0	0	122.8
366	S	26.2	Very low	28.8	Very low	96 Å²	96	134.8 Å²	134.8	67%	0.671	79%	0.787	S	S	*	*			trans	53.8	101.4	139.6	60.1	0	0	0	0	123.5
367	A	31	Very low	28.8	Very low	100 Å²	100	137.1 Å²	137.1	83%	0.826	79%	0.786	S	S	*	*				66.2	162	104.2	0	0	0	0	0	123.4
368	A	29.2	Very low	28.8	Very low	95 Å²	95	132 Å²	132	79%	0.785	78%	0.777	S	S	*	*			trans	78.1	157.7	178.3	0	0	0	0	0	115
369	T	25.8	Very low	28.7	Very low	117 Å²	117	132.6 Å²	132.6	72%	0.718	77%	0.774	S	S	*	*			cis	-147.9	144	25.8	53.1	0	0	0	0	117.1
370	K	28.9	Very low	28.8	Very low	197 Å²	197	133.5 Å²	133.5	86%	0.857	77%	0.769	S	S	*	*			trans	72.3	173.5	134.9	-73.1	178.8	176.4	-174.1	0	121.9
371	T	28.1	Very low	29	Very low	122 Å²	122	136.9 Å²	136.9	75%	0.748	77%	0.773	S	S	*	*			trans	92.5	127.4	169.9	-56.4	0	0	0	0	116.5
372	E	23.8	Very low	28.7	Very low	156 Å²	156	134.6 Å²	134.6	73%	0.729	77%	0.768	S	S	*	*			cis	-160.5	-179.6	-16.2	-111.7	-173	128.3	0	0	111.2
373	F	27.3	Very low	28.4	Very low	175 Å²	175	133 Å²	133	77%	0.768	77%	0.767	S	S	*	*			trans	-14.2	161.6	165	-69.9	-98.6	0	0	0	121.7
374	D	26.4	Very low	29.6	Very low	134 Å²	134	134 Å²	134	72%	0.717	76%	0.759	S	S	*	*			cis	-179.6	-172.8	-19.2	-163.2	-7.5	0	0	0	109.8
375	I	33.1	Very low	29.6	Very low	136 Å²	136	133.2 Å²	133.2	70%	0.697	76%	0.76	S	S	*	*			trans	96.6	108	160.6	-54.1	178.7	0	0	0	120
376	T	29.9	Very low	29.5	Very low	127 Å²	127	131.2 Å²	131.2	78%	0.779	76%	0.756	S	S	*	*			trans	62.9	131.6	158	56.5	0	0	0	0	120.1
377	N	29.8	Very low	29.6	Very low	145 Å²	145	134 Å²	134	78%	0.775	76%	0.763	S	S	*	*			cis	69.7	136.6	16.4	-86.3	-13.1	0	0	0	117.5
378	N	32.6	Very low	29.5	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	76%	0.764	S	S	*	*			cis	-129.5	178.5	11.2	-71.3	-72.6	0	0	0	111.2
379	H	27.3	Very low	29.6	Very low	169 Å²	169	140.2 Å²	140.2	78%	0.782	76%	0.763	S	S	*	*				164.6	141.5	70.6	178	100.1	0	0	0	108
380	L	31.6	Very low	30.6	Very low	128 Å²	128	139.1 Å²	139.1	67%	0.67	76%	0.758	S	S	*	*			cis	-156.8	179.9	-9.9	-160.7	66.9	0	0	0	109.4
381	Q	32.3	Very low	30.5	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	75%	0.753	S	S	*	*			trans	-85.7	-179.9	167.5	-62.5	147.1	-28.5	0	0	110.9
382	G	25.3	Very low	30.5	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	76%	0.755	S	S	*	*			cis	139	152.1	-6.9	0	0	0	0	0	114.2
383	N	24.9	Very low	30.7	Very low	165 Å²	165	140.6 Å²	140.6	88%	0.882	76%	0.76	S	S	*	*			trans	77.7	175.8	167.7	-121	17.9	0	0	0	117.8
384	P	52.3	Low	30.6	Very low	95 Å²	95	137 Å²	137	62%	0.617	76%	0.757	S	S	*	*				-142.4	-175.3	-117.3	45.4	-24.4	0	0	0	118.6
385	V	27.6	Very low	30.8	Very low	149 Å²	149	138.8 Å²	138.8	90%	0.903	76%	0.763	S	S	*	*			trans	66.6	122.5	162.8	-175.6	0	0	0	0	118.6
386	G	27.1	Very low	31.5	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	76%	0.764	S	S	*	*			trans	165.6	83.3	159.9	0	0	0	0	0	120
387	L	28.2	Very low	31.3	Very low	155 Å²	155	137.7 Å²	137.7	81%	0.812	77%	0.768	S	S	*	*			trans	61.9	166.7	147.9	-74.8	160.4	0	0	0	122.3
388	Y	27.2	Very low	31.1	Very low	217 Å²	217	134.9 Å²	134.9	85%	0.851	77%	0.765	S	S	*	*			trans	76.5	114.1	168.4	-60.3	-72.8	0	0	0	121.7
389	S	33.2	Very low	30.9	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	77%	0.771	S	S	*	*			trans	-101.1	-176.6	147.4	-143.6	0	0	0	0	107.1
390	P	46.3	Very low	30.8	Very low	94 Å²	94	132.4 Å²	132.4	61%	0.61	76%	0.763	S	S	*	*			cis	-146.3	-171.2	9	31.8	-5.1	0	0	0	117.7
391	H	26.7	Very low	30.6	Very low	162 Å²	162	135.3 Å²	135.3	75%	0.75	77%	0.77	S	S	*	*			trans	89.1	130.3	145.2	-70.1	-34.9	0	0	0	124.3
392	K	27.8	Very low	30.5	Very low	185 Å²	185	132.6 Å²	132.6	80%	0.804	76%	0.761	S	S	*	*			trans	69.6	145.4	147.4	-71.6	177.7	-178.6	-178.8	0	117.2
393	L	27.8	Very low	30.6	Very low	158 Å²	158	135.8 Å²	135.8	83%	0.827	76%	0.757	S	S	*	*			cis	-114	-168.6	0.3	-61.8	165.3	0	0	0	109.6
394	S	24.3	Very low	30.8	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	75%	0.747	S	S	*	*			cis	-154.6	175.5	-0.6	-149.2	0	0	0	0	112.6
395	M	31.8	Very low	29.5	Very low	172 Å²	172	135.8 Å²	135.8	85%	0.847	75%	0.748	S	S	*	*			trans	-146.2	-179.2	165.1	-76	-70.3	172.3	0	0	107
396	P	47.7	Very low	29.6	Very low	110 Å²	110	136.6 Å²	136.6	71%	0.714	74%	0.742	S	S	*	*			cis	-133.3	-176.9	-5.7	40.1	-21.7	0	0	0	115.5
397	C	24.8	Very low	30.4	Very low	129 Å²	129	138.8 Å²	138.8	87%	0.872	74%	0.744	S	S	*	*			trans	35.2	131.2	145.4	-66.7	0	0	0	0	124.1
398	A	25.8	Very low	30.4	Very low	87 Å²	87	135.8 Å²	135.8	72%	0.719	74%	0.742	S	S	*	*			trans	-158.2	126	141.3	0	0	0	0	0	114.3
399	I	29.4	Very low	31.6	Very low	163 Å²	163	131 Å²	131	84%	0.836	74%	0.737	S	S	*	*			trans	65.5	148.8	133	-62.2	171.3	0	0	0	120.4
400	S	25.4	Very low	31.3	Very low	87 Å²	87	133.4 Å²	133.4	61%	0.608	74%	0.74	S	S	*	*				-175.8	163.6	-56.9	65.7	0	0	0	0	110.5
401	K	27.7	Very low	30.5	Very low	189 Å²	189	136 Å²	136	82%	0.822	75%	0.748	S	S	*	*			trans	71.7	155.7	151.9	-80.6	-174.6	176.5	-176	0	118.3
402	L	28.7	Very low	31.4	Very low	123 Å²	123	133.9 Å²	133.9	64%	0.644	75%	0.749	S	S	*	*			cis	-168.2	138.5	-11.1	175.7	67.5	0	0	0	111.9
403	E	28.5	Very low	31.4	Very low	138 Å²	138	130 Å²	130	65%	0.645	74%	0.744	S	S	*	*			trans	53.2	157.1	161.6	-73.6	178.6	81.3	0	0	120.1
404	K	28.5	Very low	32.1	Very low	157 Å²	157	128.6 Å²	128.6	68%	0.683	75%	0.745	S	S	*	*			cis	-153.6	173.8	0.1	-136.1	-174.7	-178.2	86.3	0	106.8
405	T	25.6	Very low	32.4	Very low	104 Å²	104	132.7 Å²	132.7	64%	0.638	75%	0.75	S	S	*	*			cis	-150.9	136.7	4.8	-42.2	0	0	0	0	104.6
406	E	29.9	Very low	32.7	Very low	166 Å²	166	130.2 Å²	130.2	78%	0.776	75%	0.747	S	S	*	*				57.7	146.9	74.1	-110.7	-149.2	129.9	0	0	117.1
407	P	42.3	Very low	31.8	Very low	111 Å²	111	134.4 Å²	134.4	72%	0.721	75%	0.749	S	S	*	*			cis	-121.7	179.6	-9.7	12	13.9	0	0	0	116.3
408	A	28.5	Very low	32.2	Very low	92 Å²	92	134.2 Å²	134.2	76%	0.76	73%	0.734	S	S	*	*			trans	-108.8	-126.9	174.7	0	0	0	0	0	111.2
409	P	53.3	Low	32.3	Very low	116 Å²	116	137.3 Å²	137.3	75%	0.753	74%	0.739	S	S	*	*			cis	-96.7	-143.4	-1.4	9.6	15.5	0	0	0	113.1
410	I	27	Very low	32.1	Very low	158 Å²	158	132.8 Å²	132.8	81%	0.81	73%	0.732	S	S	*	*			cis	-151	-162.1	12.3	-16.8	176.9	0	0	0	113
411	L	29.5	Very low	32.1	Very low	150 Å²	150	135.4 Å²	135.4	79%	0.785	75%	0.745	S	S	*	*			trans	-127.1	-172	-178	-119.2	75.1	0	0	0	110.2
412	P	46.3	Very low	32.1	Very low	117 Å²	117	131.3 Å²	131.3	76%	0.76	74%	0.74	S	S	*	*			cis	-140.5	177.5	14.2	40.6	-19.1	0	0	0	119.7
413	S	25.8	Very low	32	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	75%	0.751	S	S	*	*			trans	-30.3	166.6	155.2	-69	0	0	0	0	119.4
414	P	43.6	Very low	31.8	Very low	130 Å²	130	132.3 Å²	132.3	84%	0.844	76%	0.756	S	S	*	*			cis	-149.4	-171.8	41.5	42.6	-19.8	0	0	0	120.9
415	K	30.6	Very low	31.6	Very low	186 Å²	186	130.7 Å²	130.7	81%	0.809	76%	0.76	S	S	*	*			trans	-118.3	163.4	176.9	-78.9	174.1	179.3	165.1	0	109.1
416	P	38.5	Very low	31.8	Very low	119 Å²	119	135 Å²	135	77%	0.773	77%	0.77	S	S	*	*				-138.3	178.1	58.8	38.3	-16.5	0	0	0	113.8
417	R	27.7	Very low	31.7	Very low	199 Å²	199	136.5 Å²	136.5	75%	0.751	78%	0.777	S	S	*	*			cis	69.3	140.3	35.8	-73.5	-177.6	158.9	-151.4	-3.9	113.7
418	H	33.2	Very low	31	Very low	124 Å²	124	139.1 Å²	139.1	57%	0.574	78%	0.78	S	S	*	*			cis	-162.9	151.7	-1.4	-120.4	-61.3	0	0	0	110.7
419	N	27.4	Very low	31.1	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	79%	0.785	S	S	*	*			trans	63.3	165.2	155.5	-51.9	-12.6	0	0	0	118
420	G	25.6	Very low	29.9	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	78%	0.776	S	S	*	*			cis	171.8	163.8	-11.8	0	0	0	0	0	113.9
421	T	25.6	Very low	30	Very low	143 Å²	143	140.2 Å²	140.2	88%	0.877	78%	0.777	S	S	*	*			trans	76.1	107.2	158.6	-48.2	0	0	0	0	122.4
422	S	28	Very low	30.1	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	77%	0.772	S	S	*	*			trans	2.9	135.5	140.9	171.4	0	0	0	0	122.8
423	I	26.4	Very low	29.5	Very low	168 Å²	168	138.2 Å²	138.2	86%	0.862	77%	0.771	S	S	*	*				-164.1	170.6	119.3	-103.2	164.1	0	0	0	110.9
424	C	23.9	Very low	30.1	Very low	113 Å²	113	138.7 Å²	138.7	76%	0.764	76%	0.762	S	S	*	*			trans	-136.4	141.5	-164.6	168.7	0	0	0	0	114.3
425	T	25.6	Very low	29.6	Very low	124 Å²	124	140.3 Å²	140.3	76%	0.761	76%	0.755	S	S	*	*			trans	-153.1	140	150.5	-0	0	0	0	0	113.7
426	K	28.1	Very low	29.7	Very low	193 Å²	193	140.5 Å²	140.5	84%	0.839	76%	0.756	S	S	*	*			trans	19.2	134	150	-62.6	172.8	-176	177.6	0	118.6
427	Q	28.9	Very low	29.3	Very low	199 Å²	199	143.9 Å²	143.9	93%	0.93	76%	0.759	S	S	*	*				-135.5	178.5	65.8	-159.7	165.2	2.9	0	0	114.4
428	Q	28.3	Very low	29.3	Very low	166 Å²	166	144.8 Å²	144.8	78%	0.776	76%	0.762	S	S	*	*			trans	-144.7	140.3	-157.6	169.1	-173.1	-3.9	0	0	112
429	L	29.2	Very low	29.2	Very low	166 Å²	166	143.5 Å²	143.5	87%	0.869	77%	0.767	S	S	*	*			trans	-177	110.6	145.7	-93.8	161.7	0	0	0	105.3
430	A	29.6	Very low	29.5	Very low	69 Å²	69	146.1 Å²	146.1	57%	0.57	77%	0.771	S	S	*	*				69.2	127.6	78.4	0	0	0	0	0	112.9
431	N	27.4	Very low	29.7	Very low	154 Å²	154	151.9 Å²	151.9	82%	0.824	78%	0.777	S	S	*	*			cis	-137.2	156.7	-5.7	-86.6	-40.3	0	0	0	107.8
432	G	31.9	Very low	30.3	Very low	67 Å²	67	153.5 Å²	153.5	69%	0.691	78%	0.775	S	S	*	*			cis	92.6	139.4	49.9	0	0	0	0	0	109.1
433	Q	35	Very low	30.4	Very low	157 Å²	157	158.1 Å²	158.1	73%	0.734	78%	0.782	S	S	*	*			cis	-158.7	169.4	3.1	-74.8	-164.7	13.8	0	0	107.4
434	H	37.4	Very low	30.5	Very low	112 Å²	112	154.2 Å²	154.2	52%	0.519	76%	0.762	S	S	.	*			cis	-157.4	142.6	-13.2	-106.5	167.8	0	0	0	108.1
435	K	33.3	Very low	30.8	Very low	164 Å²	164	156.1 Å²	156.1	71%	0.713	76%	0.758	S	S	*	*				49.8	136.1	103.1	-49.8	175	-176.6	155.4	0	114.7
436	K	33.2	Very low	31.1	Very low	190 Å²	190	156.1 Å²	156.1	83%	0.826	75%	0.749	S	S	*	*			cis	-153.4	147.8	39	-73.5	174.2	-178.5	167.7	0	114
437	K	30.7	Very low	31.1	Very low	191 Å²	191	153.1 Å²	153.1	83%	0.83	73%	0.733	S	S	*	*				25.3	148.9	129.3	-68.2	177.6	175.3	177.3	0	119.5
438	R	25.6	Very low	31	Very low	218 Å²	218	148.6 Å²	148.6	82%	0.823	72%	0.715	S	S	*	*			cis	-163.6	143.1	29.9	-142.8	-178.1	-177.9	171.7	-1.1	113.4
439	S	31.3	Very low	31	Very low	97 Å²	97	146.6 Å²	146.6	68%	0.678	70%	0.7	S	S	*	*			trans	16.9	130.4	148.9	64.6	0	0	0	0	122.7
440	K	34.7	Very low	30.9	Very low	208 Å²	208	145.8 Å²	145.8	90%	0.904	70%	0.696	S	S	*	*				-153.8	150.7	121.4	-159.7	65.5	175.9	-174.7	0	111.5
441	K	30.1	Very low	30.9	Very low	188 Å²	188	147 Å²	147	82%	0.817	69%	0.688	S	S	*	*			trans	-95.7	134.4	179	170	-179.8	176.7	-179.1	0	110.1
442	H	37	Very low	31	Very low	177 Å²	177	145 Å²	145	82%	0.819	68%	0.684	S	S	*	*			trans	57.1	117.7	159.4	-159.3	-96.8	0	0	0	118.1
443	K	31.7	Very low	30.8	Very low	200 Å²	200	144.9 Å²	144.9	87%	0.87	67%	0.667	S	S	*	*			trans	-142.8	119.7	160.6	-173	166.2	-178.7	-179.9	0	111.8
444	D	27.5	Very low	30.3	Very low	85 Å²	85	147.9 Å²	147.9	46%	0.455	67%	0.672	S	S	.	*			trans	-58.8	138.4	165.9	151.5	62.8	0	0	0	112	E446	D444-E446 PolarHBondContact OD1-N 3.01Å
445	K	29.8	Very low	30.3	Very low	153 Å²	153	145.7 Å²	145.7	67%	0.665	66%	0.664	S	S	*	*			trans	-161.7	113.1	130.5	-136.9	69.5	-144.1	149.8	0	112.8
446	E	32.1	Very low	30	Very low	124 Å²	124	145.5 Å²	145.5	58%	0.579	67%	0.665	S	S	*	*			trans	-63.2	148.5	151.6	-61	168.6	138.6	0	0	110.7	D444 K550	D444-E446 PolarHBondContact OD1-N 3.01Å; E446-K550 IonicContact OE1-NZ 2.6Å; E446-K550 PolarHBondContact OE1-NZ 3.33Å; E446-K550 IonicContact OE2-NZ 3.35Å; E446-K550 PolarHBondContact OE2-NZ 2.93Å
447	R	29.2	Very low	29.6	Very low	131 Å²	131	142.6 Å²	142.6	49%	0.494	66%	0.663	S	S	.	*				-163.7	147.3	127.5	-162.1	150.8	-56.7	-159.2	4.8	111.8	P544 G545	R447-P544 PolarHBondContact NH1-O 3.01Å; R447-G545 PolarHBondContact NH1-O 3.02Å; R447-G545 PolarHBondContact NH2-O 2.97Å
448	D	25.3	Very low	29.4	Very low	104 Å²	104	138.6 Å²	138.6	56%	0.556	66%	0.659	S	S	*	*			trans	67	138.3	160.6	-74.8	-8	0	0	0	118.6
449	R	29.3	Very low	29.8	Very low	124 Å²	124	133.7 Å²	133.7	47%	0.468	66%	0.656	S	S	.	*			cis	-157.9	117.8	-19.2	-149.3	173.5	-91	-178.7	5.3	109.7
450	L	27.5	Very low	29.5	Very low	148 Å²	148	136 Å²	136	78%	0.775	66%	0.661	S	S	*	*			trans	-138.4	91.2	170.6	-78.4	-179.5	0	0	0	111.9
451	K	29.3	Very low	29.2	Very low	95 Å²	95	132.1 Å²	132.1	41%	0.413	65%	0.647	S	S	.	*			trans	-90.5	126.6	148.3	-81.5	-172.6	162.9	-150.9	0	109.2	R134 D453	R134-K451 VanDerWaalsContact CD-CB 3.44Å; R134-K451 VanDerWaalsContact CD-O 3.29Å; R134-K451 WeakPolarHBondContact CD-O 3.42Å; R134-K451 PolarHBondContact NH1-O 3.42Å; K451-D453 IonicContact NZ-OD2 3.18Å
452	P	28.5	Very low	29.2	Very low	112 Å²	112	132.9 Å²	132.9	73%	0.727	65%	0.651	S	S	*	*			trans	-108.7	95.1	157.3	33.4	-21.6	0	0	0	110.5
453	D	27.3	Very low	28.7	Very low	65 Å²	65	133.1 Å²	133.1	35%	0.348	65%	0.652	S	S	.	*			trans	-89.6	104.9	151.4	-44.1	-64.3	0	0	0	103.3	R134 K451	R134-D453 VanDerWaalsContact CD-OD2 3.28Å; R134-D453 WeakPolarHBondContact CD-OD2 3.38Å; R134-D453 HydrophobicContact CG-CB 4.04Å; R134-D453 WeakPolarHBondContact CG-OD2 3.41Å; K451-D453 IonicContact NZ-OD2 3.18Å
454	W	25.9	Very low	28.4	Very low	219 Å²	219	130.4 Å²	130.4	83%	0.83	65%	0.647	S	S	*	*				50.8	106.7	69.1	-165.5	-92.6	0	0	0	112.5
455	I	36.4	Very low	28.4	Very low	67 Å²	67	135.6 Å²	135.6	34%	0.344	67%	0.669	S	S	.	*				-175.8	154.4	125.3	-92.2	176.7	0	0	0	109	M137 E141	M137-I455 HydrophobicContact CE-CB 3.69Å; M137-I455 HydrophobicContact CE-CG2 3.39Å; M137-I455 HydrophobicContact CG-CB 4.22Å; E141-I455 HydrophobicContact CG-CD1 4.28Å; E141-I455 WeakPolarHBondContact OE1-CD1 3.12Å
456	E	26.9	Very low	28.4	Very low	160 Å²	160	136.3 Å²	136.3	75%	0.748	67%	0.674	S	S	*	*			trans	26.5	114.2	163.3	-68	153.8	166.5	0	0	122.7
457	T	26	Very low	28.1	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	68%	0.68	S	S	*	*				-71	151.5	107	34.1	0	0	0	0	109.6
458	S	25.4	Very low	28.3	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	69%	0.692	S	S	*	*			cis	-151.3	175.6	18.3	-116.7	0	0	0	0	111.1
459	P	35.5	Very low	28.5	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	71%	0.709	S	S	*	*			trans	-93.9	158.7	-165.6	37.4	-36.4	0	0	0	115
460	D	24	Very low	28.6	Very low	145 Å²	145	140 Å²	140	78%	0.775	72%	0.724	S	S	*	*				-155.2	-169.6	121.7	-141.9	-42.3	0	0	0	110.2
461	M	28.4	Very low	28.6	Very low	127 Å²	127	140.2 Å²	140.2	63%	0.626	73%	0.732	S	S	*	*			trans	105.8	67.3	167.1	-148.9	67.6	54.5	0	0	117.3	E486	M461-E486 WeakPolarHBondContact CE-OE1 3.27Å; M461-E486 WeakPolarHBondContact CE-OE2 3.4Å
462	K	29.5	Very low	28.5	Very low	203 Å²	203	142.3 Å²	142.3	88%	0.883	75%	0.747	S	S	*	*			trans	-148.1	80.4	156.8	-85.2	-155.7	177.2	-173.2	0	114.5
463	Q	27	Very low	28.6	Very low	182 Å²	182	144.5 Å²	144.5	85%	0.85	75%	0.748	S	S	*	*			trans	-155.2	155.2	141.1	-138.7	178	-78.9	0	0	113.8
464	N	24.8	Very low	28.7	Very low	143 Å²	143	148 Å²	148	77%	0.765	76%	0.762	S	S	*	*			trans	106.4	80.8	161.3	-58.9	-15.6	0	0	0	117.1
465	Q	28.1	Very low	29	Very low	194 Å²	194	147 Å²	147	91%	0.907	76%	0.758	S	S	*	*			trans	-149.1	77.9	147.3	-169.3	175.5	46.1	0	0	110.8
466	E	29.4	Very low	28.8	Very low	169 Å²	169	150 Å²	150	79%	0.79	78%	0.775	S	S	*	*			trans	-166.9	141.1	133.9	-125.3	-161.4	101.2	0	0	115.8
467	N	25.6	Very low	29.2	Very low	132 Å²	132	150.7 Å²	150.7	71%	0.706	78%	0.776	S	S	*	*			trans	67.7	166.8	143.3	-122.5	-43.4	0	0	0	122.8
468	V	35.2	Very low	29.6	Very low	121 Å²	121	151 Å²	151	73%	0.733	78%	0.778	S	S	*	*			trans	-129.4	136.9	-156.6	173.9	0	0	0	0	111.4
469	K	28.1	Very low	30.8	Very low	212 Å²	212	151.5 Å²	151.5	92%	0.922	78%	0.778	S	S	*	*			trans	-168.6	154.8	141.7	-106.9	157.3	-173.2	177.9	0	111.6
470	A	31.6	Very low	30.9	Very low	94 Å²	94	152 Å²	152	78%	0.777	78%	0.779	S	S	*	*			trans	-97.9	163.4	-178.6	0	0	0	0	0	112.3
471	T	27.8	Very low	31.1	Very low	153 Å²	153	152.4 Å²	152.4	94%	0.939	78%	0.781	S	S	*	*			trans	-169.1	172.1	133.8	-65.6	0	0	0	0	107.8
472	D	27.9	Very low	31.7	Very low	139 Å²	139	157.8 Å²	157.8	74%	0.743	79%	0.794	S	S	*	*			trans	-103	-178.7	-156.8	-151.9	-15.3	0	0	0	115.7
473	H	30.1	Very low	31.7	Very low	158 Å²	158	152.4 Å²	152.4	73%	0.731	79%	0.787	S	S	*	*			trans	105.3	108	158.1	-73.2	-69.6	0	0	0	122.9
474	E	30.4	Very low	32.2	Very low	138 Å²	138	149.8 Å²	149.8	65%	0.645	79%	0.789	S	S	*	*			trans	43.9	136.7	133.3	-86.6	-150.8	126.7	0	0	126.3
475	R	31.4	Very low	32.8	Very low	198 Å²	198	148.5 Å²	148.5	75%	0.747	79%	0.787	S	S	*	*			trans	76.7	104.8	141	-75.7	-172.4	-158	172.4	23.3	123.7
476	D	32.8	Very low	33.9	Very low	130 Å²	130	146.4 Å²	146.4	70%	0.695	78%	0.777	S	S	*	*				85.9	152.4	111	-163.5	30.2	0	0	0	120.1
477	K	34.3	Very low	35.2	Very low	176 Å²	176	145.7 Å²	145.7	77%	0.765	77%	0.774	S	S	*	*			trans	79.3	92.9	167.6	-48.1	-172.7	-175.4	171.6	0	119.2
478	T	34.5	Very low	37.5	Very low	135 Å²	135	144.5 Å²	144.5	83%	0.828	77%	0.767	S	S	*	*			trans	-51.9	157.5	141.7	38.9	0	0	0	0	112.1
479	P	49.8	Very low	39.9	Very low	116 Å²	116	141.1 Å²	141.1	75%	0.753	75%	0.747	S	S	*	*			cis	-147	157.8	41.1	38.9	-17.6	0	0	0	120.4
480	V	37.7	Very low	42.9	Very low	127 Å²	127	135 Å²	135	77%	0.77	72%	0.724	S	S	*	*			trans	55.9	106.2	147.1	179.6	0	0	0	0	118.9
481	N	28.7	Very low	45.6	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	69%	0.69	S	S	*	*				-163.4	174.5	101.2	-127.2	-51.2	0	0	0	114
482	R	42.1	Very low	48.6	Very low	241 Å²	241	128.1 Å²	128.1	91%	0.909	66%	0.664	S	S	*	*			trans	-89.3	128.9	-171.3	-61	172.9	177	162.8	-2.3	114.1
483	A	29.2	Very low	51.6	Low	89 Å²	89	127 Å²	127	74%	0.736	66%	0.656	S	S	*	*			trans	-157.4	132.4	150.3	0	0	0	0	0	111.5	T485	A483-T485 PolarHBondContact O-N 3.2Å; A483-T485 VanDerWaalsContact O-N 3.15Å
484	S	37.2	Very low	54.4	Low	127 Å²	127	125 Å²	125	89%	0.888	65%	0.646	S	S	*	*			trans	23	71.1	155	-49.4	0	0	0	0	119.3	E486	S484-E486 PolarHBondContact O-N 2.91Å
485	T	36.8	Very low	57.4	Low	117 Å²	117	118.6 Å²	118.6	72%	0.718	62%	0.616	S	S	*	*			trans	-73.3	118.7	151.8	43.9	0	0	0	0	108.7	A483 E487	A483-T485 PolarHBondContact O-N 3.2Å; A483-T485 VanDerWaalsContact O-N 3.15Å; T485-E487 PolarHBondContact O-N 3.34Å
486	E	51.4	Low	60.3	Low	149 Å²	149	112.2 Å²	112.2	70%	0.696	60%	0.601	S	S	*	*			trans	-72.5	84.9	162.4	-169.1	162.7	-133.3	0	0	107.5	M461 S484 L488	M461-E486 WeakPolarHBondContact CE-OE1 3.27Å; M461-E486 WeakPolarHBondContact CE-OE2 3.4Å; S484-E486 PolarHBondContact O-N 2.91Å; E486-L488 PolarHBondContact O-N 3.02Å
487	E	57.3	Low	63	Low	155 Å²	155	110.9 Å²	110.9	72%	0.724	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-68	125.9	-164	-168	171.3	-168.7	0	0	111.2	T485 P489	T485-E487 PolarHBondContact O-N 3.34Å; E487-P489 WeakPolarHBondContact O-CD 3.44Å; E487-P489 VanDerWaalsContact O-N 3.17Å
488	L	73	Confident	65.8	Low	107 Å²	107	103 Å²	103	56%	0.56	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-54.7	121.1	176.8	-178.8	70.9	0	0	0	108.5	E486 D490 F492 I493	E486-L488 PolarHBondContact O-N 3.02Å; L488-D490 PolarHBondContact O-N 2.72Å; L488-F492 HydrophobicContact CD1-CB 4.29Å; L488-F492 HydrophobicContact CD1-CD2 4.24Å; L488-F492 HydrophobicContact CD1-CG 4.45Å; L488-F492 HydrophobicContact CD2-CB 4.22Å; L488-F492 HydrophobicContact CG-CB 4.05Å; L488-I493 HydrophobicContact CD2-CG1 4.18Å
489	P	86.3	Confident	68.4	Low	49 Å²	49	101.3 Å²	101.3	32%	0.318	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-54	137.9	-168.9	-28.9	32.4	0	0	0	113.5	E487 Y491 F492	E487-P489 WeakPolarHBondContact O-CD 3.44Å; E487-P489 VanDerWaalsContact O-N 3.17Å; P489-Y491 HydrophobicContact CB-CD1 3.93Å; P489-Y491 HydrophobicContact CB-CE1 3.38Å; P489-Y491 HydrophobicContact CB-CE2 4.35Å; P489-Y491 HydrophobicContact CG-CE1 4.37Å; P489-Y491 PolarHBondContact O-N 3.28Å; P489-F492 HydrophobicContact CB-CD2 3.9Å; P489-F492 HydrophobicContact CB-CE2 4.34Å; P489-F492 HydrophobicContact CG-CD2 3.99Å; P489-F492 HydrophobicContact CG-CE2 4.15Å; P489-F492 WeakPolarHBondContact O-CB 3.46Å; P489-F492 PolarHBondContact O-N 3.34Å
490	D	89.9	Confident	70.5	Confident	84 Å²	84	99 Å²	99	45%	0.449	54%	0.538	S	S	.	.	H	α-helix	trans	-47.8	-36.1	-172.8	71.9	-40.3	0	0	0	114.2	L488 F492 I493 K494 Y579	L488-D490 PolarHBondContact O-N 2.72Å; D490-F492 PolarHBondContact O-N 3.24Å; D490-I493 PolarHBondContact O-N 3.36Å; D490-I493 VanDerWaalsContact O-N 3.15Å; D490-K494 PolarHBondContact O-N 3.15Å; D490-Y579 VanDerWaalsContact OD1-CE2 3.22Å; D490-Y579 WeakPolarHBondContact OD1-CE2 3.48Å; D490-Y579 PolarHBondContact OD1-OH 2.81Å; D490-Y579 PolarHBondContact OD2-OH 3.12Å
491	Y	90.2	Very high	72.9	Confident	14 Å²	14	98 Å²	98	6%	0.055	53%	0.528	C	S	.	.	H	α-helix	trans	-71.3	-22.5	177.7	60.3	-94.9	0	0	0	114.7	P489 I493 Y495 Y579 K582 K583 H586	P489-Y491 HydrophobicContact CB-CD1 3.93Å; P489-Y491 HydrophobicContact CB-CE1 3.38Å; P489-Y491 HydrophobicContact CB-CE2 4.35Å; P489-Y491 HydrophobicContact CG-CE1 4.37Å; P489-Y491 PolarHBondContact O-N 3.28Å; Y491-I493 VanDerWaalsContact C-N 3.32Å; Y491-Y495 WeakPolarHBondContact O-CB 3.16Å; Y491-Y495 VanDerWaalsContact O-CD2 3.32Å; Y491-Y495 WeakPolarHBondContact O-CD2 3.42Å; Y491-Y495 PolarHBondContact O-N 3.42Å; Y491-Y579 AromaticContact CD1-CE2 3.83Å; Y491-Y579 HydrophobicContact CD1-CE2 3.83Å; Y491-Y579 HydrophobicContact CE1-CD2 4.33Å; Y491-Y579 HydrophobicContact CE1-CE2 4.04Å; Y491-K582 WeakPolarHBondContact OH-CB 3.23Å; Y491-K583 HydrophobicContact CD1-CB 3.82Å; Y491-K583 HydrophobicContact CD1-CG 4.31Å; Y491-K583 HydrophobicContact CD2-CB 4.38Å; Y491-K583 HydrophobicContact CE1-CB 4.33Å; Y491-K583 HydrophobicContact CG-CB 3.86Å; Y491-K583 HydrophobicContact CG-CG 4.04Å; Y491-H586 HydrophobicContact CD2-CB 3.95Å; Y491-H586 AromaticContact CD2-CD2 3.79Å; Y491-H586 HydrophobicContact CE2-CB 4.09Å; Y491-H586 PolarHBondContact O-CD2 3.44Å
492	F	89.6	Confident	75.9	Confident	88 Å²	88	98.6 Å²	98.6	39%	0.386	53%	0.526	S	S	.	.	H	α-helix	trans	-73.7	-27.1	168.5	-71.4	-69.1	0	0	0	112	L488 P489 D490 H586	L488-F492 HydrophobicContact CD1-CB 4.29Å; L488-F492 HydrophobicContact CD1-CD2 4.24Å; L488-F492 HydrophobicContact CD1-CG 4.45Å; L488-F492 HydrophobicContact CD2-CB 4.22Å; L488-F492 HydrophobicContact CG-CB 4.05Å; P489-F492 HydrophobicContact CB-CD2 3.9Å; P489-F492 HydrophobicContact CB-CE2 4.34Å; P489-F492 HydrophobicContact CG-CD2 3.99Å; P489-F492 HydrophobicContact CG-CE2 4.15Å; P489-F492 WeakPolarHBondContact O-CB 3.46Å; P489-F492 PolarHBondContact O-N 3.34Å; D490-F492 PolarHBondContact O-N 3.24Å; F492-H586 AromaticContact CD1-CE1 3.43Å; F492-H586 VanDerWaalsContact CD1-CE1 3.43Å; F492-H586 WeakPolarHBondContact CD1-CE1 3.34Å; F492-H586 AromaticContact CD1-ND1 3.72Å; F492-H586 AromaticContact CD1-NE2 3.63Å; F492-H586 AromaticContact CE1-CE1 3.63Å; F492-H586 AromaticContact CE1-CG 3.89Å; F492-H586 AromaticContact CE1-ND1 3.43Å; F492-H586 WeakPolarHBondContact CE1-ND1 3.31Å
493	I	90.1	Very high	78.3	Confident	115 Å²	115	88.6 Å²	88.6	59%	0.59	49%	0.489	S	S	*	.	H	α-helix	trans	-82.2	-42.3	177.1	-53.4	175.7	0	0	0	110.3	L488 D490 Y491	L488-I493 HydrophobicContact CD2-CG1 4.18Å; D490-I493 PolarHBondContact O-N 3.36Å; D490-I493 VanDerWaalsContact O-N 3.15Å; Y491-I493 VanDerWaalsContact C-N 3.32Å
494	K	90.8	Very high	81.3	Confident	117 Å²	117	86.7 Å²	86.7	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-75	-37.6	179	-176.2	-178.7	169.7	-160.1	0	113.4	D490 Y507 D510	D490-K494 PolarHBondContact O-N 3.15Å; K494-Y507 PolarHBondContact O-OH 3.16Å; K494-D510 IonicContact NZ-OD2 2.69Å; K494-D510 PolarHBondContact NZ-OD2 2.74Å
495	Y	92	Very high	84	Confident	4 Å²	4	84.6 Å²	84.6	2%	0.016	44%	0.439	C	S	.	.	S	Bend	trans	-112.2	100.9	-176.8	-52.7	-90.7	0	0	0	110	Y491 Y507 D510 H586 I587 L590	Y491-Y495 WeakPolarHBondContact O-CB 3.16Å; Y491-Y495 VanDerWaalsContact O-CD2 3.32Å; Y491-Y495 WeakPolarHBondContact O-CD2 3.42Å; Y491-Y495 PolarHBondContact O-N 3.42Å; Y495-Y507 AromaticContact CD1-CD1 3.66Å; Y495-Y507 HydrophobicContact CD1-CD1 3.66Å; Y495-Y507 AromaticContact CD1-CD2 3.98Å; Y495-Y507 HydrophobicContact CD1-CD2 3.98Å; Y495-Y507 AromaticContact CD1-CE1 3.65Å; Y495-Y507 HydrophobicContact CD1-CE1 3.65Å; Y495-Y507 AromaticContact CD1-CE2 3.99Å; Y495-Y507 HydrophobicContact CD1-CE2 3.99Å; Y495-Y507 AromaticContact CD1-CG 3.84Å; Y495-Y507 HydrophobicContact CD1-CG 3.84Å; Y495-Y507 AromaticContact CD1-CZ 3.83Å; Y495-Y507 HydrophobicContact CE1-CD1 4.05Å; Y495-Y507 HydrophobicContact CE1-CE1 4.26Å; Y495-Y507 HydrophobicContact CE1-CG 4.42Å; Y495-Y507 HydrophobicContact CG-CE2 4.47Å; Y495-D510 HydrophobicContact CE1-CB 4.12Å; Y495-D510 VanDerWaalsContact CE1-OD2 3.32Å; Y495-D510 WeakPolarHBondContact CE1-OD2 3.46Å; Y495-D510 VanDerWaalsContact CZ-OD2 3.32Å; Y495-D510 PolarHBondContact OH-OD2 2.92Å; Y495-H586 PolarHBondContact O-NE2 2.84Å; Y495-I587 HydrophobicContact CD1-CD1 4.03Å; Y495-I587 HydrophobicContact CD1-CG1 3.76Å; Y495-I587 HydrophobicContact CD2-CD1 3.96Å; Y495-I587 HydrophobicContact CD2-CG1 3.89Å; Y495-I587 HydrophobicContact CE1-CD1 3.76Å; Y495-I587 HydrophobicContact CE1-CG1 4.04Å; Y495-I587 HydrophobicContact CE2-CD1 3.71Å; Y495-I587 HydrophobicContact CE2-CG1 4.17Å; Y495-I587 HydrophobicContact CG-CD1 4.12Å; Y495-I587 HydrophobicContact CG-CG1 3.68Å; Y495-L590 WeakPolarHBondContact O-CD1 3.32Å
496	S	91.8	Very high	86.7	Confident	64 Å²	64	84 Å²	84	45%	0.448	43%	0.431	S	S	.	.			trans	-99.4	179.2	179.3	59.9	0	0	0	0	111.5	V498 Y507 L590	S496-V498 PolarHBondContact O-N 2.93Å; S496-Y507 PolarHBondContact N-OH 3.21Å; S496-Y507 WeakPolarHBondContact O-CE2 3.31Å; S496-L590 WeakPolarHBondContact O-CD1 3.43Å
497	T	90.8	Very high	88.8	Confident	102 Å²	102	77.6 Å²	77.6	63%	0.626	40%	0.401	S	S	*	.			trans	-52.6	125.7	174.7	-49.6	0	0	0	0	110.8	Q503	T497-Q503 PolarHBondContact O-NE2 2.84Å
498	V	92.5	Very high	90.4	Very high	10 Å²	10	73.4 Å²	73.4	6%	0.061	38%	0.381	C	S	.	.			trans	-74.8	130.4	-179.4	175.2	0	0	0	0	109.5	S496 Q503 R504 Y507 L590 Y594	S496-V498 PolarHBondContact O-N 2.93Å; V498-Q503 HydrophobicContact CG1-CB 4.32Å; V498-Q503 HydrophobicContact CG1-CG 4.37Å; V498-Q503 HydrophobicContact CG2-CG 4.39Å; V498-R504 HydrophobicContact CG1-CB 3.7Å; V498-R504 HydrophobicContact CG1-CG 4.46Å; V498-Y507 HydrophobicContact CG2-CD2 3.39Å; V498-Y507 HydrophobicContact CG2-CE2 3.53Å; V498-Y507 HydrophobicContact CG2-CG 4.38Å; V498-L590 HydrophobicContact CG2-CB 4.12Å; V498-Y594 HydrophobicContact CB-CD2 4.19Å; V498-Y594 HydrophobicContact CB-CG 4.2Å; V498-Y594 HydrophobicContact CG1-CD1 4.17Å; V498-Y594 HydrophobicContact CG1-CD2 3.65Å; V498-Y594 HydrophobicContact CG1-CE2 4.21Å; V498-Y594 HydrophobicContact CG1-CG 3.61Å; V498-Y594 WeakPolarHBondContact O-CD2 3.4Å
499	T	90.1	Very high	91.4	Very high	100 Å²	100	72 Å²	72	61%	0.613	37%	0.374	S	S	*	.			trans	-121.2	-22.2	-177.4	55.6	0	0	0	0	113.4	Q503	T499-Q503 PolarHBondContact OG1-OE1 2.93Å
500	T	92.2	Very high	91.7	Very high	67 Å²	67	71.8 Å²	71.8	41%	0.411	37%	0.37	S	S	.	.	S	Bend	trans	-126.5	154.8	179.8	72.3	0	0	0	0	112.5	E502 Q503 R504	T500-E502 PolarHBondContact O-N 3.25Å; T500-Q503 PolarHBondContact O-N 3.49Å; T500-Q503 WeakPolarHBondContact OG1-CB 3.38Å; T500-Q503 PolarHBondContact OG1-N 3.08Å; T500-Q503 VanDerWaalsContact OG1-N 3.15Å; T500-R504 PolarHBondContact O-N 3.4Å
501	L	89.9	Confident	91.9	Very high	106 Å²	106	69.4 Å²	69.4	56%	0.555	36%	0.356	S	S	*	.	H	α-helix	trans	-63.9	-31	177.6	-174.4	63.5	0	0	0	112.1	R504 Q505 Y594	L501-R504 WeakPolarHBondContact O-CB 3.21Å; L501-R504 PolarHBondContact O-N 2.85Å; L501-Q505 WeakPolarHBondContact O-CB 3.12Å; L501-Q505 PolarHBondContact O-N 2.95Å; L501-Y594 HydrophobicContact CD1-CE1 4.36Å; L501-Y594 PolarHBondContact N-OH 3.35Å; L501-Y594 VanDerWaalsContact N-OH 3.12Å
502	E	91.3	Very high	91.9	Very high	165 Å²	165	70.7 Å²	70.7	77%	0.771	37%	0.367	S	S	*	.	H	α-helix	trans	-69	-44	175.2	-62	-177.9	167.8	0	0	111.6	T500 R504 Q505 L506	T500-E502 PolarHBondContact O-N 3.25Å; E502-R504 VanDerWaalsContact C-N 3.31Å; E502-R504 PolarHBondContact O-N 3.48Å; E502-Q505 PolarHBondContact O-N 2.63Å; E502-L506 WeakPolarHBondContact O-CB 3.37Å; E502-L506 PolarHBondContact O-N 3.21Å
503	Q	91.9	Very high	92.1	Very high	32 Å²	32	70.3 Å²	70.3	15%	0.15	38%	0.38	C	S	.	.	H	α-helix	trans	-61.6	-41	172.8	-173.6	-171.6	4.5	0	0	110.8	T497 V498 T499 T500 Q505 L506 Y507	T497-Q503 PolarHBondContact O-NE2 2.84Å; V498-Q503 HydrophobicContact CG1-CB 4.32Å; V498-Q503 HydrophobicContact CG1-CG 4.37Å; V498-Q503 HydrophobicContact CG2-CG 4.39Å; T499-Q503 PolarHBondContact OG1-OE1 2.93Å; T500-Q503 PolarHBondContact O-N 3.49Å; T500-Q503 WeakPolarHBondContact OG1-CB 3.38Å; T500-Q503 PolarHBondContact OG1-N 3.08Å; T500-Q503 VanDerWaalsContact OG1-N 3.15Å; Q503-Q505 PolarHBondContact O-N 3.02Å; Q503-L506 PolarHBondContact O-N 3.47Å; Q503-Y507 HydrophobicContact CG-CD1 4.37Å; Q503-Y507 HydrophobicContact CG-CE1 3.94Å; Q503-Y507 HydrophobicContact CG-CE2 4.19Å; Q503-Y507 PolarHBondContact NE2-OH 3.25Å; Q503-Y507 VanDerWaalsContact NE2-OH 3.08Å; Q503-Y507 WeakPolarHBondContact O-CB 3.42Å; Q503-Y507 WeakPolarHBondContact O-CD1 3.4Å; Q503-Y507 PolarHBondContact O-N 3.04Å
504	R	93.3	Very high	92.1	Very high	49 Å²	49	66.7 Å²	66.7	19%	0.185	36%	0.36	C	S	.	.	H	α-helix	trans	-59.4	-43.8	174.5	-173	-96.8	-175.6	-139.4	-3.6	112.1	V498 T500 L501 E502 H508 I591 Y594 D595	V498-R504 HydrophobicContact CG1-CB 3.7Å; V498-R504 HydrophobicContact CG1-CG 4.46Å; T500-R504 PolarHBondContact O-N 3.4Å; L501-R504 WeakPolarHBondContact O-CB 3.21Å; L501-R504 PolarHBondContact O-N 2.85Å; E502-R504 VanDerWaalsContact C-N 3.31Å; E502-R504 PolarHBondContact O-N 3.48Å; R504-H508 WeakPolarHBondContact O-CB 3.42Å; R504-H508 PolarHBondContact O-N 2.86Å; R504-I591 HydrophobicContact CG-CG2 4.21Å; R504-Y594 HydrophobicContact CB-CD1 3.89Å; R504-Y594 HydrophobicContact CB-CE1 4.01Å; R504-Y594 HydrophobicContact CG-CD1 3.71Å; R504-Y594 HydrophobicContact CG-CE1 4.19Å; R504-D595 IonicContact CZ-OD1 3.62Å; R504-D595 IonicContact CZ-OD2 2.68Å; R504-D595 IonicContact NE-OD1 3.63Å; R504-D595 PolarHBondContact NE-OD1 2.94Å; R504-D595 IonicContact NE-OD2 2.83Å; R504-D595 IonicContact NH2-OD1 3.49Å; R504-D595 PolarHBondContact NH2-OD1 3.31Å; R504-D595 IonicContact NH2-OD2 2.74Å; R504-D595 PolarHBondContact NH2-OD2 3.45Å
505	Q	92	Very high	92.2	Very high	83 Å²	83	65.7 Å²	65.7	39%	0.388	35%	0.354	S	S	.	.	H	α-helix	trans	-70.1	-43.8	179.3	-173.3	56	36.8	0	0	111.9	L501 E502 Q503 Y507 H508 D509	L501-Q505 WeakPolarHBondContact O-CB 3.12Å; L501-Q505 PolarHBondContact O-N 2.95Å; E502-Q505 PolarHBondContact O-N 2.63Å; Q503-Q505 PolarHBondContact O-N 3.02Å; Q505-Y507 VanDerWaalsContact C-N 3.29Å; Q505-Y507 PolarHBondContact O-N 2.75Å; Q505-H508 WeakPolarHBondContact O-CB 3.24Å; Q505-H508 PolarHBondContact O-N 3.42Å; Q505-H508 VanDerWaalsContact O-N 3.16Å; Q505-D509 PolarHBondContact NE2-OD1 3.27Å; Q505-D509 PolarHBondContact NE2-OD2 3.37Å; Q505-D509 PolarHBondContact O-N 3.02Å
506	L	94.6	Very high	92.1	Very high	103 Å²	103	69.8 Å²	69.8	54%	0.539	38%	0.376	S	S	.	.	H	α-helix	trans	-57.2	-43.3	174.5	179.7	63.2	0	0	0	111.7	E502 Q503 D509 D510	E502-L506 WeakPolarHBondContact O-CB 3.37Å; E502-L506 PolarHBondContact O-N 3.21Å; Q503-L506 PolarHBondContact O-N 3.47Å; L506-D509 PolarHBondContact O-N 2.55Å; L506-D510 WeakPolarHBondContact O-CB 3.26Å; L506-D510 PolarHBondContact O-N 3.05Å
507	Y	94.7	Very high	92.1	Very high	16 Å²	16	70.3 Å²	70.3	6%	0.063	37%	0.372	C	S	.	.	H	α-helix	trans	-68.9	-34.6	178.6	-76.1	15.4	0	0	0	112.3	K494 Y495 S496 V498 Q503 Q505 F511 I587 L590	K494-Y507 PolarHBondContact O-OH 3.16Å; Y495-Y507 AromaticContact CD1-CD1 3.66Å; Y495-Y507 HydrophobicContact CD1-CD1 3.66Å; Y495-Y507 AromaticContact CD1-CD2 3.98Å; Y495-Y507 HydrophobicContact CD1-CD2 3.98Å; Y495-Y507 AromaticContact CD1-CE1 3.65Å; Y495-Y507 HydrophobicContact CD1-CE1 3.65Å; Y495-Y507 AromaticContact CD1-CE2 3.99Å; Y495-Y507 HydrophobicContact CD1-CE2 3.99Å; Y495-Y507 AromaticContact CD1-CG 3.84Å; Y495-Y507 HydrophobicContact CD1-CG 3.84Å; Y495-Y507 AromaticContact CD1-CZ 3.83Å; Y495-Y507 HydrophobicContact CE1-CD1 4.05Å; Y495-Y507 HydrophobicContact CE1-CE1 4.26Å; Y495-Y507 HydrophobicContact CE1-CG 4.42Å; Y495-Y507 HydrophobicContact CG-CE2 4.47Å; S496-Y507 PolarHBondContact N-OH 3.21Å; S496-Y507 WeakPolarHBondContact O-CE2 3.31Å; V498-Y507 HydrophobicContact CG2-CD2 3.39Å; V498-Y507 HydrophobicContact CG2-CE2 3.53Å; V498-Y507 HydrophobicContact CG2-CG 4.38Å; Q503-Y507 HydrophobicContact CG-CD1 4.37Å; Q503-Y507 HydrophobicContact CG-CE1 3.94Å; Q503-Y507 HydrophobicContact CG-CE2 4.19Å; Q503-Y507 PolarHBondContact NE2-OH 3.25Å; Q503-Y507 VanDerWaalsContact NE2-OH 3.08Å; Q503-Y507 WeakPolarHBondContact O-CB 3.42Å; Q503-Y507 WeakPolarHBondContact O-CD1 3.4Å; Q503-Y507 PolarHBondContact O-N 3.04Å; Q505-Y507 VanDerWaalsContact C-N 3.29Å; Q505-Y507 PolarHBondContact O-N 2.75Å; Y507-F511 WeakPolarHBondContact O-CB 3.41Å; Y507-F511 PolarHBondContact O-N 3.33Å; Y507-I587 VanDerWaalsContact O-CG2 3.31Å; Y507-I587 WeakPolarHBondContact O-CG2 3.48Å; Y507-L590 HydrophobicContact CD2-CD1 4.45Å; Y507-L590 HydrophobicContact CE2-CD1 4.17Å
508	H	92.5	Very high	92.2	Very high	66 Å²	66	67 Å²	67	31%	0.306	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-41.7	172	170.4	-82.1	0	0	0	111.8	R504 Q505 F511 C512 I591	R504-H508 WeakPolarHBondContact O-CB 3.42Å; R504-H508 PolarHBondContact O-N 2.86Å; Q505-H508 WeakPolarHBondContact O-CB 3.24Å; Q505-H508 PolarHBondContact O-N 3.42Å; Q505-H508 VanDerWaalsContact O-N 3.16Å; H508-F511 WeakPolarHBondContact O-CB 3.22Å; H508-F511 PolarHBondContact O-N 3.04Å; H508-C512 VanDerWaalsContact CE1-SG 3.58Å; H508-C512 PolarHBondContact O-N 3.46Å; H508-C512 PolarHBondContact O-SG 2.99Å; H508-I591 HydrophobicContact CB-CD1 4.16Å
509	D	92.9	Very high	92.2	Very high	78 Å²	78	71.8 Å²	71.8	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-77.3	-36.6	-176.1	-63.6	-21.4	0	0	0	111.8	Q505 L506 F511 C512 A513	Q505-D509 PolarHBondContact NE2-OD1 3.27Å; Q505-D509 PolarHBondContact NE2-OD2 3.37Å; Q505-D509 PolarHBondContact O-N 3.02Å; L506-D509 PolarHBondContact O-N 2.55Å; D509-F511 VanDerWaalsContact C-N 3.34Å; D509-C512 PolarHBondContact O-N 3.29Å; D509-A513 PolarHBondContact O-N 3.01Å
510	D	92.8	Very high	92.3	Very high	44 Å²	44	71.7 Å²	71.7	24%	0.235	36%	0.364	C	S	.	.	H	α-helix	trans	-58.2	-43.2	166	-101.4	15.3	0	0	0	111.7	K494 Y495 L506 A513 E514	K494-D510 IonicContact NZ-OD2 2.69Å; K494-D510 PolarHBondContact NZ-OD2 2.74Å; Y495-D510 HydrophobicContact CE1-CB 4.12Å; Y495-D510 VanDerWaalsContact CE1-OD2 3.32Å; Y495-D510 WeakPolarHBondContact CE1-OD2 3.46Å; Y495-D510 VanDerWaalsContact CZ-OD2 3.32Å; Y495-D510 PolarHBondContact OH-OD2 2.92Å; L506-D510 WeakPolarHBondContact O-CB 3.26Å; L506-D510 PolarHBondContact O-N 3.05Å; D510-A513 PolarHBondContact O-N 3.45Å; D510-E514 PolarHBondContact O-N 3.19Å
511	F	94.1	Very high	92.2	Very high	34 Å²	34	69.1 Å²	69.1	15%	0.149	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-47	174.2	174.2	-78.1	0	0	0	110.7	Y507 H508 D509 A513 E514 Y515 L584 I587 K588	Y507-F511 WeakPolarHBondContact O-CB 3.41Å; Y507-F511 PolarHBondContact O-N 3.33Å; H508-F511 WeakPolarHBondContact O-CB 3.22Å; H508-F511 PolarHBondContact O-N 3.04Å; D509-F511 VanDerWaalsContact C-N 3.34Å; F511-A513 VanDerWaalsContact C-N 3.33Å; F511-A513 PolarHBondContact O-N 2.61Å; F511-E514 PolarHBondContact O-N 3.42Å; F511-Y515 HydrophobicContact CE1-CD1 4.47Å; F511-Y515 AromaticContact CE1-CD2 3.88Å; F511-Y515 HydrophobicContact CE1-CD2 3.88Å; F511-Y515 HydrophobicContact CE1-CE2 4.49Å; F511-Y515 AromaticContact CE1-CG 3.88Å; F511-Y515 HydrophobicContact CE1-CG 3.88Å; F511-Y515 AromaticContact CZ-CD2 3.8Å; F511-Y515 HydrophobicContact CZ-CD2 3.8Å; F511-Y515 HydrophobicContact CZ-CE2 4.23Å; F511-Y515 HydrophobicContact CZ-CG 4.29Å; F511-Y515 WeakPolarHBondContact O-CB 3.42Å; F511-Y515 PolarHBondContact O-N 3Å; F511-L584 HydrophobicContact CB-CD2 4.23Å; F511-L584 HydrophobicContact CD2-CB 3.94Å; F511-L584 HydrophobicContact CD2-CD2 3.56Å; F511-L584 HydrophobicContact CD2-CG 4.36Å; F511-L584 HydrophobicContact CE2-CB 3.71Å; F511-L584 HydrophobicContact CE2-CD2 4.04Å; F511-L584 HydrophobicContact CE2-CG 4.43Å; F511-L584 WeakPolarHBondContact CE2-O 3.38Å; F511-L584 HydrophobicContact CG-CD2 3.92Å; F511-I587 HydrophobicContact CB-CG2 4.03Å; F511-K588 HydrophobicContact CD2-CB 4.33Å; F511-K588 HydrophobicContact CE2-CB 3.95Å; F511-K588 HydrophobicContact CE2-CD 4.44Å
512	C	90.8	Very high	92.3	Very high	42 Å²	42	68 Å²	68	28%	0.284	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-34.9	-178.3	-70.6	0	0	0	0	112.9	H508 D509	H508-C512 VanDerWaalsContact CE1-SG 3.58Å; H508-C512 PolarHBondContact O-N 3.46Å; H508-C512 PolarHBondContact O-SG 2.99Å; D509-C512 PolarHBondContact O-N 3.29Å
513	A	92.8	Very high	92.2	Very high	80 Å²	80	64.5 Å²	64.5	66%	0.661	33%	0.326	S	S	*	.	H	α-helix	trans	-63.7	-40.2	178.4	0	0	0	0	0	113.2	D509 D510 F511	D509-A513 PolarHBondContact O-N 3.01Å; D510-A513 PolarHBondContact O-N 3.45Å; F511-A513 VanDerWaalsContact C-N 3.33Å; F511-A513 PolarHBondContact O-N 2.61Å
514	E	91.1	Very high	91.9	Very high	38 Å²	38	66.6 Å²	66.6	18%	0.178	33%	0.332	C	S	.	.	H	α-helix	trans	-92.2	-16.8	179.3	-71.4	-172.3	152.1	0	0	114.1	D510 F511 D516 E517 Y518 R576 L580 K583 L584	D510-E514 PolarHBondContact O-N 3.19Å; F511-E514 PolarHBondContact O-N 3.42Å; E514-D516 PolarHBondContact O-N 3.21Å; E514-E517 WeakPolarHBondContact O-CB 3.31Å; E514-E517 PolarHBondContact O-N 3.48Å; E514-Y518 PolarHBondContact O-N 3.26Å; E514-R576 IonicContact OE1-NH2 2.78Å; E514-L580 HydrophobicContact CB-CD2 4.02Å; E514-L580 HydrophobicContact CG-CD2 4.35Å; E514-K583 IonicContact OE1-NZ 3.37Å; E514-K583 PolarHBondContact OE1-NZ 2.71Å; E514-K583 VanDerWaalsContact OE2-CD 3.29Å; E514-K583 WeakPolarHBondContact OE2-CD 3.22Å; E514-K583 WeakPolarHBondContact OE2-CE 3.2Å; E514-K583 IonicContact OE2-NZ 2.75Å; E514-K583 PolarHBondContact OE2-NZ 3.45Å; E514-L584 HydrophobicContact CB-CD2 4.23Å
515	Y	92.1	Very high	91.7	Very high	96 Å²	96	65.1 Å²	65.1	38%	0.376	33%	0.328	S	S	.	.	H	α-helix	trans	-64.2	-34.7	-176.7	-177	-113.8	0	0	0	113.7	F511 Y518 R519 L584	F511-Y515 HydrophobicContact CE1-CD1 4.47Å; F511-Y515 AromaticContact CE1-CD2 3.88Å; F511-Y515 HydrophobicContact CE1-CD2 3.88Å; F511-Y515 HydrophobicContact CE1-CE2 4.49Å; F511-Y515 AromaticContact CE1-CG 3.88Å; F511-Y515 HydrophobicContact CE1-CG 3.88Å; F511-Y515 AromaticContact CZ-CD2 3.8Å; F511-Y515 HydrophobicContact CZ-CD2 3.8Å; F511-Y515 HydrophobicContact CZ-CE2 4.23Å; F511-Y515 HydrophobicContact CZ-CG 4.29Å; F511-Y515 WeakPolarHBondContact O-CB 3.42Å; F511-Y515 PolarHBondContact O-N 3Å; Y515-Y518 AromaticContact CD2-CD1 3.98Å; Y515-Y518 HydrophobicContact CD2-CD1 3.98Å; Y515-Y518 AromaticContact CE2-CD1 4Å; Y515-Y518 HydrophobicContact CE2-CD1 4Å; Y515-Y518 HydrophobicContact CE2-CE1 4.36Å; Y515-Y518 PolarHBondContact O-N 3.05Å; Y515-R519 HydrophobicContact CD1-CG 4.41Å; Y515-R519 HydrophobicContact CE1-CG 4.04Å; Y515-R519 HydrophobicContact CE2-CG 4.17Å; Y515-R519 WeakPolarHBondContact O-CG 3.47Å; Y515-R519 PolarHBondContact O-N 3.42Å; Y515-L584 HydrophobicContact CD2-CD1 4.36Å
516	D	89.6	Confident	91.4	Very high	91 Å²	91	62.6 Å²	62.6	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-69.2	-33.6	174.9	-89.8	-14.9	0	0	0	112.3	E514 R519 V520	E514-D516 PolarHBondContact O-N 3.21Å; D516-R519 IonicContact OD1-NH1 3.83Å; D516-V520 WeakPolarHBondContact O-CG2 3.01Å; D516-V520 PolarHBondContact O-N 2.96Å
517	E	92.5	Very high	91	Very high	75 Å²	75	60.6 Å²	60.6	35%	0.35	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-50.5	170.5	-169.4	-160.6	150.7	0	0	110.1	E514 R519 V520 L521 R576 L580	E514-E517 WeakPolarHBondContact O-CB 3.31Å; E514-E517 PolarHBondContact O-N 3.48Å; E517-R519 VanDerWaalsContact C-N 3.3Å; E517-R519 PolarHBondContact O-N 3.16Å; E517-V520 PolarHBondContact O-N 2.85Å; E517-L521 HydrophobicContact CG-CD1 4.31Å; E517-L521 HydrophobicContact CG-CG 4.47Å; E517-L521 WeakPolarHBondContact O-CG 3.14Å; E517-L521 PolarHBondContact O-N 3.19Å; E517-R576 VanDerWaalsContact OE1-CG 3.25Å; E517-R576 WeakPolarHBondContact OE1-CG 3.48Å; E517-R576 IonicContact OE1-CZ 2.74Å; E517-R576 IonicContact OE1-NE 3.46Å; E517-R576 PolarHBondContact OE1-NE 2.8Å; E517-R576 IonicContact OE1-NH2 2.72Å; E517-R576 IonicContact OE2-CZ 3.16Å; E517-R576 IonicContact OE2-NE 2.8Å; E517-R576 PolarHBondContact OE2-NE 2.94Å; E517-R576 IonicContact OE2-NH2 2.61Å; E517-R576 PolarHBondContact OE2-NH2 3.32Å; E517-L580 HydrophobicContact CB-CD1 4.24Å; E517-L580 HydrophobicContact CG-CD1 4.11Å
518	Y	93.5	Very high	90.4	Very high	33 Å²	33	60.4 Å²	60.4	13%	0.129	32%	0.322	C	S	.	.	H	α-helix	trans	-53.6	-46.9	178.4	169	-114.2	0	0	0	111.9	E514 Y515 L521 H522 L580 H581 L584	E514-Y518 PolarHBondContact O-N 3.26Å; Y515-Y518 AromaticContact CD2-CD1 3.98Å; Y515-Y518 HydrophobicContact CD2-CD1 3.98Å; Y515-Y518 AromaticContact CE2-CD1 4Å; Y515-Y518 HydrophobicContact CE2-CD1 4Å; Y515-Y518 HydrophobicContact CE2-CE1 4.36Å; Y515-Y518 PolarHBondContact O-N 3.05Å; Y518-L521 PolarHBondContact O-N 3.43Å; Y518-H522 HydrophobicContact CE2-CB 4.19Å; Y518-H522 WeakPolarHBondContact O-CB 3.3Å; Y518-H522 PolarHBondContact O-N 3.01Å; Y518-L580 HydrophobicContact CD2-CB 3.98Å; Y518-L580 HydrophobicContact CG-CB 4.37Å; Y518-H581 HydrophobicContact CD2-CB 4.5Å; Y518-H581 HydrophobicContact CE2-CB 3.75Å; Y518-H581 AromaticContact CZ-ND1 3.7Å; Y518-H581 PolarHBondContact OH-ND1 2.85Å; Y518-L584 HydrophobicContact CD1-CD1 4.1Å; Y518-L584 HydrophobicContact CG-CD1 3.85Å
519	R	92.1	Very high	90.1	Very high	110 Å²	110	58.6 Å²	58.6	42%	0.415	32%	0.316	S	S	.	.	H	α-helix	trans	-61.3	-48	178.3	-77.8	-176.3	60	-137.9	-4.1	112.9	Y515 D516 E517 L521 H522 D523	Y515-R519 HydrophobicContact CD1-CG 4.41Å; Y515-R519 HydrophobicContact CE1-CG 4.04Å; Y515-R519 HydrophobicContact CE2-CG 4.17Å; Y515-R519 WeakPolarHBondContact O-CG 3.47Å; Y515-R519 PolarHBondContact O-N 3.42Å; D516-R519 IonicContact OD1-NH1 3.83Å; E517-R519 VanDerWaalsContact C-N 3.3Å; E517-R519 PolarHBondContact O-N 3.16Å; R519-L521 VanDerWaalsContact C-N 3.29Å; R519-L521 PolarHBondContact O-N 2.78Å; R519-H522 PolarHBondContact O-N 2.72Å; R519-D523 WeakPolarHBondContact O-CB 3.49Å; R519-D523 VanDerWaalsContact O-CG 3.27Å; R519-D523 PolarHBondContact O-N 2.95Å
520	V	91.3	Very high	89.8	Confident	97 Å²	97	60.2 Å²	60.2	59%	0.588	32%	0.321	S	S	*	.	H	α-helix	trans	-65.2	-33.8	-179.5	172.9	0	0	0	0	111.8	D516 E517 R524	D516-V520 WeakPolarHBondContact O-CG2 3.01Å; D516-V520 PolarHBondContact O-N 2.96Å; E517-V520 PolarHBondContact O-N 2.85Å; V520-R524 VanDerWaalsContact O-CB 3.27Å; V520-R524 WeakPolarHBondContact O-CB 3.33Å; V520-R524 PolarHBondContact O-N 2.99Å
521	L	91.4	Very high	89.3	Confident	14 Å²	14	59.6 Å²	59.6	7%	0.073	32%	0.317	C	S	.	.	H	α-helix	trans	-69.2	-49.5	171.1	-65.1	-175.4	0	0	0	111.7	E517 Y518 R519 R524 I525 E573 R576 C577 L580	E517-L521 HydrophobicContact CG-CD1 4.31Å; E517-L521 HydrophobicContact CG-CG 4.47Å; E517-L521 WeakPolarHBondContact O-CG 3.14Å; E517-L521 PolarHBondContact O-N 3.19Å; Y518-L521 PolarHBondContact O-N 3.43Å; R519-L521 VanDerWaalsContact C-N 3.29Å; R519-L521 PolarHBondContact O-N 2.78Å; L521-R524 VanDerWaalsContact CD2-NH2 3.29Å; L521-R524 PolarHBondContact O-N 3.48Å; L521-I525 HydrophobicContact CB-CD1 4.41Å; L521-I525 WeakPolarHBondContact O-CB 3.34Å; L521-I525 WeakPolarHBondContact O-CD1 3.39Å; L521-I525 VanDerWaalsContact O-CG1 3.28Å; L521-I525 WeakPolarHBondContact O-CG1 3.35Å; L521-I525 PolarHBondContact O-N 3Å; L521-E573 HydrophobicContact CD2-CB 4.47Å; L521-R576 HydrophobicContact CD1-CB 3.97Å; L521-R576 HydrophobicContact CD1-CG 3.57Å; L521-C577 HydrophobicContact CB-CB 4Å; L521-C577 HydrophobicContact CD1-CB 4.39Å; L521-L580 HydrophobicContact CD1-CD1 4.27Å
522	H	90.2	Very high	88.8	Confident	81 Å²	81	60.3 Å²	60.3	38%	0.375	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-51	-177.6	179.7	-91.1	0	0	0	112.2	Y518 R519 R524 I525 G526	Y518-H522 HydrophobicContact CE2-CB 4.19Å; Y518-H522 WeakPolarHBondContact O-CB 3.3Å; Y518-H522 PolarHBondContact O-N 3.01Å; R519-H522 PolarHBondContact O-N 2.72Å; H522-R524 VanDerWaalsContact C-N 3.25Å; H522-R524 PolarHBondContact O-N 2.8Å; H522-I525 PolarHBondContact O-N 2.71Å; H522-G526 PolarHBondContact O-N 2.86Å
523	D	89.3	Confident	88.6	Confident	93 Å²	93	62.2 Å²	62.2	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-61.9	-36.1	-179.4	-66.8	-10.9	0	0	0	111.3	R519 A527	R519-D523 WeakPolarHBondContact O-CB 3.49Å; R519-D523 VanDerWaalsContact O-CG 3.27Å; R519-D523 PolarHBondContact O-N 2.95Å; D523-A527 WeakPolarHBondContact O-CB 3.49Å; D523-A527 PolarHBondContact O-N 3.12Å
524	R	86.8	Confident	88.1	Confident	75 Å²	75	62.3 Å²	62.3	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-70.7	-44.2	176.4	178.3	162.7	61.1	134.5	-6.7	112.7	V520 L521 H522 G526 A527 I528 E573	V520-R524 VanDerWaalsContact O-CB 3.27Å; V520-R524 WeakPolarHBondContact O-CB 3.33Å; V520-R524 PolarHBondContact O-N 2.99Å; L521-R524 VanDerWaalsContact CD2-NH2 3.29Å; L521-R524 PolarHBondContact O-N 3.48Å; H522-R524 VanDerWaalsContact C-N 3.25Å; H522-R524 PolarHBondContact O-N 2.8Å; R524-G526 VanDerWaalsContact C-N 3.33Å; R524-A527 PolarHBondContact O-N 2.93Å; R524-I528 HydrophobicContact CG-CD1 4.25Å; R524-I528 VanDerWaalsContact O-CG1 3.3Å; R524-I528 WeakPolarHBondContact O-CG1 3.41Å; R524-I528 PolarHBondContact O-N 3.22Å; R524-I528 VanDerWaalsContact O-N 3.16Å; R524-E573 VanDerWaalsContact CZ-CD 3.4Å; R524-E573 IonicContact CZ-OE1 2.71Å; R524-E573 IonicContact CZ-OE2 2.8Å; R524-E573 IonicContact NH1-OE1 3.45Å; R524-E573 PolarHBondContact NH1-OE1 2.97Å; R524-E573 IonicContact NH1-OE2 2.8Å; R524-E573 PolarHBondContact NH1-OE2 2.77Å; R524-E573 IonicContact NH2-OE1 3.62Å; R524-E573 PolarHBondContact NH2-OE1 2.98Å; R524-E573 IonicContact NH2-OE2 3.15Å
525	I	88.4	Confident	87.6	Confident	19 Å²	19	60.8 Å²	60.8	10%	0.097	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-39.2	176.3	-68.9	158.8	0	0	0	110.2	L521 H522 I528 T529 Y570 K574 C577	L521-I525 HydrophobicContact CB-CD1 4.41Å; L521-I525 WeakPolarHBondContact O-CB 3.34Å; L521-I525 WeakPolarHBondContact O-CD1 3.39Å; L521-I525 VanDerWaalsContact O-CG1 3.28Å; L521-I525 WeakPolarHBondContact O-CG1 3.35Å; L521-I525 PolarHBondContact O-N 3Å; H522-I525 PolarHBondContact O-N 2.71Å; I525-I528 PolarHBondContact O-N 3.14Å; I525-T529 WeakPolarHBondContact O-CB 3.28Å; I525-T529 PolarHBondContact O-N 3.39Å; I525-T529 PolarHBondContact O-OG1 2.87Å; I525-Y570 HydrophobicContact CG1-CE2 4.18Å; I525-K574 HydrophobicContact CD1-CB 4.41Å; I525-C577 HydrophobicContact CD1-CB 3.39Å
526	G	85.2	Confident	87.1	Confident	30 Å²	30	57.3 Å²	57.3	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-60.5	-47.6	173.8	0	0	0	0	0	112.8	H522 R524 I528 T529 E530	H522-G526 PolarHBondContact O-N 2.86Å; R524-G526 VanDerWaalsContact C-N 3.33Å; G526-I528 PolarHBondContact O-N 3.3Å; G526-T529 VanDerWaalsContact O-CB 3.28Å; G526-T529 WeakPolarHBondContact O-CB 3.38Å; G526-T529 PolarHBondContact O-N 3.41Å; G526-E530 WeakPolarHBondContact O-CB 3.43Å; G526-E530 PolarHBondContact O-N 3.19Å
527	A	86.7	Confident	86.8	Confident	60 Å²	60	56 Å²	56	50%	0.496	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-36.1	177.6	0	0	0	0	0	113.4	D523 R524 M531	D523-A527 WeakPolarHBondContact O-CB 3.49Å; D523-A527 PolarHBondContact O-N 3.12Å; R524-A527 PolarHBondContact O-N 2.93Å; A527-M531 PolarHBondContact O-N 3.42Å
528	I	83.1	Confident	86.3	Confident	12 Å²	12	57.6 Å²	57.6	6%	0.062	31%	0.308	C	S	.	.	H	α-helix	trans	-67.7	-46.6	173.6	-67.3	167.9	0	0	0	110	R524 I525 G526 M531 F532 Y563 F567 Y570	R524-I528 HydrophobicContact CG-CD1 4.25Å; R524-I528 VanDerWaalsContact O-CG1 3.3Å; R524-I528 WeakPolarHBondContact O-CG1 3.41Å; R524-I528 PolarHBondContact O-N 3.22Å; R524-I528 VanDerWaalsContact O-N 3.16Å; I525-I528 PolarHBondContact O-N 3.14Å; G526-I528 PolarHBondContact O-N 3.3Å; I528-M531 PolarHBondContact O-N 2.91Å; I528-F532 HydrophobicContact CG2-CD2 4.05Å; I528-F532 HydrophobicContact CG2-CE2 3.95Å; I528-F532 VanDerWaalsContact O-CD2 3.26Å; I528-F532 WeakPolarHBondContact O-CD2 3.31Å; I528-F532 PolarHBondContact O-N 3.15Å; I528-Y563 HydrophobicContact CD1-CD1 4.47Å; I528-Y563 HydrophobicContact CG1-CD1 4.15Å; I528-Y563 HydrophobicContact CG1-CE1 3.87Å; I528-Y563 HydrophobicContact CG2-CD1 4.46Å; I528-F567 HydrophobicContact CD1-CD2 4.47Å; I528-Y570 HydrophobicContact CB-CE2 4.21Å; I528-Y570 HydrophobicContact CD1-CD2 3.76Å; I528-Y570 HydrophobicContact CD1-CE2 3.71Å; I528-Y570 HydrophobicContact CG2-CE2 3.91Å
529	T	85.9	Confident	85.8	Confident	29 Å²	29	56.8 Å²	56.8	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-52.7	-56.1	175.1	-80.1	0	0	0	0	111.6	W145 I525 G526 M531 F532 V533	W145-T529 HydrophobicContact CZ2-CG2 3.69Å; I525-T529 WeakPolarHBondContact O-CB 3.28Å; I525-T529 PolarHBondContact O-N 3.39Å; I525-T529 PolarHBondContact O-OG1 2.87Å; G526-T529 VanDerWaalsContact O-CB 3.28Å; G526-T529 WeakPolarHBondContact O-CB 3.38Å; G526-T529 PolarHBondContact O-N 3.41Å; T529-M531 VanDerWaalsContact C-N 3.31Å; T529-M531 PolarHBondContact O-N 3.48Å; T529-F532 PolarHBondContact O-N 2.9Å; T529-F532 VanDerWaalsContact O-N 3.08Å; T529-V533 HydrophobicContact CG2-CG2 4.48Å; T529-V533 WeakPolarHBondContact O-CG2 3.42Å; T529-V533 PolarHBondContact O-N 3.41Å
530	E	85.7	Confident	85.3	Confident	112 Å²	112	57.9 Å²	57.9	52%	0.523	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-40.9	-175.4	-160.3	-153.8	154.3	0	0	110.9	G526 F532 V533 Q534	G526-E530 WeakPolarHBondContact O-CB 3.43Å; G526-E530 PolarHBondContact O-N 3.19Å; E530-F532 VanDerWaalsContact C-N 3.32Å; E530-F532 PolarHBondContact O-N 3.44Å; E530-V533 PolarHBondContact O-N 3.32Å; E530-Q534 HydrophobicContact CG-CG 4.44Å; E530-Q534 WeakPolarHBondContact O-CB 3.44Å; E530-Q534 VanDerWaalsContact O-CG 3.31Å; E530-Q534 WeakPolarHBondContact O-CG 3.16Å; E530-Q534 PolarHBondContact O-N 3.22Å; E530-Q534 PolarHBondContact OE1-NE2 3.21Å
531	M	83.4	Confident	84.9	Confident	30 Å²	30	58.6 Å²	58.6	15%	0.148	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-42.1	175.8	-174.9	-160.5	58.8	0	0	112	A527 I528 T529 L535 K559 Y563	A527-M531 PolarHBondContact O-N 3.42Å; I528-M531 PolarHBondContact O-N 2.91Å; T529-M531 VanDerWaalsContact C-N 3.31Å; T529-M531 PolarHBondContact O-N 3.48Å; M531-L535 HydrophobicContact CG-CD1 4.16Å; M531-L535 WeakPolarHBondContact O-CB 3.32Å; M531-L535 WeakPolarHBondContact O-CD1 3.3Å; M531-L535 WeakPolarHBondContact O-CG 3.21Å; M531-L535 PolarHBondContact O-N 3.46Å; M531-L535 VanDerWaalsContact O-N 3.09Å; M531-K559 HydrophobicContact SD-CD 4.28Å; M531-Y563 HydrophobicContact CE-CD2 3.69Å; M531-Y563 HydrophobicContact CE-CE1 4.32Å; M531-Y563 HydrophobicContact CE-CE2 3.4Å; M531-Y563 VanDerWaalsContact CE-CE2 3.4Å; M531-Y563 HydrophobicContact CE-CG 4.24Å; M531-Y563 HydrophobicContact SD-CD2 4.27Å; M531-Y563 HydrophobicContact SD-CE2 3.43Å; M531-Y563 WeakPolarHBondContact SD-CE2 3.42Å
532	F	83.8	Confident	84.6	Confident	50 Å²	50	60.4 Å²	60.4	22%	0.219	33%	0.333	C	S	.	.	H	α-helix	trans	-74.1	-34.6	177.6	-75	-66.8	0	0	0	112.7	I528 T529 E530 L535 G536 Y560	I528-F532 HydrophobicContact CG2-CD2 4.05Å; I528-F532 HydrophobicContact CG2-CE2 3.95Å; I528-F532 VanDerWaalsContact O-CD2 3.26Å; I528-F532 WeakPolarHBondContact O-CD2 3.31Å; I528-F532 PolarHBondContact O-N 3.15Å; T529-F532 PolarHBondContact O-N 2.9Å; T529-F532 VanDerWaalsContact O-N 3.08Å; E530-F532 VanDerWaalsContact C-N 3.32Å; E530-F532 PolarHBondContact O-N 3.44Å; F532-L535 HydrophobicContact CD1-CD1 4.22Å; F532-L535 HydrophobicContact CE1-CD1 4.48Å; F532-L535 PolarHBondContact O-N 2.91Å; F532-G536 PolarHBondContact O-N 3.22Å; F532-Y560 HydrophobicContact CE1-CD2 4.49Å; F532-Y560 HydrophobicContact CZ-CD2 4.17Å
533	V	84.9	Confident	84.2	Confident	81 Å²	81	61.2 Å²	61.2	49%	0.491	34%	0.344	S	S	.	.	H	α-helix	trans	-63.2	-45	171.5	173.1	0	0	0	0	111.3	T529 E530 L535 G536 S537	T529-V533 HydrophobicContact CG2-CG2 4.48Å; T529-V533 WeakPolarHBondContact O-CG2 3.42Å; T529-V533 PolarHBondContact O-N 3.41Å; E530-V533 PolarHBondContact O-N 3.32Å; V533-L535 VanDerWaalsContact C-N 3.28Å; V533-L535 PolarHBondContact O-N 3.09Å; V533-G536 PolarHBondContact O-N 3.38Å; V533-S537 PolarHBondContact O-N 3.16Å; V533-S537 PolarHBondContact O-OG 2.82Å
534	Q	84.1	Confident	83.8	Confident	83 Å²	83	59.9 Å²	59.9	39%	0.388	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-29.6	175.3	-73.8	-175.7	19	0	0	113.4	E530 S537 K538	E530-Q534 HydrophobicContact CG-CG 4.44Å; E530-Q534 WeakPolarHBondContact O-CB 3.44Å; E530-Q534 VanDerWaalsContact O-CG 3.31Å; E530-Q534 WeakPolarHBondContact O-CG 3.16Å; E530-Q534 PolarHBondContact O-N 3.22Å; E530-Q534 PolarHBondContact OE1-NE2 3.21Å; Q534-S537 PolarHBondContact O-OG 2.87Å; Q534-S537 VanDerWaalsContact O-OG 3.12Å; Q534-K538 WeakPolarHBondContact O-CD 3.43Å; Q534-K538 VanDerWaalsContact O-CG 3.23Å; Q534-K538 WeakPolarHBondContact O-CG 3.43Å; Q534-K538 PolarHBondContact O-N 3.22Å
535	L	80	Confident	83.2	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-78.7	-40.6	174.6	-75.1	165.1	0	0	0	111.5	M531 F532 V533 K538 I539 M552 I556 K559	M531-L535 HydrophobicContact CG-CD1 4.16Å; M531-L535 WeakPolarHBondContact O-CB 3.32Å; M531-L535 WeakPolarHBondContact O-CD1 3.3Å; M531-L535 WeakPolarHBondContact O-CG 3.21Å; M531-L535 PolarHBondContact O-N 3.46Å; M531-L535 VanDerWaalsContact O-N 3.09Å; F532-L535 HydrophobicContact CD1-CD1 4.22Å; F532-L535 HydrophobicContact CE1-CD1 4.48Å; F532-L535 PolarHBondContact O-N 2.91Å; V533-L535 VanDerWaalsContact C-N 3.28Å; V533-L535 PolarHBondContact O-N 3.09Å; L535-K538 PolarHBondContact O-N 3.24Å; L535-I539 PolarHBondContact O-N 3.3Å; L535-M552 HydrophobicContact CD2-CE 3.89Å; L535-I556 HydrophobicContact CB-CD1 4.28Å; L535-I556 HydrophobicContact CB-CG1 3.88Å; L535-I556 HydrophobicContact CD1-CG1 4.48Å; L535-I556 HydrophobicContact CD2-CG1 4.29Å; L535-I556 HydrophobicContact CG-CG1 4.45Å; L535-K559 HydrophobicContact CD1-CB 4.48Å; L535-K559 HydrophobicContact CD1-CD 3.57Å; L535-K559 HydrophobicContact CD2-CD 4.26Å
536	G	80.4	Confident	83.1	Confident	24 Å²	24	58.7 Å²	58.7	25%	0.247	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-46.1	173.6	0	0	0	0	0	112.1	F532 V533 K538 I539 N540	F532-G536 PolarHBondContact O-N 3.22Å; V533-G536 PolarHBondContact O-N 3.38Å; G536-K538 PolarHBondContact O-N 3.47Å; G536-I539 VanDerWaalsContact O-CG2 3.31Å; G536-I539 WeakPolarHBondContact O-CG2 3.34Å; G536-I539 PolarHBondContact O-N 2.92Å; G536-N540 VanDerWaalsContact O-CB 3.3Å; G536-N540 WeakPolarHBondContact O-CB 3.45Å; G536-N540 PolarHBondContact O-N 3.31Å; G536-N540 PolarHBondContact O-ND2 3.24Å; G536-N540 PolarHBondContact O-OD1 2.9Å
537	S	83.7	Confident	83.1	Confident	62 Å²	62	63 Å²	63	43%	0.434	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-42.6	174.9	62.7	0	0	0	0	111.9	V533 Q534 N540 T541	V533-S537 PolarHBondContact O-N 3.16Å; V533-S537 PolarHBondContact O-OG 2.82Å; Q534-S537 PolarHBondContact O-OG 2.87Å; Q534-S537 VanDerWaalsContact O-OG 3.12Å; S537-N540 PolarHBondContact O-N 3.22Å; S537-T541 WeakPolarHBondContact O-CG2 3.49Å; S537-T541 PolarHBondContact O-N 3.39Å; S537-T541 PolarHBondContact O-OG1 3.39Å
538	K	83	Confident	82.8	Confident	110 Å²	110	65.1 Å²	65.1	48%	0.478	36%	0.359	S	S	.	.	H	α-helix	trans	-62.4	-45.1	177.7	-76.3	170.4	-176.4	171.4	0	113.5	Q534 L535 G536 N540 T541 M552	Q534-K538 WeakPolarHBondContact O-CD 3.43Å; Q534-K538 VanDerWaalsContact O-CG 3.23Å; Q534-K538 WeakPolarHBondContact O-CG 3.43Å; Q534-K538 PolarHBondContact O-N 3.22Å; L535-K538 PolarHBondContact O-N 3.24Å; G536-K538 PolarHBondContact O-N 3.47Å; K538-N540 VanDerWaalsContact C-N 3.34Å; K538-T541 WeakPolarHBondContact CA-OG1 3.37Å; K538-T541 PolarHBondContact O-N 2.89Å; K538-T541 PolarHBondContact O-OG1 3.48Å; K538-M552 HydrophobicContact CB-CE 3.73Å
539	I	82.8	Confident	83	Confident	15 Å²	15	66.6 Å²	66.6	8%	0.077	37%	0.365	C	S	.	.	H	α-helix	trans	-68.7	-34	175.9	-168.7	165.8	0	0	0	111.8	L535 G536 T541 L542 Y549 M552 E553 I556	L535-I539 PolarHBondContact O-N 3.3Å; G536-I539 VanDerWaalsContact O-CG2 3.31Å; G536-I539 WeakPolarHBondContact O-CG2 3.34Å; G536-I539 PolarHBondContact O-N 2.92Å; I539-T541 VanDerWaalsContact C-N 3.29Å; I539-T541 PolarHBondContact O-N 3.3Å; I539-L542 PolarHBondContact O-N 3.06Å; I539-L542 VanDerWaalsContact O-N 3.16Å; I539-Y549 HydrophobicContact CD1-CD1 4.46Å; I539-Y549 HydrophobicContact CD1-CD2 4.4Å; I539-Y549 HydrophobicContact CD1-CE1 4.04Å; I539-Y549 HydrophobicContact CD1-CE2 3.99Å; I539-Y549 HydrophobicContact CG1-CD2 3.75Å; I539-Y549 HydrophobicContact CG1-CE1 4.37Å; I539-Y549 HydrophobicContact CG1-CE2 3.44Å; I539-Y549 VanDerWaalsContact CG1-CE2 3.44Å; I539-Y549 HydrophobicContact CG1-CG 4.34Å; I539-M552 HydrophobicContact CB-CB 4.36Å; I539-M552 HydrophobicContact CD1-CB 4.47Å; I539-M552 HydrophobicContact CG1-CB 4.36Å; I539-E553 HydrophobicContact CD1-CB 3.84Å; I539-E553 HydrophobicContact CD1-CG 4.42Å; I539-I556 HydrophobicContact CB-CD1 3.88Å; I539-I556 HydrophobicContact CD1-CD1 3.97Å; I539-I556 HydrophobicContact CG2-CD1 3.66Å
540	N	81.1	Confident	82.9	Confident	133 Å²	133	68.8 Å²	68.8	71%	0.711	37%	0.372	S	S	*	.	H	α-helix	trans	-68.8	-24.1	174.8	-67.4	-10	0	0	0	113.3	G536 S537 K538 L542	G536-N540 VanDerWaalsContact O-CB 3.3Å; G536-N540 WeakPolarHBondContact O-CB 3.45Å; G536-N540 PolarHBondContact O-N 3.31Å; G536-N540 PolarHBondContact O-ND2 3.24Å; G536-N540 PolarHBondContact O-OD1 2.9Å; S537-N540 PolarHBondContact O-N 3.22Å; K538-N540 VanDerWaalsContact C-N 3.34Å; N540-L542 VanDerWaalsContact C-N 3.31Å
541	T	84	Confident	83	Confident	112 Å²	112	68.3 Å²	68.3	69%	0.687	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-6.3	171.9	50.8	0	0	0	0	114.4	S537 K538 I539	S537-T541 WeakPolarHBondContact O-CG2 3.49Å; S537-T541 PolarHBondContact O-N 3.39Å; S537-T541 PolarHBondContact O-OG1 3.39Å; K538-T541 WeakPolarHBondContact CA-OG1 3.37Å; K538-T541 PolarHBondContact O-N 2.89Å; K538-T541 PolarHBondContact O-OG1 3.48Å; I539-T541 VanDerWaalsContact C-N 3.29Å; I539-T541 PolarHBondContact O-N 3.3Å
542	L	83.9	Confident	83	Confident	52 Å²	52	68.1 Å²	68.1	27%	0.272	37%	0.371	S	S	.	.	S	Bend	trans	-101.5	139.7	178	-65.8	178.5	0	0	0	111.3	I539 N540 P544 E548 Y549 M552	I539-L542 PolarHBondContact O-N 3.06Å; I539-L542 VanDerWaalsContact O-N 3.16Å; N540-L542 VanDerWaalsContact C-N 3.31Å; L542-P544 WeakPolarHBondContact O-CD 3.42Å; L542-E548 HydrophobicContact CD1-CB 4.03Å; L542-E548 HydrophobicContact CD2-CB 4.37Å; L542-Y549 HydrophobicContact CB-CD2 4.13Å; L542-M552 HydrophobicContact CD1-CB 4.05Å; L542-M552 HydrophobicContact CD1-CG 3.49Å; L542-M552 VanDerWaalsContact CD1-CG 3.49Å
543	T	82.3	Confident	82.8	Confident	99 Å²	99	68.8 Å²	68.8	61%	0.607	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-61.7	123.6	178.4	-56.5	0	0	0	0	110.6	G545 T546	T543-G545 PolarHBondContact O-N 2.89Å; T543-G545 VanDerWaalsContact O-N 3.15Å; T543-T546 HydrophobicContact CG2-CG2 4.23Å; T543-T546 WeakPolarHBondContact O-CG2 3.4Å; T543-T546 PolarHBondContact O-N 3.07Å; T543-T546 VanDerWaalsContact O-N 3.14Å
544	P	80.3	Confident	82.6	Confident	64 Å²	64	69.4 Å²	69.4	42%	0.416	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	119.2	-173.4	-33.1	37.7	0	0	0	114.8	R447 L542 Y549	R447-P544 PolarHBondContact NH1-O 3.01Å; L542-P544 WeakPolarHBondContact O-CD 3.42Å; P544-Y549 HydrophobicContact CB-CE2 4.36Å; P544-Y549 HydrophobicContact CG-CE2 4.42Å
545	G	75.4	Confident	82.6	Confident	26 Å²	26	69.3 Å²	69.3	27%	0.268	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	11.7	176.8	0	0	0	0	0	116.5	R447 T543 Y549	R447-G545 PolarHBondContact NH1-O 3.02Å; R447-G545 PolarHBondContact NH2-O 2.97Å; T543-G545 PolarHBondContact O-N 2.89Å; T543-G545 VanDerWaalsContact O-N 3.15Å; G545-Y549 VanDerWaalsContact N-CG 3.34Å
546	T	86.1	Confident	82.7	Confident	43 Å²	43	70.9 Å²	70.9	26%	0.264	38%	0.383	S	S	.	.	S	Bend	trans	-64.3	167.3	161.4	72.9	0	0	0	0	110.5	T543 E548 Y549 K550	T543-T546 HydrophobicContact CG2-CG2 4.23Å; T543-T546 WeakPolarHBondContact O-CG2 3.4Å; T543-T546 PolarHBondContact O-N 3.07Å; T543-T546 VanDerWaalsContact O-N 3.14Å; T546-E548 WeakPolarHBondContact CB-OE2 3.33Å; T546-E548 PolarHBondContact O-N 2.87Å; T546-E548 PolarHBondContact OG1-OE2 2.88Å; T546-Y549 WeakPolarHBondContact O-CB 3.42Å; T546-Y549 PolarHBondContact O-N 3.25Å; T546-Y549 VanDerWaalsContact O-N 3.13Å; T546-Y549 PolarHBondContact OG1-N 3.39Å; T546-K550 PolarHBondContact O-N 3.13Å
547	Q	84.9	Confident	82.7	Confident	121 Å²	121	73.1 Å²	73.1	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-63	-32	-177.6	-172.6	62.4	24.1	0	0	111.3	K550 L551	Q547-K550 PolarHBondContact O-N 3.07Å; Q547-L551 HydrophobicContact CG-CD1 4.3Å; Q547-L551 WeakPolarHBondContact O-CB 3.41Å; Q547-L551 WeakPolarHBondContact O-CG 3.41Å; Q547-L551 PolarHBondContact O-N 2.97Å
548	E	80.7	Confident	82.7	Confident	104 Å²	104	75.2 Å²	75.2	49%	0.486	39%	0.392	S	S	.	.	H	α-helix	trans	-69.1	-40.6	176.3	-51.5	68.9	-144.1	0	0	110.9	L542 T546 L551 M552	L542-E548 HydrophobicContact CD1-CB 4.03Å; L542-E548 HydrophobicContact CD2-CB 4.37Å; T546-E548 WeakPolarHBondContact CB-OE2 3.33Å; T546-E548 PolarHBondContact O-N 2.87Å; T546-E548 PolarHBondContact OG1-OE2 2.88Å; E548-L551 PolarHBondContact O-N 3.45Å; E548-M552 WeakPolarHBondContact O-CB 3.47Å; E548-M552 PolarHBondContact O-N 3.44Å
549	Y	86.1	Confident	82.6	Confident	44 Å²	44	73 Å²	73	17%	0.173	38%	0.383	C	S	.	.	H	α-helix	trans	-60.3	-47.3	173.5	-176.9	-80.6	0	0	0	110.8	I539 L542 P544 G545 T546 L551 M552 E553	I539-Y549 HydrophobicContact CD1-CD1 4.46Å; I539-Y549 HydrophobicContact CD1-CD2 4.4Å; I539-Y549 HydrophobicContact CD1-CE1 4.04Å; I539-Y549 HydrophobicContact CD1-CE2 3.99Å; I539-Y549 HydrophobicContact CG1-CD2 3.75Å; I539-Y549 HydrophobicContact CG1-CE1 4.37Å; I539-Y549 HydrophobicContact CG1-CE2 3.44Å; I539-Y549 VanDerWaalsContact CG1-CE2 3.44Å; I539-Y549 HydrophobicContact CG1-CG 4.34Å; L542-Y549 HydrophobicContact CB-CD2 4.13Å; P544-Y549 HydrophobicContact CB-CE2 4.36Å; P544-Y549 HydrophobicContact CG-CE2 4.42Å; G545-Y549 VanDerWaalsContact N-CG 3.34Å; T546-Y549 WeakPolarHBondContact O-CB 3.42Å; T546-Y549 PolarHBondContact O-N 3.25Å; T546-Y549 VanDerWaalsContact O-N 3.13Å; T546-Y549 PolarHBondContact OG1-N 3.39Å; Y549-L551 PolarHBondContact O-N 3.25Å; Y549-M552 PolarHBondContact O-N 2.99Å; Y549-M552 VanDerWaalsContact O-N 3.17Å; Y549-E553 PolarHBondContact O-N 3.46Å
550	K	84.8	Confident	82.5	Confident	74 Å²	74	78.3 Å²	78.3	32%	0.322	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-42.9	178.4	-164.5	173.1	-168.3	175	0	111.9	E446 T546 Q547 M552 E553 D554	E446-K550 IonicContact OE1-NZ 2.6Å; E446-K550 PolarHBondContact OE1-NZ 3.33Å; E446-K550 IonicContact OE2-NZ 3.35Å; E446-K550 PolarHBondContact OE2-NZ 2.93Å; T546-K550 PolarHBondContact O-N 3.13Å; Q547-K550 PolarHBondContact O-N 3.07Å; K550-M552 VanDerWaalsContact C-N 3.31Å; K550-M552 PolarHBondContact O-N 2.95Å; K550-E553 PolarHBondContact O-N 3.44Å; K550-D554 PolarHBondContact O-N 3.43Å
551	L	88.1	Confident	82.3	Confident	102 Å²	102	80.3 Å²	80.3	53%	0.534	40%	0.4	S	S	.	.	H	α-helix	trans	-61.7	-35.1	173.6	-78.9	165.6	0	0	0	113	Q547 E548 Y549 Q555	Q547-L551 HydrophobicContact CG-CD1 4.3Å; Q547-L551 WeakPolarHBondContact O-CB 3.41Å; Q547-L551 WeakPolarHBondContact O-CG 3.41Å; Q547-L551 PolarHBondContact O-N 2.97Å; E548-L551 PolarHBondContact O-N 3.45Å; Y549-L551 PolarHBondContact O-N 3.25Å; L551-Q555 WeakPolarHBondContact O-CB 3.18Å; L551-Q555 PolarHBondContact O-N 3.02Å
552	M	82.8	Confident	82.3	Confident	27 Å²	27	81 Å²	81	13%	0.133	39%	0.393	C	S	.	.	H	α-helix	trans	-71.8	-38.2	174.1	-84	-59.2	-54.4	0	0	112.6	L535 K538 I539 L542 E548 Y549 K550 Q555 I556	L535-M552 HydrophobicContact CD2-CE 3.89Å; K538-M552 HydrophobicContact CB-CE 3.73Å; I539-M552 HydrophobicContact CB-CB 4.36Å; I539-M552 HydrophobicContact CD1-CB 4.47Å; I539-M552 HydrophobicContact CG1-CB 4.36Å; L542-M552 HydrophobicContact CD1-CB 4.05Å; L542-M552 HydrophobicContact CD1-CG 3.49Å; L542-M552 VanDerWaalsContact CD1-CG 3.49Å; E548-M552 WeakPolarHBondContact O-CB 3.47Å; E548-M552 PolarHBondContact O-N 3.44Å; Y549-M552 PolarHBondContact O-N 2.99Å; Y549-M552 VanDerWaalsContact O-N 3.17Å; K550-M552 VanDerWaalsContact C-N 3.31Å; K550-M552 PolarHBondContact O-N 2.95Å; M552-Q555 PolarHBondContact O-N 3.44Å; M552-I556 VanDerWaalsContact O-CG1 3.3Å; M552-I556 WeakPolarHBondContact O-CG1 3.4Å; M552-I556 PolarHBondContact O-N 3.34Å
553	E	80.1	Confident	82.1	Confident	64 Å²	64	82.2 Å²	82.2	30%	0.299	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-47	174.2	-169.5	159.7	-140	0	0	111.1	I539 Y549 K550 Q555 I556 L557	I539-E553 HydrophobicContact CD1-CB 3.84Å; I539-E553 HydrophobicContact CD1-CG 4.42Å; Y549-E553 PolarHBondContact O-N 3.46Å; K550-E553 PolarHBondContact O-N 3.44Å; E553-Q555 VanDerWaalsContact C-N 3.32Å; E553-Q555 PolarHBondContact O-N 2.9Å; E553-I556 WeakPolarHBondContact O-CB 3.47Å; E553-I556 PolarHBondContact O-N 3.34Å; E553-L557 HydrophobicContact CG-CD1 4.38Å; E553-L557 WeakPolarHBondContact O-CG 3.38Å; E553-L557 PolarHBondContact O-N 2.84Å
554	D	80.9	Confident	81.9	Confident	93 Å²	93	83.8 Å²	83.8	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-59.7	-39.6	171.6	-82.4	-38.5	0	0	0	112.3	K550 L557 Q558	K550-D554 PolarHBondContact O-N 3.43Å; D554-L557 PolarHBondContact O-N 3.49Å; D554-Q558 VanDerWaalsContact O-CB 3.24Å; D554-Q558 WeakPolarHBondContact O-CB 3.38Å; D554-Q558 PolarHBondContact O-N 2.96Å
555	Q	82.4	Confident	81.9	Confident	81 Å²	81	89.6 Å²	89.6	38%	0.379	41%	0.412	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176.3	-167.7	-174.4	119	0	0	112	L551 M552 E553 K559	L551-Q555 WeakPolarHBondContact O-CB 3.18Å; L551-Q555 PolarHBondContact O-N 3.02Å; M552-Q555 PolarHBondContact O-N 3.44Å; E553-Q555 VanDerWaalsContact C-N 3.32Å; E553-Q555 PolarHBondContact O-N 2.9Å; Q555-K559 HydrophobicContact CG-CD 4.49Å; Q555-K559 WeakPolarHBondContact O-CB 3.44Å; Q555-K559 WeakPolarHBondContact O-CG 3.28Å; Q555-K559 PolarHBondContact O-N 3.02Å; Q555-K559 VanDerWaalsContact OE1-NZ 3.15Å
556	I	83.2	Confident	82.2	Confident	38 Å²	38	95.5 Å²	95.5	20%	0.195	43%	0.43	C	S	.	.	H	α-helix	trans	-62	-51.9	175.1	-74.9	164.3	0	0	0	110	L535 I539 M552 E553 Q558 K559 Y560	L535-I556 HydrophobicContact CB-CD1 4.28Å; L535-I556 HydrophobicContact CB-CG1 3.88Å; L535-I556 HydrophobicContact CD1-CG1 4.48Å; L535-I556 HydrophobicContact CD2-CG1 4.29Å; L535-I556 HydrophobicContact CG-CG1 4.45Å; I539-I556 HydrophobicContact CB-CD1 3.88Å; I539-I556 HydrophobicContact CD1-CD1 3.97Å; I539-I556 HydrophobicContact CG2-CD1 3.66Å; M552-I556 VanDerWaalsContact O-CG1 3.3Å; M552-I556 WeakPolarHBondContact O-CG1 3.4Å; M552-I556 PolarHBondContact O-N 3.34Å; E553-I556 WeakPolarHBondContact O-CB 3.47Å; E553-I556 PolarHBondContact O-N 3.34Å; I556-Q558 VanDerWaalsContact C-N 3.33Å; I556-Q558 PolarHBondContact O-N 2.84Å; I556-K559 PolarHBondContact O-N 3.26Å; I556-Y560 WeakPolarHBondContact O-CB 3.27Å; I556-Y560 PolarHBondContact O-N 3.48Å
557	L	79.9	Confident	81.8	Confident	72 Å²	72	95.5 Å²	95.5	38%	0.377	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-40.8	179.2	-69.2	172	0	0	0	111.8	E553 D554 Y560 R561	E553-L557 HydrophobicContact CG-CD1 4.38Å; E553-L557 WeakPolarHBondContact O-CG 3.38Å; E553-L557 PolarHBondContact O-N 2.84Å; D554-L557 PolarHBondContact O-N 3.49Å; L557-Y560 PolarHBondContact O-N 3.2Å; L557-R561 WeakPolarHBondContact O-CB 3.44Å; L557-R561 VanDerWaalsContact O-CG 3.22Å; L557-R561 WeakPolarHBondContact O-CG 3.17Å; L557-R561 PolarHBondContact O-N 3.42Å
558	Q	84.3	Confident	81.3	Confident	105 Å²	105	94.6 Å²	94.6	49%	0.491	43%	0.431	S	S	.	.	H	α-helix	trans	-66.9	-42.3	177	-163.8	-162.4	97.9	0	0	111.9	D554 I556 K562	D554-Q558 VanDerWaalsContact O-CB 3.24Å; D554-Q558 WeakPolarHBondContact O-CB 3.38Å; D554-Q558 PolarHBondContact O-N 2.96Å; I556-Q558 VanDerWaalsContact C-N 3.33Å; I556-Q558 PolarHBondContact O-N 2.84Å; Q558-K562 HydrophobicContact CG-CD 4.36Å; Q558-K562 WeakPolarHBondContact O-CB 3.36Å; Q558-K562 VanDerWaalsContact O-CG 3.31Å; Q558-K562 WeakPolarHBondContact O-CG 3.18Å; Q558-K562 PolarHBondContact O-N 3.03Å
559	K	80.8	Confident	81.4	Confident	65 Å²	65	90.9 Å²	90.9	28%	0.283	42%	0.421	S	S	.	.	H	α-helix	trans	-64.5	-44.8	174.8	-78	-178.5	-179.3	177.9	0	111.3	M531 L535 Q555 I556 R561 K562 Y563	M531-K559 HydrophobicContact SD-CD 4.28Å; L535-K559 HydrophobicContact CD1-CB 4.48Å; L535-K559 HydrophobicContact CD1-CD 3.57Å; L535-K559 HydrophobicContact CD2-CD 4.26Å; Q555-K559 HydrophobicContact CG-CD 4.49Å; Q555-K559 WeakPolarHBondContact O-CB 3.44Å; Q555-K559 WeakPolarHBondContact O-CG 3.28Å; Q555-K559 PolarHBondContact O-N 3.02Å; Q555-K559 VanDerWaalsContact OE1-NZ 3.15Å; I556-K559 PolarHBondContact O-N 3.26Å; K559-R561 PolarHBondContact O-N 3.45Å; K559-K562 PolarHBondContact O-N 3.22Å; K559-Y563 WeakPolarHBondContact O-CD2 3.2Å; K559-Y563 PolarHBondContact O-N 2.96Å
560	Y	79.8	Confident	81.3	Confident	125 Å²	125	91.6 Å²	91.6	49%	0.49	42%	0.424	S	S	.	.	H	α-helix	trans	-58.9	-47.4	176.3	-179.5	-119	0	0	0	112.3	F532 I556 L557 K562 Y563 K564	F532-Y560 HydrophobicContact CE1-CD2 4.49Å; F532-Y560 HydrophobicContact CZ-CD2 4.17Å; I556-Y560 WeakPolarHBondContact O-CB 3.27Å; I556-Y560 PolarHBondContact O-N 3.48Å; L557-Y560 PolarHBondContact O-N 3.2Å; Y560-K562 VanDerWaalsContact C-N 3.35Å; Y560-K562 PolarHBondContact O-N 2.9Å; Y560-Y563 PolarHBondContact O-N 3.45Å; Y560-K564 WeakPolarHBondContact O-CB 3.35Å; Y560-K564 PolarHBondContact O-N 2.92Å
561	R	77.3	Confident	81.1	Confident	176 Å²	176	95.7 Å²	95.7	66%	0.664	44%	0.437	S	S	*	.	H	α-helix	trans	-59.1	-42.4	174.4	-70.7	170	-171.9	177.6	5.5	112.2	L557 K559 K565	L557-R561 WeakPolarHBondContact O-CB 3.44Å; L557-R561 VanDerWaalsContact O-CG 3.22Å; L557-R561 WeakPolarHBondContact O-CG 3.17Å; L557-R561 PolarHBondContact O-N 3.42Å; K559-R561 PolarHBondContact O-N 3.45Å; R561-K565 PolarHBondContact O-N 2.91Å; R561-K565 VanDerWaalsContact O-N 3.12Å
562	K	84.3	Confident	81.1	Confident	126 Å²	126	95 Å²	95	55%	0.548	43%	0.431	S	S	.	.	H	α-helix	trans	-64.3	-44.7	176.4	-77.2	171.6	171.5	176.9	0	112.3	Q558 K559 Y560 K565 K566	Q558-K562 HydrophobicContact CG-CD 4.36Å; Q558-K562 WeakPolarHBondContact O-CB 3.36Å; Q558-K562 VanDerWaalsContact O-CG 3.31Å; Q558-K562 WeakPolarHBondContact O-CG 3.18Å; Q558-K562 PolarHBondContact O-N 3.03Å; K559-K562 PolarHBondContact O-N 3.22Å; Y560-K562 VanDerWaalsContact C-N 3.35Å; Y560-K562 PolarHBondContact O-N 2.9Å; K562-K565 PolarHBondContact O-N 2.94Å; K562-K566 WeakPolarHBondContact O-CB 3.42Å; K562-K566 PolarHBondContact O-N 2.96Å
563	Y	79.4	Confident	81.4	Confident	77 Å²	77	96 Å²	96	30%	0.302	44%	0.435	S	S	.	.	H	α-helix	trans	-67.4	-45.3	177.6	-91.4	-96.6	0	0	0	112.2	I528 M531 K559 Y560 K565 K566 F567	I528-Y563 HydrophobicContact CD1-CD1 4.47Å; I528-Y563 HydrophobicContact CG1-CD1 4.15Å; I528-Y563 HydrophobicContact CG1-CE1 3.87Å; I528-Y563 HydrophobicContact CG2-CD1 4.46Å; M531-Y563 HydrophobicContact CE-CD2 3.69Å; M531-Y563 HydrophobicContact CE-CE1 4.32Å; M531-Y563 HydrophobicContact CE-CE2 3.4Å; M531-Y563 VanDerWaalsContact CE-CE2 3.4Å; M531-Y563 HydrophobicContact CE-CG 4.24Å; M531-Y563 HydrophobicContact SD-CD2 4.27Å; M531-Y563 HydrophobicContact SD-CE2 3.43Å; M531-Y563 WeakPolarHBondContact SD-CE2 3.42Å; K559-Y563 WeakPolarHBondContact O-CD2 3.2Å; K559-Y563 PolarHBondContact O-N 2.96Å; Y560-Y563 PolarHBondContact O-N 3.45Å; Y563-K565 PolarHBondContact O-N 3.39Å; Y563-K566 PolarHBondContact O-N 2.96Å; Y563-F567 AromaticContact CD1-CD2 3.71Å; Y563-F567 HydrophobicContact CD1-CD2 3.71Å; Y563-F567 AromaticContact CD1-CE2 3.72Å; Y563-F567 HydrophobicContact CD1-CE2 3.72Å; Y563-F567 HydrophobicContact CE1-CD2 4.22Å; Y563-F567 AromaticContact CE1-CE2 3.74Å; Y563-F567 HydrophobicContact CE1-CE2 3.74Å; Y563-F567 PolarHBondContact O-N 2.92Å
564	K	78.9	Confident	81.7	Confident	132 Å²	132	96.7 Å²	96.7	57%	0.574	44%	0.438	S	S	*	.	H	α-helix	trans	-59.6	-32.2	176.2	-173.8	173.1	179.5	176.5	0	112.9	Y560	Y560-K564 WeakPolarHBondContact O-CB 3.35Å; Y560-K564 PolarHBondContact O-N 2.92Å
565	K	80.6	Confident	82.1	Confident	187 Å²	187	99.4 Å²	99.4	81%	0.813	45%	0.445	S	S	*	.	H	α-helix	trans	-77.1	-33.6	172.5	-173	172.3	-179.3	177.9	0	113.1	R561 K562 Y563	R561-K565 PolarHBondContact O-N 2.91Å; R561-K565 VanDerWaalsContact O-N 3.12Å; K562-K565 PolarHBondContact O-N 2.94Å; Y563-K565 PolarHBondContact O-N 3.39Å
566	K	81.8	Confident	82.6	Confident	150 Å²	150	99.4 Å²	99.4	65%	0.652	44%	0.441	S	S	*	.	H	α-helix	trans	-78.5	-32.5	-179.6	-174.6	175.9	174.7	-174.8	0	113.2	K562 Y563	K562-K566 WeakPolarHBondContact O-CB 3.42Å; K562-K566 PolarHBondContact O-N 2.96Å; Y563-K566 PolarHBondContact O-N 2.96Å
567	F	76.9	Confident	82.9	Confident	43 Å²	43	98 Å²	98	19%	0.189	44%	0.435	C	S	.	.			trans	-129.3	71.9	-175.8	-57.1	-75	0	0	0	110.5	I528 Y563 G569 Y570	I528-F567 HydrophobicContact CD1-CD2 4.47Å; Y563-F567 AromaticContact CD1-CD2 3.71Å; Y563-F567 HydrophobicContact CD1-CD2 3.71Å; Y563-F567 AromaticContact CD1-CE2 3.72Å; Y563-F567 HydrophobicContact CD1-CE2 3.72Å; Y563-F567 HydrophobicContact CE1-CD2 4.22Å; Y563-F567 AromaticContact CE1-CE2 3.74Å; Y563-F567 HydrophobicContact CE1-CE2 3.74Å; Y563-F567 PolarHBondContact O-N 2.92Å; F567-G569 PolarHBondContact O-N 3.13Å; F567-Y570 WeakPolarHBondContact O-CB 3.47Å; F567-Y570 PolarHBondContact O-N 3.3Å
568	P	74.8	Confident	83.4	Confident	101 Å²	101	98.5 Å²	98.5	66%	0.656	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.3	-178.6	25.6	-34.3	0	0	0	113.2
569	G	82.3	Confident	83.9	Confident	26 Å²	26	96.3 Å²	96.3	27%	0.268	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	14.6	178.3	0	0	0	0	0	115.7	F567 R571 E572 E573	F567-G569 PolarHBondContact O-N 3.13Å; G569-R571 VanDerWaalsContact C-N 3.28Å; G569-R571 PolarHBondContact O-N 3.31Å; G569-E572 VanDerWaalsContact CA-OE2 3.23Å; G569-E572 WeakPolarHBondContact CA-OE2 3.43Å; G569-E572 WeakPolarHBondContact O-CB 3.44Å; G569-E572 PolarHBondContact O-N 3.49Å; G569-E572 VanDerWaalsContact O-N 3.13Å; G569-E572 VanDerWaalsContact O-OE2 3.12Å; G569-E573 VanDerWaalsContact O-CG 3.31Å; G569-E573 WeakPolarHBondContact O-CG 3.43Å; G569-E573 PolarHBondContact O-N 2.81Å
570	Y	84.1	Confident	84.4	Confident	60 Å²	60	93.2 Å²	93.2	24%	0.235	41%	0.41	C	S	.	.	H	α-helix	trans	-58.5	-32.8	-172.4	171.8	-103	0	0	0	114.4	I525 I528 F567 K574	I525-Y570 HydrophobicContact CG1-CE2 4.18Å; I528-Y570 HydrophobicContact CB-CE2 4.21Å; I528-Y570 HydrophobicContact CD1-CD2 3.76Å; I528-Y570 HydrophobicContact CD1-CE2 3.71Å; I528-Y570 HydrophobicContact CG2-CE2 3.91Å; F567-Y570 WeakPolarHBondContact O-CB 3.47Å; F567-Y570 PolarHBondContact O-N 3.3Å; Y570-K574 WeakPolarHBondContact O-CB 3.42Å; Y570-K574 PolarHBondContact O-N 3.15Å
571	R	79.9	Confident	85.1	Confident	160 Å²	160	89.8 Å²	89.8	60%	0.604	40%	0.398	S	S	*	.	H	α-helix	trans	-74.8	-35	179.5	-54.3	171.6	-59.9	-123	-12.4	111	G569 K574 K575	G569-R571 VanDerWaalsContact C-N 3.28Å; G569-R571 PolarHBondContact O-N 3.31Å; R571-K574 PolarHBondContact O-N 2.87Å; R571-K575 WeakPolarHBondContact O-CG 3.41Å; R571-K575 PolarHBondContact O-N 2.81Å
572	E	88.3	Confident	85.8	Confident	87 Å²	87	87.5 Å²	87.5	41%	0.407	39%	0.393	S	S	.	.	H	α-helix	trans	-72.2	-40.3	-178.3	-60.1	67.3	-152.3	0	0	108.8	G569 K575 R576	G569-E572 VanDerWaalsContact CA-OE2 3.23Å; G569-E572 WeakPolarHBondContact CA-OE2 3.43Å; G569-E572 WeakPolarHBondContact O-CB 3.44Å; G569-E572 PolarHBondContact O-N 3.49Å; G569-E572 VanDerWaalsContact O-N 3.13Å; G569-E572 VanDerWaalsContact O-OE2 3.12Å; E572-K575 PolarHBondContact O-N 2.91Å; E572-R576 PolarHBondContact O-N 2.71Å
573	E	89.4	Confident	86.3	Confident	47 Å²	47	82.1 Å²	82.1	22%	0.22	37%	0.369	C	S	.	.	H	α-helix	trans	-61.7	-41.9	166.8	-67.5	173.6	156.3	0	0	112.5	L521 R524 G569 R576 C577	L521-E573 HydrophobicContact CD2-CB 4.47Å; R524-E573 VanDerWaalsContact CZ-CD 3.4Å; R524-E573 IonicContact CZ-OE1 2.71Å; R524-E573 IonicContact CZ-OE2 2.8Å; R524-E573 IonicContact NH1-OE1 3.45Å; R524-E573 PolarHBondContact NH1-OE1 2.97Å; R524-E573 IonicContact NH1-OE2 2.8Å; R524-E573 PolarHBondContact NH1-OE2 2.77Å; R524-E573 IonicContact NH2-OE1 3.62Å; R524-E573 PolarHBondContact NH2-OE1 2.98Å; R524-E573 IonicContact NH2-OE2 3.15Å; G569-E573 VanDerWaalsContact O-CG 3.31Å; G569-E573 WeakPolarHBondContact O-CG 3.43Å; G569-E573 PolarHBondContact O-N 2.81Å; E573-R576 PolarHBondContact O-N 3.48Å; E573-C577 WeakPolarHBondContact O-CB 3.31Å; E573-C577 PolarHBondContact O-N 3.18Å
574	K	87.3	Confident	87	Confident	80 Å²	80	78.7 Å²	78.7	35%	0.348	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-47.4	174.1	-170.6	179	-173.4	-90.2	0	111.7	I525 Y570 R571 R576 C577 E578	I525-K574 HydrophobicContact CD1-CB 4.41Å; Y570-K574 WeakPolarHBondContact O-CB 3.42Å; Y570-K574 PolarHBondContact O-N 3.15Å; R571-K574 PolarHBondContact O-N 2.87Å; K574-R576 PolarHBondContact O-N 3.41Å; K574-C577 WeakPolarHBondContact O-CB 3.42Å; K574-C577 PolarHBondContact O-N 3.34Å; K574-E578 WeakPolarHBondContact CE-OE1 3.46Å; K574-E578 WeakPolarHBondContact CG-OE1 3.37Å; K574-E578 IonicContact NZ-OE1 2.81Å; K574-E578 PolarHBondContact NZ-OE1 3.23Å; K574-E578 WeakPolarHBondContact O-CG 3.38Å; K574-E578 PolarHBondContact O-N 3.39Å
575	K	88.7	Confident	87.7	Confident	149 Å²	149	75.4 Å²	75.4	65%	0.648	35%	0.35	S	S	*	.	H	α-helix	trans	-59.5	-42.5	175.7	-75.7	-176.6	175.6	-166.6	0	112.3	R571 E572 E578 Y579	R571-K575 WeakPolarHBondContact O-CG 3.41Å; R571-K575 PolarHBondContact O-N 2.81Å; E572-K575 PolarHBondContact O-N 2.91Å; K575-E578 PolarHBondContact O-N 3.4Å; K575-Y579 WeakPolarHBondContact O-CB 3.34Å; K575-Y579 PolarHBondContact O-N 2.98Å
576	R	92.1	Very high	88.3	Confident	81 Å²	81	68.4 Å²	68.4	31%	0.306	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-41.5	175	-179.7	61.3	176.8	167.1	3.9	111.6	E514 E517 L521 E572 E573 K574 Y579 L580	E514-R576 IonicContact OE1-NH2 2.78Å; E517-R576 VanDerWaalsContact OE1-CG 3.25Å; E517-R576 WeakPolarHBondContact OE1-CG 3.48Å; E517-R576 IonicContact OE1-CZ 2.74Å; E517-R576 IonicContact OE1-NE 3.46Å; E517-R576 PolarHBondContact OE1-NE 2.8Å; E517-R576 IonicContact OE1-NH2 2.72Å; E517-R576 IonicContact OE2-CZ 3.16Å; E517-R576 IonicContact OE2-NE 2.8Å; E517-R576 PolarHBondContact OE2-NE 2.94Å; E517-R576 IonicContact OE2-NH2 2.61Å; E517-R576 PolarHBondContact OE2-NH2 3.32Å; L521-R576 HydrophobicContact CD1-CB 3.97Å; L521-R576 HydrophobicContact CD1-CG 3.57Å; E572-R576 PolarHBondContact O-N 2.71Å; E573-R576 PolarHBondContact O-N 3.48Å; K574-R576 PolarHBondContact O-N 3.41Å; R576-Y579 PolarHBondContact O-N 3.22Å; R576-L580 HydrophobicContact CG-CD1 4.19Å; R576-L580 WeakPolarHBondContact O-CB 3.31Å; R576-L580 WeakPolarHBondContact O-CG 3.43Å; R576-L580 PolarHBondContact O-N 3Å
577	C	91.4	Very high	88.8	Confident	10 Å²	10	61.2 Å²	61.2	7%	0.068	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-41.3	175.4	-169.9	0	0	0	0	112.8	L521 I525 E573 K574 H581	L521-C577 HydrophobicContact CB-CB 4Å; L521-C577 HydrophobicContact CD1-CB 4.39Å; I525-C577 HydrophobicContact CD1-CB 3.39Å; E573-C577 WeakPolarHBondContact O-CB 3.31Å; E573-C577 PolarHBondContact O-N 3.18Å; K574-C577 WeakPolarHBondContact O-CB 3.42Å; K574-C577 PolarHBondContact O-N 3.34Å; C577-H581 WeakPolarHBondContact O-CB 3.45Å; C577-H581 PolarHBondContact O-N 3.01Å
578	E	89.9	Confident	89.6	Confident	81 Å²	81	63.6 Å²	63.6	38%	0.379	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-42	176.3	-73	167.9	-179.2	0	0	112.4	K574 K575 H581 K582	K574-E578 WeakPolarHBondContact CE-OE1 3.46Å; K574-E578 WeakPolarHBondContact CG-OE1 3.37Å; K574-E578 IonicContact NZ-OE1 2.81Å; K574-E578 PolarHBondContact NZ-OE1 3.23Å; K574-E578 WeakPolarHBondContact O-CG 3.38Å; K574-E578 PolarHBondContact O-N 3.39Å; K575-E578 PolarHBondContact O-N 3.4Å; E578-H581 PolarHBondContact O-N 3.18Å; E578-K582 WeakPolarHBondContact O-CG 3.46Å; E578-K582 PolarHBondContact O-N 3.15Å; E578-K582 VanDerWaalsContact O-N 3.14Å
579	Y	93.3	Very high	90.4	Very high	60 Å²	60	60.6 Å²	60.6	24%	0.235	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-51.7	172.9	169.4	-88	0	0	0	111	D490 Y491 K575 R576 H581 K582 K583	D490-Y579 VanDerWaalsContact OD1-CE2 3.22Å; D490-Y579 WeakPolarHBondContact OD1-CE2 3.48Å; D490-Y579 PolarHBondContact OD1-OH 2.81Å; D490-Y579 PolarHBondContact OD2-OH 3.12Å; Y491-Y579 AromaticContact CD1-CE2 3.83Å; Y491-Y579 HydrophobicContact CD1-CE2 3.83Å; Y491-Y579 HydrophobicContact CE1-CD2 4.33Å; Y491-Y579 HydrophobicContact CE1-CE2 4.04Å; K575-Y579 WeakPolarHBondContact O-CB 3.34Å; K575-Y579 PolarHBondContact O-N 2.98Å; R576-Y579 PolarHBondContact O-N 3.22Å; Y579-H581 VanDerWaalsContact C-N 3.33Å; Y579-H581 PolarHBondContact O-N 2.8Å; Y579-K582 PolarHBondContact O-N 2.56Å; Y579-K583 HydrophobicContact CE1-CB 4.37Å; Y579-K583 HydrophobicContact CE1-CD 3.71Å; Y579-K583 WeakPolarHBondContact O-CB 3.32Å; Y579-K583 PolarHBondContact O-N 2.83Å
580	L	93.2	Very high	90.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-40.5	179.4	-76	176.8	0	0	0	111.8	E514 E517 Y518 L521 R576 K582 K583 L584	E514-L580 HydrophobicContact CB-CD2 4.02Å; E514-L580 HydrophobicContact CG-CD2 4.35Å; E517-L580 HydrophobicContact CB-CD1 4.24Å; E517-L580 HydrophobicContact CG-CD1 4.11Å; Y518-L580 HydrophobicContact CD2-CB 3.98Å; Y518-L580 HydrophobicContact CG-CB 4.37Å; L521-L580 HydrophobicContact CD1-CD1 4.27Å; R576-L580 HydrophobicContact CG-CD1 4.19Å; R576-L580 WeakPolarHBondContact O-CB 3.31Å; R576-L580 WeakPolarHBondContact O-CG 3.43Å; R576-L580 PolarHBondContact O-N 3Å; L580-K582 PolarHBondContact O-N 2.96Å; L580-K583 PolarHBondContact O-N 3.42Å; L580-L584 HydrophobicContact CB-CD1 4.28Å; L580-L584 WeakPolarHBondContact O-CB 3.4Å; L580-L584 WeakPolarHBondContact O-CG 3.48Å; L580-L584 PolarHBondContact O-N 3.42Å
581	H	93.1	Very high	91.3	Very high	52 Å²	52	58.2 Å²	58.2	24%	0.241	27%	0.272	C	S	.	.	H	α-helix	trans	-57.1	-47.9	175.2	-176.3	68.6	0	0	0	111.8	Y518 C577 E578 Y579 S585	Y518-H581 HydrophobicContact CD2-CB 4.5Å; Y518-H581 HydrophobicContact CE2-CB 3.75Å; Y518-H581 AromaticContact CZ-ND1 3.7Å; Y518-H581 PolarHBondContact OH-ND1 2.85Å; C577-H581 WeakPolarHBondContact O-CB 3.45Å; C577-H581 PolarHBondContact O-N 3.01Å; E578-H581 PolarHBondContact O-N 3.18Å; Y579-H581 VanDerWaalsContact C-N 3.33Å; Y579-H581 PolarHBondContact O-N 2.8Å; H581-S585 WeakPolarHBondContact O-CB 3.36Å; H581-S585 PolarHBondContact O-N 2.68Å
582	K	93.4	Very high	91.9	Very high	128 Å²	128	53 Å²	53	56%	0.557	26%	0.262	S	S	*	.	H	α-helix	trans	-65.5	-49.3	178.2	-68	176.7	-179.6	-177.5	0	112	Y491 E578 Y579 L580 S585 H586	Y491-K582 WeakPolarHBondContact OH-CB 3.23Å; E578-K582 WeakPolarHBondContact O-CG 3.46Å; E578-K582 PolarHBondContact O-N 3.15Å; E578-K582 VanDerWaalsContact O-N 3.14Å; Y579-K582 PolarHBondContact O-N 2.56Å; L580-K582 PolarHBondContact O-N 2.96Å; K582-S585 PolarHBondContact O-N 2.78Å; K582-H586 PolarHBondContact O-N 2.74Å
583	K	94.3	Very high	92	Very high	13 Å²	13	52.7 Å²	52.7	6%	0.057	26%	0.261	C	S	.	.	H	α-helix	trans	-58.1	-52.5	178.6	173	172.6	179	-172.9	0	112.2	Y491 E514 Y579 L580 S585 H586 I587	Y491-K583 HydrophobicContact CD1-CB 3.82Å; Y491-K583 HydrophobicContact CD1-CG 4.31Å; Y491-K583 HydrophobicContact CD2-CB 4.38Å; Y491-K583 HydrophobicContact CE1-CB 4.33Å; Y491-K583 HydrophobicContact CG-CB 3.86Å; Y491-K583 HydrophobicContact CG-CG 4.04Å; E514-K583 IonicContact OE1-NZ 3.37Å; E514-K583 PolarHBondContact OE1-NZ 2.71Å; E514-K583 VanDerWaalsContact OE2-CD 3.29Å; E514-K583 WeakPolarHBondContact OE2-CD 3.22Å; E514-K583 WeakPolarHBondContact OE2-CE 3.2Å; E514-K583 IonicContact OE2-NZ 2.75Å; E514-K583 PolarHBondContact OE2-NZ 3.45Å; Y579-K583 HydrophobicContact CE1-CB 4.37Å; Y579-K583 HydrophobicContact CE1-CD 3.71Å; Y579-K583 WeakPolarHBondContact O-CB 3.32Å; Y579-K583 PolarHBondContact O-N 2.83Å; L580-K583 PolarHBondContact O-N 3.42Å; K583-S585 VanDerWaalsContact C-N 3.32Å; K583-S585 PolarHBondContact O-N 3.32Å; K583-H586 WeakPolarHBondContact O-CB 3.44Å; K583-H586 PolarHBondContact O-N 3.23Å; K583-I587 HydrophobicContact CG-CD1 3.73Å; K583-I587 VanDerWaalsContact O-CG1 3.31Å; K583-I587 WeakPolarHBondContact O-CG1 3.35Å; K583-I587 PolarHBondContact O-N 2.84Å
584	L	93.5	Very high	92.2	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-67	-34	-178.9	-66.4	169.7	0	0	0	111.4	F511 E514 Y515 Y518 L580 K588	F511-L584 HydrophobicContact CB-CD2 4.23Å; F511-L584 HydrophobicContact CD2-CB 3.94Å; F511-L584 HydrophobicContact CD2-CD2 3.56Å; F511-L584 HydrophobicContact CD2-CG 4.36Å; F511-L584 HydrophobicContact CE2-CB 3.71Å; F511-L584 HydrophobicContact CE2-CD2 4.04Å; F511-L584 HydrophobicContact CE2-CG 4.43Å; F511-L584 WeakPolarHBondContact CE2-O 3.38Å; F511-L584 HydrophobicContact CG-CD2 3.92Å; E514-L584 HydrophobicContact CB-CD2 4.23Å; Y515-L584 HydrophobicContact CD2-CD1 4.36Å; Y518-L584 HydrophobicContact CD1-CD1 4.1Å; Y518-L584 HydrophobicContact CG-CD1 3.85Å; L580-L584 HydrophobicContact CB-CD1 4.28Å; L580-L584 WeakPolarHBondContact O-CB 3.4Å; L580-L584 WeakPolarHBondContact O-CG 3.48Å; L580-L584 PolarHBondContact O-N 3.42Å; L584-K588 WeakPolarHBondContact O-CB 3.41Å; L584-K588 PolarHBondContact O-N 3.45Å
585	S	93.9	Very high	92.2	Very high	63 Å²	63	48.6 Å²	48.6	44%	0.441	24%	0.243	S	C	.	.	H	α-helix	trans	-66.1	-39.5	172.2	-169	0	0	0	0	112.5	H581 K582 K583 G589	H581-S585 WeakPolarHBondContact O-CB 3.36Å; H581-S585 PolarHBondContact O-N 2.68Å; K582-S585 PolarHBondContact O-N 2.78Å; K583-S585 VanDerWaalsContact C-N 3.32Å; K583-S585 PolarHBondContact O-N 3.32Å; S585-G589 PolarHBondContact O-N 3.08Å
586	H	93.1	Very high	92.3	Very high	39 Å²	39	48.6 Å²	48.6	18%	0.181	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-53	174.9	177.9	58.9	0	0	0	111.3	Y491 F492 Y495 K582 K583 K588 G589 L590	Y491-H586 HydrophobicContact CD2-CB 3.95Å; Y491-H586 AromaticContact CD2-CD2 3.79Å; Y491-H586 HydrophobicContact CE2-CB 4.09Å; Y491-H586 PolarHBondContact O-CD2 3.44Å; F492-H586 AromaticContact CD1-CE1 3.43Å; F492-H586 VanDerWaalsContact CD1-CE1 3.43Å; F492-H586 WeakPolarHBondContact CD1-CE1 3.34Å; F492-H586 AromaticContact CD1-ND1 3.72Å; F492-H586 AromaticContact CD1-NE2 3.63Å; F492-H586 AromaticContact CE1-CE1 3.63Å; F492-H586 AromaticContact CE1-CG 3.89Å; F492-H586 AromaticContact CE1-ND1 3.43Å; F492-H586 WeakPolarHBondContact CE1-ND1 3.31Å; Y495-H586 PolarHBondContact O-NE2 2.84Å; K582-H586 PolarHBondContact O-N 2.74Å; K583-H586 WeakPolarHBondContact O-CB 3.44Å; K583-H586 PolarHBondContact O-N 3.23Å; H586-K588 VanDerWaalsContact C-N 3.32Å; H586-K588 PolarHBondContact O-N 3.22Å; H586-G589 WeakPolarHBondContact O-CA 3.39Å; H586-G589 PolarHBondContact O-N 3.2Å; H586-L590 WeakPolarHBondContact NE2-CD1 2.95Å; H586-L590 WeakPolarHBondContact O-CG 3.41Å; H586-L590 PolarHBondContact O-N 3.24Å
587	I	92.1	Very high	92.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.4	-44.8	178.4	-63.2	165.9	0	0	0	111	Y495 Y507 F511 K583 G589 L590 I591	Y495-I587 HydrophobicContact CD1-CD1 4.03Å; Y495-I587 HydrophobicContact CD1-CG1 3.76Å; Y495-I587 HydrophobicContact CD2-CD1 3.96Å; Y495-I587 HydrophobicContact CD2-CG1 3.89Å; Y495-I587 HydrophobicContact CE1-CD1 3.76Å; Y495-I587 HydrophobicContact CE1-CG1 4.04Å; Y495-I587 HydrophobicContact CE2-CD1 3.71Å; Y495-I587 HydrophobicContact CE2-CG1 4.17Å; Y495-I587 HydrophobicContact CG-CD1 4.12Å; Y495-I587 HydrophobicContact CG-CG1 3.68Å; Y507-I587 VanDerWaalsContact O-CG2 3.31Å; Y507-I587 WeakPolarHBondContact O-CG2 3.48Å; F511-I587 HydrophobicContact CB-CG2 4.03Å; K583-I587 HydrophobicContact CG-CD1 3.73Å; K583-I587 VanDerWaalsContact O-CG1 3.31Å; K583-I587 WeakPolarHBondContact O-CG1 3.35Å; K583-I587 PolarHBondContact O-N 2.84Å; I587-G589 VanDerWaalsContact C-N 3.33Å; I587-G589 PolarHBondContact O-N 2.92Å; I587-L590 PolarHBondContact O-N 2.92Å; I587-I591 HydrophobicContact CG2-CD1 3.94Å; I587-I591 WeakPolarHBondContact O-CG1 3.42Å; I587-I591 PolarHBondContact O-N 2.94Å
588	K	92.8	Very high	91.5	Very high	92 Å²	92	53.8 Å²	53.8	40%	0.4	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-37	175.8	-176.8	175.1	178.9	177.9	0	112.6	F511 L584 H586 A592	F511-K588 HydrophobicContact CD2-CB 4.33Å; F511-K588 HydrophobicContact CE2-CB 3.95Å; F511-K588 HydrophobicContact CE2-CD 4.44Å; L584-K588 WeakPolarHBondContact O-CB 3.41Å; L584-K588 PolarHBondContact O-N 3.45Å; H586-K588 VanDerWaalsContact C-N 3.32Å; H586-K588 PolarHBondContact O-N 3.22Å; K588-A592 WeakPolarHBondContact O-CB 3.29Å; K588-A592 PolarHBondContact O-N 3.48Å
589	G	92.5	Very high	90.3	Very high	38 Å²	38	52.4 Å²	52.4	39%	0.392	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-47.6	174.2	0	0	0	0	0	112.1	S585 H586 I587 I591 A592 E593	S585-G589 PolarHBondContact O-N 3.08Å; H586-G589 WeakPolarHBondContact O-CA 3.39Å; H586-G589 PolarHBondContact O-N 3.2Å; I587-G589 VanDerWaalsContact C-N 3.33Å; I587-G589 PolarHBondContact O-N 2.92Å; G589-I591 PolarHBondContact O-N 3.24Å; G589-A592 PolarHBondContact O-N 3.43Å; G589-E593 WeakPolarHBondContact O-CB 3.25Å; G589-E593 PolarHBondContact O-N 3.46Å
590	L	93	Very high	88.8	Confident	23 Å²	23	55 Å²	55	12%	0.12	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-41.9	177.5	-66.1	171.1	0	0	0	112.9	Y495 S496 V498 Y507 H586 I587 E593 Y594	Y495-L590 WeakPolarHBondContact O-CD1 3.32Å; S496-L590 WeakPolarHBondContact O-CD1 3.43Å; V498-L590 HydrophobicContact CG2-CB 4.12Å; Y507-L590 HydrophobicContact CD2-CD1 4.45Å; Y507-L590 HydrophobicContact CE2-CD1 4.17Å; H586-L590 WeakPolarHBondContact NE2-CD1 2.95Å; H586-L590 WeakPolarHBondContact O-CG 3.41Å; H586-L590 PolarHBondContact O-N 3.24Å; I587-L590 PolarHBondContact O-N 2.92Å; L590-E593 PolarHBondContact O-N 2.95Å; L590-Y594 PolarHBondContact O-N 3.16Å; L590-Y594 VanDerWaalsContact O-N 3.13Å
591	I	92.1	Very high	86.7	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-45.9	175.3	-66	163.2	0	0	0	110.5	R504 H508 I587 G589 E593 Y594 D595	R504-I591 HydrophobicContact CG-CG2 4.21Å; H508-I591 HydrophobicContact CB-CD1 4.16Å; I587-I591 HydrophobicContact CG2-CD1 3.94Å; I587-I591 WeakPolarHBondContact O-CG1 3.42Å; I587-I591 PolarHBondContact O-N 2.94Å; G589-I591 PolarHBondContact O-N 3.24Å; I591-E593 VanDerWaalsContact C-N 3.29Å; I591-E593 PolarHBondContact O-N 3.35Å; I591-Y594 PolarHBondContact O-N 3.05Å; I591-D595 WeakPolarHBondContact O-CB 3.48Å; I591-D595 VanDerWaalsContact O-CG 3.24Å; I591-D595 PolarHBondContact O-N 2.98Å
592	A	91.8	Very high	84.1	Confident	50 Å²	50	66.4 Å²	66.4	41%	0.413	38%	0.378	S	S	.	.	H	α-helix	trans	-67.8	-26.6	179.1	0	0	0	0	0	113.5	K588 G589 R596	K588-A592 WeakPolarHBondContact O-CB 3.29Å; K588-A592 PolarHBondContact O-N 3.48Å; G589-A592 PolarHBondContact O-N 3.43Å; A592-R596 WeakPolarHBondContact O-CB 3.44Å; A592-R596 PolarHBondContact O-N 2.9Å
593	E	92.1	Very high	83.6	Confident	80 Å²	80	63.3 Å²	63.3	37%	0.374	37%	0.369	S	S	.	.	H	α-helix	trans	-69.4	-44.5	171.8	-167.1	60.6	-144.4	0	0	111.3	G589 L590 I591 R596 T597	G589-E593 WeakPolarHBondContact O-CB 3.25Å; G589-E593 PolarHBondContact O-N 3.46Å; L590-E593 PolarHBondContact O-N 2.95Å; I591-E593 VanDerWaalsContact C-N 3.29Å; I591-E593 PolarHBondContact O-N 3.35Å; E593-R596 IonicContact OE1-CZ 3.57Å; E593-R596 IonicContact OE1-NH1 3.48Å; E593-R596 IonicContact OE1-NH2 2.92Å; E593-R596 PolarHBondContact OE1-NH2 2.95Å; E593-R596 IonicContact OE2-CZ 3.8Å; E593-R596 IonicContact OE2-NH1 2.63Å; E593-R596 PolarHBondContact OE2-NH1 3.24Å; E593-R596 IonicContact OE2-NH2 2.7Å; E593-R596 PolarHBondContact OE2-NH2 3.36Å; E593-T597 WeakPolarHBondContact O-CG2 3.37Å; E593-T597 PolarHBondContact O-N 2.97Å; E593-T597 PolarHBondContact O-OG1 3.44Å
594	Y	91.7	Very high	83.1	Confident	19 Å²	19	65.9 Å²	65.9	8%	0.075	39%	0.386	C	S	.	.	H	α-helix	trans	-66.9	-50.2	176.1	-175.7	-97.9	0	0	0	112.4	V498 L501 R504 L590 I591 R596 T597 Q598	V498-Y594 HydrophobicContact CB-CD2 4.19Å; V498-Y594 HydrophobicContact CB-CG 4.2Å; V498-Y594 HydrophobicContact CG1-CD1 4.17Å; V498-Y594 HydrophobicContact CG1-CD2 3.65Å; V498-Y594 HydrophobicContact CG1-CE2 4.21Å; V498-Y594 HydrophobicContact CG1-CG 3.61Å; V498-Y594 WeakPolarHBondContact O-CD2 3.4Å; L501-Y594 HydrophobicContact CD1-CE1 4.36Å; L501-Y594 PolarHBondContact N-OH 3.35Å; L501-Y594 VanDerWaalsContact N-OH 3.12Å; R504-Y594 HydrophobicContact CB-CD1 3.89Å; R504-Y594 HydrophobicContact CB-CE1 4.01Å; R504-Y594 HydrophobicContact CG-CD1 3.71Å; R504-Y594 HydrophobicContact CG-CE1 4.19Å; L590-Y594 PolarHBondContact O-N 3.16Å; L590-Y594 VanDerWaalsContact O-N 3.13Å; I591-Y594 PolarHBondContact O-N 3.05Å; Y594-R596 PolarHBondContact O-N 2.96Å; Y594-R596 VanDerWaalsContact O-N 3.16Å; Y594-T597 WeakPolarHBondContact CA-OG1 3.46Å; Y594-T597 PolarHBondContact O-N 3.43Å; Y594-T597 VanDerWaalsContact O-N 3.07Å; Y594-T597 PolarHBondContact O-OG1 3.15Å; Y594-T597 VanDerWaalsContact O-OG1 3.06Å; Y594-Q598 HydrophobicContact CD1-CG 3.94Å; Y594-Q598 HydrophobicContact CD2-CG 4.08Å; Y594-Q598 HydrophobicContact CE1-CG 3.6Å; Y594-Q598 HydrophobicContact CE2-CG 3.7Å; Y594-Q598 HydrophobicContact CG-CG 4.21Å; Y594-Q598 VanDerWaalsContact CZ-CG 3.46Å; Y594-Q598 WeakPolarHBondContact O-CG 3.48Å; Y594-Q598 PolarHBondContact O-N 3.26Å
595	D	88.8	Confident	82.5	Confident	22 Å²	22	69.3 Å²	69.3	12%	0.118	41%	0.405	C	S	.	.	H	α-helix	trans	-59	-32.5	179.6	-66.1	-10.9	0	0	0	111.3	R504 I591 G599 L600 V601	R504-D595 IonicContact CZ-OD1 3.62Å; R504-D595 IonicContact CZ-OD2 2.68Å; R504-D595 IonicContact NE-OD1 3.63Å; R504-D595 PolarHBondContact NE-OD1 2.94Å; R504-D595 IonicContact NE-OD2 2.83Å; R504-D595 IonicContact NH2-OD1 3.49Å; R504-D595 PolarHBondContact NH2-OD1 3.31Å; R504-D595 IonicContact NH2-OD2 2.74Å; R504-D595 PolarHBondContact NH2-OD2 3.45Å; I591-D595 WeakPolarHBondContact O-CB 3.48Å; I591-D595 VanDerWaalsContact O-CG 3.24Å; I591-D595 PolarHBondContact O-N 2.98Å; D595-G599 PolarHBondContact O-N 2.69Å; D595-L600 HydrophobicContact CB-CB 4.45Å; D595-L600 PolarHBondContact O-N 3Å; D595-V601 HydrophobicContact CB-CG2 3.98Å
596	R	89.9	Confident	81.8	Confident	150 Å²	150	69.6 Å²	69.6	57%	0.566	40%	0.403	S	S	*	.	H	α-helix	trans	-73.3	-42.3	174.2	-170.4	173.3	82.5	-105.5	5.7	113	A592 E593 Y594 G599	A592-R596 WeakPolarHBondContact O-CB 3.44Å; A592-R596 PolarHBondContact O-N 2.9Å; E593-R596 IonicContact OE1-CZ 3.57Å; E593-R596 IonicContact OE1-NH1 3.48Å; E593-R596 IonicContact OE1-NH2 2.92Å; E593-R596 PolarHBondContact OE1-NH2 2.95Å; E593-R596 IonicContact OE2-CZ 3.8Å; E593-R596 IonicContact OE2-NH1 2.63Å; E593-R596 PolarHBondContact OE2-NH1 3.24Å; E593-R596 IonicContact OE2-NH2 2.7Å; E593-R596 PolarHBondContact OE2-NH2 3.36Å; Y594-R596 PolarHBondContact O-N 2.96Å; Y594-R596 VanDerWaalsContact O-N 3.16Å; R596-G599 PolarHBondContact O-N 3.3Å
597	T	87.3	Confident	81.1	Confident	93 Å²	93	71.6 Å²	71.6	57%	0.571	42%	0.417	S	S	*	.	H	α-helix	trans	-73.9	-25.8	-179.7	46.8	0	0	0	0	113.3	E593 Y594	E593-T597 WeakPolarHBondContact O-CG2 3.37Å; E593-T597 PolarHBondContact O-N 2.97Å; E593-T597 PolarHBondContact O-OG1 3.44Å; Y594-T597 WeakPolarHBondContact CA-OG1 3.46Å; Y594-T597 PolarHBondContact O-N 3.43Å; Y594-T597 VanDerWaalsContact O-N 3.07Å; Y594-T597 PolarHBondContact O-OG1 3.15Å; Y594-T597 VanDerWaalsContact O-OG1 3.06Å
598	Q	80.1	Confident	80.4	Confident	107 Å²	107	76.3 Å²	76.3	50%	0.5	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.6	173.3	-60.9	-58	-40.4	0	0	114.1	Y594 L600	Y594-Q598 HydrophobicContact CD1-CG 3.94Å; Y594-Q598 HydrophobicContact CD2-CG 4.08Å; Y594-Q598 HydrophobicContact CE1-CG 3.6Å; Y594-Q598 HydrophobicContact CE2-CG 3.7Å; Y594-Q598 HydrophobicContact CG-CG 4.21Å; Y594-Q598 VanDerWaalsContact CZ-CG 3.46Å; Y594-Q598 WeakPolarHBondContact O-CG 3.48Å; Y594-Q598 PolarHBondContact O-N 3.26Å; Q598-L600 HydrophobicContact CB-CD1 4.01Å; Q598-L600 HydrophobicContact CB-CG 4.24Å; Q598-L600 PolarHBondContact O-N 2.85Å
599	G	65.3	Low	79.5	Confident	52 Å²	52	75.2 Å²	75.2	54%	0.536	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	18.5	-177.2	0	0	0	0	0	114.7	D595 R596 V601	D595-G599 PolarHBondContact O-N 2.69Å; R596-G599 PolarHBondContact O-N 3.3Å; G599-V601 PolarHBondContact O-N 3.02Å
600	L	59.9	Low	78.5	Confident	113 Å²	113	78.1 Å²	78.1	59%	0.592	45%	0.452	S	S	*	.			trans	-78.4	7.6	-179.8	-79.4	165.6	0	0	0	113.7	D595 Q598	D595-L600 HydrophobicContact CB-CB 4.45Å; D595-L600 PolarHBondContact O-N 3Å; Q598-L600 HydrophobicContact CB-CD1 4.01Å; Q598-L600 HydrophobicContact CB-CG 4.24Å; Q598-L600 PolarHBondContact O-N 2.85Å
601	V	50.8	Low	77.3	Confident	103 Å²	103	82.7 Å²	82.7	62%	0.624	48%	0.48	S	S	*	.			trans	-124.1	115.1	173.4	-172.3	0	0	0	0	109.1	D595 G599	D595-V601 HydrophobicContact CB-CG2 3.98Å; G599-V601 PolarHBondContact O-N 3.02Å
602	S	37.9	Very low	76	Confident	189 Å²	189	88.9 Å²	88.9	100%	1.322	52%	0.517	S	S	*	.			trans	-138.5	0	168.3	-67.6	0	0	0	0	108.8

Retrieved 602 of 602 residues in 593.2 ms (Link to these results)

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