A0A087Y1R3_POEFO Loading...

RBR-type E3 ubiquitin transferase

E3 ubiquitin-protein ligase which accepts ubiquitin from E2 ubiquitin-conjugating enzymes ube2l3 and ube2l6 in the form of a thioester and then directly transfers the ubiquitin to targeted substrates.

AlphaFold DB , UniProt , Accession A0A087Y1R3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 305 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	G	31.9	Very low	33.3	Very low	139 Å²	139	124.8 Å²	124.8	100%	1.433	86%	0.863	S	S	*	*				0	138.9	0	0	0	0	0	0	107.4
2	G	30.1	Very low	33.2	Very low	75 Å²	75	128.9 Å²	128.9	77%	0.773	86%	0.859	S	S	*	*			cis	-177.3	151	5.3	0	0	0	0	0	105.3
3	S	29.7	Very low	32.9	Very low	117 Å²	117	128.8 Å²	128.8	82%	0.818	85%	0.852	S	S	*	*			trans	-60	-169	171.1	-27.8	0	0	0	0	111.7
4	P	44.7	Very low	32.7	Very low	103 Å²	103	132.1 Å²	132.1	67%	0.669	85%	0.846	S	S	*	*			cis	-146.4	-175.8	-14.3	31.4	-6.7	0	0	0	115.8
5	L	32.5	Very low	32.9	Very low	160 Å²	160	135.3 Å²	135.3	84%	0.838	85%	0.848	S	S	*	*			trans	58.5	143.3	138	-72.7	157.6	0	0	0	124.7
6	S	31.3	Very low	33.1	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	84%	0.842	S	S	*	*			trans	121.6	110.1	146.6	68.3	0	0	0	0	114.4
7	C	29.8	Very low	33.2	Very low	111 Å²	111	133.5 Å²	133.5	75%	0.75	84%	0.835	S	S	*	*				77.6	132.8	75.1	-77.4	0	0	0	0	114.7
8	L	35.1	Very low	33.6	Very low	171 Å²	171	131.9 Å²	131.9	90%	0.895	84%	0.837	S	S	*	*			trans	84.9	88.2	158.6	-59.1	132.9	0	0	0	118
9	S	33.5	Very low	33.9	Very low	120 Å²	120	137.1 Å²	137.1	84%	0.839	84%	0.839	S	S	*	*			trans	-90.5	123.2	151.2	58.1	0	0	0	0	109.7
10	C	33.1	Very low	34.2	Very low	131 Å²	131	140.9 Å²	140.9	89%	0.885	84%	0.839	S	S	*	*			trans	-51.9	125.8	-175.7	-65.9	0	0	0	0	114.1
11	V	34.8	Very low	34.7	Very low	135 Å²	135	144.8 Å²	144.8	82%	0.818	84%	0.839	S	S	*	*			trans	-110.1	121.1	149.5	176.7	0	0	0	0	105.9	V13	V11-V13 PolarHBondContact O-N 3.2Å
12	E	31.9	Very low	35	Very low	174 Å²	174	142 Å²	142	81%	0.813	80%	0.796	S	S	*	*			trans	-48.4	119	178.8	-80.1	168	108.5	0	0	111.6	K14	E12-K14 VanDerWaalsContact C-N 3.31Å; E12-K14 PolarHBondContact O-N 3Å
13	V	29.9	Very low	35.8	Very low	127 Å²	127	145.2 Å²	145.2	77%	0.77	80%	0.8	S	S	*	*			trans	-71	93	162.9	179.4	0	0	0	0	107	V11 M15	V11-V13 PolarHBondContact O-N 3.2Å; V13-M15 VanDerWaalsContact C-N 3.34Å; V13-M15 HydrophobicContact CG1-CG 4.28Å; V13-M15 PolarHBondContact O-N 2.89Å
14	K	29.8	Very low	37	Very low	176 Å²	176	149 Å²	149	77%	0.765	80%	0.797	S	S	*	*			trans	-67.4	100.5	157.2	-88	-178.3	178.2	174.5	0	107.2	E12 T16	E12-K14 VanDerWaalsContact C-N 3.31Å; E12-K14 PolarHBondContact O-N 3Å; K14-T16 VanDerWaalsContact C-N 3.31Å; K14-T16 PolarHBondContact O-N 3.22Å
15	M	35.4	Very low	37.1	Very low	179 Å²	179	151.3 Å²	151.3	88%	0.882	80%	0.799	S	S	*	*			trans	-60.5	94.4	163.4	-77.4	-159.3	170	0	0	108.9	V13	V13-M15 VanDerWaalsContact C-N 3.34Å; V13-M15 HydrophobicContact CG1-CG 4.28Å; V13-M15 PolarHBondContact O-N 2.89Å
16	T	35.8	Very low	38.2	Very low	123 Å²	123	151.4 Å²	151.4	76%	0.755	80%	0.799	S	S	*	*			trans	-89.7	106.8	161	38.8	0	0	0	0	107.8	K14 A18	K14-T16 VanDerWaalsContact C-N 3.31Å; K14-T16 PolarHBondContact O-N 3.22Å; T16-A18 PolarHBondContact O-N 3.43Å
17	T	34.9	Very low	39.7	Very low	118 Å²	118	150.4 Å²	150.4	72%	0.724	80%	0.797	S	S	*	*			trans	-21	117	165.8	47	0	0	0	0	113.6	R19	T17-R19 PolarHBondContact O-N 3.04Å
18	A	39.9	Very low	41.4	Very low	105 Å²	105	151.2 Å²	151.2	87%	0.868	80%	0.799	S	S	*	*			trans	-55.5	100.6	164	0	0	0	0	0	108.8	T16 Y20	T16-A18 PolarHBondContact O-N 3.43Å; A18-Y20 PolarHBondContact O-N 3.13Å
19	R	41	Very low	43.1	Very low	229 Å²	229	148.6 Å²	148.6	86%	0.864	79%	0.786	S	S	*	*			trans	-76.4	106.5	166.4	-71.9	-158.8	-171.4	-177	5.2	107.4	T17 R21	T17-R19 PolarHBondContact O-N 3.04Å; R19-R21 PolarHBondContact O-N 2.92Å; R19-R21 VanDerWaalsContact O-N 3.09Å
20	Y	38.3	Very low	45.4	Very low	214 Å²	214	147.1 Å²	147.1	84%	0.839	77%	0.773	S	S	*	*			trans	-51.3	110.3	162.6	-169.8	-97.2	0	0	0	108.7	A18	A18-Y20 PolarHBondContact O-N 3.13Å
21	R	44.3	Very low	48	Very low	222 Å²	222	145 Å²	145	84%	0.838	75%	0.753	S	S	*	*			trans	-95.7	124.8	175	-119.3	-170	-164.2	174.9	5	108.4	R19	R19-R21 PolarHBondContact O-N 2.92Å; R19-R21 VanDerWaalsContact O-N 3.09Å
22	P	39.6	Very low	50.8	Low	82 Å²	82	140.8 Å²	140.8	53%	0.532	73%	0.727	S	S	.	*			trans	-62.6	144.6	174	-16.3	29.1	0	0	0	111.4	W24	P22-W24 VanDerWaalsContact C-N 3.29Å; P22-W24 PolarHBondContact O-N 2.99Å
23	T	46.6	Very low	53.7	Low	141 Å²	141	135.8 Å²	135.8	87%	0.865	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	27.2	-164.3	-7.9	0	0	0	0	116.3
24	W	54.1	Low	56.8	Low	198 Å²	198	129.7 Å²	129.7	75%	0.75	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	8.7	-170.9	63.3	-90.2	0	0	0	117.7	P22	P22-W24 VanDerWaalsContact C-N 3.29Å; P22-W24 PolarHBondContact O-N 2.99Å
25	E	47.9	Very low	59.8	Low	151 Å²	151	127.5 Å²	127.5	71%	0.706	67%	0.665	S	S	*	*			trans	-126.6	72.3	166.4	-73.7	-179.1	172	0	0	110.2	A27	E25-A27 PolarHBondContact O-N 3.02Å; E25-A27 VanDerWaalsContact O-N 3.08Å
26	L	56.2	Low	62.6	Low	161 Å²	161	122.5 Å²	122.5	84%	0.843	64%	0.641	S	S	*	*			trans	-75.4	86.5	159.8	-74.3	165	0	0	0	106.6	V28	L26-V28 VanDerWaalsContact C-N 3.34Å; L26-V28 PolarHBondContact O-N 3.43Å
27	A	62.5	Low	65.4	Low	90 Å²	90	119.4 Å²	119.4	74%	0.744	62%	0.624	S	S	*	*			trans	-58.2	105.2	162.7	0	0	0	0	0	106.6	E25 D29	E25-A27 PolarHBondContact O-N 3.02Å; E25-A27 VanDerWaalsContact O-N 3.08Å; A27-D29 PolarHBondContact O-N 3.1Å; A27-D29 VanDerWaalsContact O-N 3.16Å
28	V	64.3	Low	68.2	Low	128 Å²	128	120.3 Å²	120.3	78%	0.776	62%	0.624	S	S	*	*			trans	-61.7	118	175.7	-169.6	0	0	0	0	106	L26	L26-V28 VanDerWaalsContact C-N 3.34Å; L26-V28 PolarHBondContact O-N 3.43Å
29	D	71.2	Confident	70.7	Confident	117 Å²	117	116.4 Å²	116.4	63%	0.626	59%	0.594	S	S	*	*			trans	-54.4	133.3	178.5	-74.1	-53.3	0	0	0	109.1	A27 L31	A27-D29 PolarHBondContact O-N 3.1Å; A27-D29 VanDerWaalsContact O-N 3.16Å; D29-L31 PolarHBondContact O-N 2.93Å
30	P	81.2	Confident	73.2	Confident	89 Å²	89	112 Å²	112	58%	0.578	58%	0.583	S	S	*	*			trans	-61.4	114.4	-177.3	22.7	-31.1	0	0	0	109.5	L43	P30-L43 HydrophobicContact CG-CD1 4.25Å
31	L	89.1	Confident	75.8	Confident	87 Å²	87	103.9 Å²	103.9	46%	0.455	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77	141.8	174.8	-61.5	175.1	0	0	0	109.8	D29 E40 P42	D29-L31 PolarHBondContact O-N 2.93Å; L31-E40 HydrophobicContact CB-CB 4.16Å; L31-E40 HydrophobicContact CD1-CB 4.23Å; L31-P42 HydrophobicContact CD2-CG 4.01Å
32	V	92.6	Very high	78.1	Confident	45 Å²	45	95.2 Å²	95.2	27%	0.273	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142.3	175.3	-175.8	0	0	0	0	108.3	E40 F41 L43 M46	V32-E40 CarbonylContact O-C 3.57Å; V32-E40 WeakPolarHBondContact O-CA 3.34Å; V32-F41 PolarHBondContact N-O 2.86Å; V32-F41 PolarHBondContact O-N 3.27Å; V32-L43 HydrophobicContact CG2-CD2 3.5Å; V32-L43 HydrophobicContact CG2-CG 4.15Å; V32-M46 HydrophobicContact CB-CE 3.53Å; V32-M46 HydrophobicContact CB-CG 4.24Å; V32-M46 HydrophobicContact CG1-CE 3.78Å; V32-M46 WeakPolarHBondContact O-CE 3.14Å
33	S	93.7	Very high	80.5	Confident	69 Å²	69	96.4 Å²	96.4	48%	0.483	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	131.1	176.9	-179.4	0	0	0	0	111.2	G39	S33-G39 WeakPolarHBondContact CA-O 3.43Å
34	C	95.3	Very high	82.7	Confident	0 Å²	0	98.2 Å²	98.2	0%	0	53%	0.525	C	S	.	.			trans	-86	125.8	172.9	178	0	0	0	0	110.8	L36 L38 G39 F41 M46 C57	C34-L36 VanDerWaalsContact C-N 3.25Å; C34-L36 PolarHBondContact O-N 3.29Å; C34-L36 PolarHBondContact SG-N 2.91Å; C34-L36 VanDerWaalsContact SG-N 3.45Å; C34-L38 WeakPolarHBondContact O-CA 3.13Å; C34-L38 PolarHBondContact O-N 3.3Å; C34-G39 PolarHBondContact N-O 3.3Å; C34-F41 HydrophobicContact CB-CD2 4.08Å; C34-F41 HydrophobicContact CB-CE2 3.97Å; C34-M46 HydrophobicContact CB-CE 4.27Å; C34-C57 HydrophobicContact CB-CB 4.04Å; C34-C57 PolarHBondContact SG-N 3.13Å; C34-C57 VanDerWaalsContact SG-SG 3.65Å
35	K	91.8	Very high	84.5	Confident	129 Å²	129	93.5 Å²	93.5	56%	0.561	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.5	179.6	-57.8	-175.2	-174.4	-175.6	0	115.4	F56 D81	K35-F56 HydrophobicContact CB-CD1 4.46Å; K35-F56 HydrophobicContact CB-CE1 4.17Å; K35-D81 IonicContact NZ-OD2 2.9Å; K35-D81 PolarHBondContact NZ-OD2 3.19Å
36	L	93.7	Very high	86.8	Confident	74 Å²	74	87.2 Å²	87.2	39%	0.387	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-48.1	-178	-70.9	171.9	0	0	0	112.5	C34 F56 C60 P80	C34-L36 VanDerWaalsContact C-N 3.25Å; C34-L36 PolarHBondContact O-N 3.29Å; C34-L36 PolarHBondContact SG-N 2.91Å; C34-L36 VanDerWaalsContact SG-N 3.45Å; L36-F56 HydrophobicContact CD1-CB 4.37Å; L36-F56 HydrophobicContact CD1-CD1 3.68Å; L36-F56 HydrophobicContact CD1-CE1 4.2Å; L36-F56 HydrophobicContact CD1-CG 4.15Å; L36-F56 HydrophobicContact CG-CD1 3.66Å; L36-F56 HydrophobicContact CG-CE1 3.96Å; L36-C60 HydrophobicContact CB-CB 3.86Å; L36-C60 HydrophobicContact CD1-CB 3.73Å; L36-C60 HydrophobicContact CG-CB 4.46Å; L36-P80 HydrophobicContact CD1-CB 3.98Å; L36-P80 HydrophobicContact CD1-CG 4.13Å; L36-P80 HydrophobicContact CD2-CB 3.85Å; L36-P80 HydrophobicContact CG-CB 4.33Å
37	C	95.2	Very high	88.6	Confident	59 Å²	59	81.3 Å²	81.3	40%	0.399	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-4.3	178.1	59.2	0	0	0	0	113.9	G39 F41 C57 C60	C37-G39 PolarHBondContact O-N 3.16Å; C37-G39 VanDerWaalsContact O-N 3.07Å; C37-F41 WeakPolarHBondContact SG-CE2 2.95Å; C37-C57 VanDerWaalsContact SG-SG 3.66Å; C37-C60 VanDerWaalsContact CB-SG 3.52Å
38	L	93.8	Very high	90.2	Very high	137 Å²	137	80 Å²	80	72%	0.717	44%	0.435	S	S	*	.			trans	60.4	11.9	-176.8	-50.7	178	0	0	0	114.6	C34	C34-L38 WeakPolarHBondContact O-CA 3.13Å; C34-L38 PolarHBondContact O-N 3.3Å
39	G	92.3	Very high	91.6	Very high	23 Å²	23	73.9 Å²	73.9	24%	0.237	40%	0.398	C	S	.	.			trans	-83	158.6	175.7	0	0	0	0	0	113.1	S33 C34 C37 F41	S33-G39 WeakPolarHBondContact CA-O 3.43Å; C34-G39 PolarHBondContact N-O 3.3Å; C37-G39 PolarHBondContact O-N 3.16Å; C37-G39 VanDerWaalsContact O-N 3.07Å; G39-F41 VanDerWaalsContact C-CE2 3.42Å; G39-F41 WeakPolarHBondContact O-CD2 3.22Å; G39-F41 WeakPolarHBondContact O-CE2 3.33Å
40	E	94.3	Very high	92.8	Very high	135 Å²	135	71.4 Å²	71.4	63%	0.631	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.8	174.7	-65.3	-171.1	162.8	0	0	110.4	L31 V32	L31-E40 HydrophobicContact CB-CB 4.16Å; L31-E40 HydrophobicContact CD1-CB 4.23Å; V32-E40 CarbonylContact O-C 3.57Å; V32-E40 WeakPolarHBondContact O-CA 3.34Å
41	F	93.1	Very high	93.4	Very high	44 Å²	44	70.8 Å²	70.8	19%	0.193	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.5	-174.7	-57.3	-90.5	0	0	0	111.3	V32 C34 C37 G39 Q45 M46 C57	V32-F41 PolarHBondContact N-O 2.86Å; V32-F41 PolarHBondContact O-N 3.27Å; C34-F41 HydrophobicContact CB-CD2 4.08Å; C34-F41 HydrophobicContact CB-CE2 3.97Å; C37-F41 WeakPolarHBondContact SG-CE2 2.95Å; G39-F41 VanDerWaalsContact C-CE2 3.42Å; G39-F41 WeakPolarHBondContact O-CD2 3.22Å; G39-F41 WeakPolarHBondContact O-CE2 3.33Å; F41-Q45 HydrophobicContact CB-CB 4.23Å; F41-M46 HydrophobicContact CB-CE 3.88Å; F41-M46 HydrophobicContact CB-SD 4.23Å; F41-M46 HydrophobicContact CD2-CE 4.04Å; F41-M46 HydrophobicContact CG-CE 4.45Å; F41-C57 HydrophobicContact CD1-CB 4.37Å; F41-C57 HydrophobicContact CD2-CB 3.62Å; F41-C57 HydrophobicContact CE2-CB 3.77Å; F41-C57 HydrophobicContact CG-CB 3.94Å; F41-C57 HydrophobicContact CZ-CB 4.22Å
42	P	92.7	Very high	93.7	Very high	40 Å²	40	67.1 Å²	67.1	26%	0.26	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	153	168.4	-20.5	32.2	0	0	0	111.4	L31 E44 Q45	L31-P42 HydrophobicContact CD2-CG 4.01Å; P42-E44 PolarHBondContact O-N 2.87Å; P42-E44 VanDerWaalsContact O-N 3.11Å; P42-Q45 PolarHBondContact O-N 2.84Å
43	L	90.3	Very high	93.7	Very high	107 Å²	107	70.6 Å²	70.6	56%	0.56	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-54.4	-31.8	178.4	-74.5	167.9	0	0	0	113.6	P30 V32 Q45 M46	P30-L43 HydrophobicContact CG-CD1 4.25Å; V32-L43 HydrophobicContact CG2-CD2 3.5Å; V32-L43 HydrophobicContact CG2-CG 4.15Å; L43-Q45 PolarHBondContact O-N 2.93Å; L43-M46 WeakPolarHBondContact O-CB 3.36Å; L43-M46 PolarHBondContact O-N 3.36Å; L43-M46 VanDerWaalsContact O-N 3.11Å
44	E	91.2	Very high	93.8	Very high	180 Å²	180	68.1 Å²	68.1	84%	0.841	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24.5	178.3	-58.2	-178.9	174.5	0	0	113.5	P42	P42-E44 PolarHBondContact O-N 2.87Å; P42-E44 VanDerWaalsContact O-N 3.11Å
45	Q	93	Very high	93.8	Very high	98 Å²	98	70.2 Å²	70.2	46%	0.458	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-98.6	8.8	178.4	-60.7	179.4	19.7	0	0	112	F41 P42 L43 C57 T58	F41-Q45 HydrophobicContact CB-CB 4.23Å; P42-Q45 PolarHBondContact O-N 2.84Å; L43-Q45 PolarHBondContact O-N 2.93Å; Q45-C57 CarbonylContact O-C 3.58Å; Q45-C57 VanDerWaalsContact O-CA 3.31Å; Q45-C57 WeakPolarHBondContact O-CA 3.33Å; Q45-T58 PolarHBondContact O-N 3.01Å; Q45-T58 PolarHBondContact O-OG1 3.29Å; Q45-T58 VanDerWaalsContact O-OG1 3.11Å
46	M	94.8	Very high	94	Very high	20 Å²	20	64.1 Å²	64.1	10%	0.099	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	146.3	177	-67.5	-60.7	-157.2	0	0	110.7	V32 C34 F41 L43 V55 F56 C57	V32-M46 HydrophobicContact CB-CE 3.53Å; V32-M46 HydrophobicContact CB-CG 4.24Å; V32-M46 HydrophobicContact CG1-CE 3.78Å; V32-M46 WeakPolarHBondContact O-CE 3.14Å; C34-M46 HydrophobicContact CB-CE 4.27Å; F41-M46 HydrophobicContact CB-CE 3.88Å; F41-M46 HydrophobicContact CB-SD 4.23Å; F41-M46 HydrophobicContact CD2-CE 4.04Å; F41-M46 HydrophobicContact CG-CE 4.45Å; L43-M46 WeakPolarHBondContact O-CB 3.36Å; L43-M46 PolarHBondContact O-N 3.36Å; L43-M46 VanDerWaalsContact O-N 3.11Å; M46-V55 HydrophobicContact CB-CG1 3.7Å; M46-V55 HydrophobicContact CG-CG1 4.13Å; M46-V55 HydrophobicContact SD-CG1 4.27Å; M46-F56 CarbonylContact C-O 3.6Å; M46-F56 WeakPolarHBondContact CA-O 3.25Å; M46-C57 WeakPolarHBondContact SD-CA 3.48Å; M46-C57 HydrophobicContact SD-CB 3.89Å; M46-C57 PolarHBondContact SD-N 2.87Å
47	T	95.1	Very high	94.1	Very high	36 Å²	36	60.8 Å²	60.8	22%	0.221	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.5	176	-55.7	0	0	0	0	108.9	V55 F56 T58 L61	T47-V55 WeakPolarHBondContact O-CA 3.44Å; T47-F56 PolarHBondContact N-O 2.76Å; T47-F56 PolarHBondContact O-N 3.1Å; T47-T58 WeakPolarHBondContact OG1-CB 3.43Å; T47-T58 PolarHBondContact OG1-OG1 3.5Å; T47-L61 HydrophobicContact CG2-CD2 3.72Å
48	T	94.8	Very high	94.2	Very high	62 Å²	62	59.5 Å²	59.5	38%	0.38	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.6	179.8	-55.4	0	0	0	0	109.3	T50 Q53 C54 V55	T48-T50 PolarHBondContact O-N 2.9Å; T48-Q53 HydrophobicContact CG2-CB 4.46Å; T48-C54 WeakPolarHBondContact CA-O 3.46Å; T48-V55 HydrophobicContact CG2-CG2 4.13Å
49	I	95.5	Very high	94.3	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	31%	0.308	C	S	.	.			trans	-76.8	121.1	174.2	-58.2	170	0	0	0	108.6	Q51 C52 Q53 C54 F56 L61 C79 L90	I49-Q51 PolarHBondContact O-N 3.23Å; I49-C52 VanDerWaalsContact CG2-SG 3.56Å; I49-C52 PolarHBondContact O-N 2.87Å; I49-Q53 VanDerWaalsContact O-CA 3.24Å; I49-Q53 WeakPolarHBondContact O-CA 3.41Å; I49-Q53 PolarHBondContact O-N 2.79Å; I49-C54 PolarHBondContact N-O 2.92Å; I49-F56 HydrophobicContact CD1-CD2 4.16Å; I49-F56 HydrophobicContact CD1-CE2 3.73Å; I49-L61 HydrophobicContact CD1-CD1 4.35Å; I49-L61 HydrophobicContact CG1-CD2 4.27Å; I49-C79 HydrophobicContact CD1-CB 4.2Å; I49-L90 HydrophobicContact CD1-CD1 3.73Å; I49-L90 HydrophobicContact CG1-CD1 4.14Å; I49-L90 HydrophobicContact CG1-CG 4.46Å; I49-L90 HydrophobicContact CG2-CD1 4.2Å; I49-L90 HydrophobicContact CG2-CG 4.47Å
50	T	94.8	Very high	94.5	Very high	64 Å²	64	58.3 Å²	58.3	39%	0.393	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-43	-174.3	50.2	0	0	0	0	113.7	T48 Q53 E94	T48-T50 PolarHBondContact O-N 2.9Å; T50-Q53 PolarHBondContact O-NE2 3.08Å; T50-E94 WeakPolarHBondContact CB-OE1 2.88Å; T50-E94 VanDerWaalsContact CG2-OE1 3.23Å; T50-E94 WeakPolarHBondContact CG2-OE1 3.29Å; T50-E94 PolarHBondContact N-OE1 2.92Å; T50-E94 VanDerWaalsContact OG1-CD 3.24Å; T50-E94 PolarHBondContact OG1-OE1 3.38Å; T50-E94 PolarHBondContact OG1-OE2 2.94Å
51	Q	94.6	Very high	94.6	Very high	77 Å²	77	51.9 Å²	51.9	36%	0.36	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-37.9	-175.8	-65.9	-169	24.5	0	0	113.8	I49 K86 H89 Q91	I49-Q51 PolarHBondContact O-N 3.23Å; Q51-K86 WeakPolarHBondContact O-CD 3.06Å; Q51-H89 VanDerWaalsContact CG-O 3.31Å; Q51-H89 WeakPolarHBondContact CG-O 3.28Å; Q51-H89 PolarHBondContact NE2-O 3.4Å; Q51-Q91 HydrophobicContact CG-CG 4.4Å
52	C	94.5	Very high	94.7	Very high	10 Å²	10	53.4 Å²	53.4	7%	0.068	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-12.5	-174	57.6	0	0	0	0	115.3	I49 C54 C79 C84 K86	I49-C52 VanDerWaalsContact CG2-SG 3.56Å; I49-C52 PolarHBondContact O-N 2.87Å; C52-C54 PolarHBondContact O-N 2.96Å; C52-C54 VanDerWaalsContact SG-SG 3.68Å; C52-C79 VanDerWaalsContact SG-SG 3.62Å; C52-C84 WeakPolarHBondContact CB-SG 3.31Å; C52-K86 HydrophobicContact CB-CB 4.16Å
53	Q	94.6	Very high	94.9	Very high	118 Å²	118	57.7 Å²	57.7	55%	0.551	30%	0.296	S	S	*	.			trans	60.6	17.2	-174.1	-55.2	-66.5	-39	0	0	113.6	T48 I49 T50	T48-Q53 HydrophobicContact CG2-CB 4.46Å; I49-Q53 VanDerWaalsContact O-CA 3.24Å; I49-Q53 WeakPolarHBondContact O-CA 3.41Å; I49-Q53 PolarHBondContact O-N 2.79Å; T50-Q53 PolarHBondContact O-NE2 3.08Å
54	C	94.4	Very high	95.1	Very high	16 Å²	16	55.2 Å²	55.2	11%	0.108	28%	0.28	C	S	.	.			trans	-71	140.5	171.1	-65.5	0	0	0	0	109.7	T48 I49 C52 F56	T48-C54 WeakPolarHBondContact CA-O 3.46Å; I49-C54 PolarHBondContact N-O 2.92Å; C52-C54 PolarHBondContact O-N 2.96Å; C52-C54 VanDerWaalsContact SG-SG 3.68Å; C54-F56 HydrophobicContact CB-CE2 3.64Å; C54-F56 HydrophobicContact CB-CZ 4.07Å
55	V	94.7	Very high	95.3	Very high	45 Å²	45	46.6 Å²	46.6	27%	0.273	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.4	-174.3	-172.6	0	0	0	0	110	M46 T47 T48	M46-V55 HydrophobicContact CB-CG1 3.7Å; M46-V55 HydrophobicContact CG-CG1 4.13Å; M46-V55 HydrophobicContact SD-CG1 4.27Å; T47-V55 WeakPolarHBondContact O-CA 3.44Å; T48-V55 HydrophobicContact CG2-CG2 4.13Å
56	F	96.5	Very high	95.3	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.2	176.7	-53.9	-87.1	0	0	0	109.7	K35 L36 M46 T47 I49 C54 L61 P80 D81	K35-F56 HydrophobicContact CB-CD1 4.46Å; K35-F56 HydrophobicContact CB-CE1 4.17Å; L36-F56 HydrophobicContact CD1-CB 4.37Å; L36-F56 HydrophobicContact CD1-CD1 3.68Å; L36-F56 HydrophobicContact CD1-CE1 4.2Å; L36-F56 HydrophobicContact CD1-CG 4.15Å; L36-F56 HydrophobicContact CG-CD1 3.66Å; L36-F56 HydrophobicContact CG-CE1 3.96Å; M46-F56 CarbonylContact C-O 3.6Å; M46-F56 WeakPolarHBondContact CA-O 3.25Å; T47-F56 PolarHBondContact N-O 2.76Å; T47-F56 PolarHBondContact O-N 3.1Å; I49-F56 HydrophobicContact CD1-CD2 4.16Å; I49-F56 HydrophobicContact CD1-CE2 3.73Å; C54-F56 HydrophobicContact CB-CE2 3.64Å; C54-F56 HydrophobicContact CB-CZ 4.07Å; F56-L61 HydrophobicContact CB-CB 4.46Å; F56-L61 HydrophobicContact CD2-CD1 4.35Å; F56-P80 HydrophobicContact CD2-CG 4.46Å; F56-P80 HydrophobicContact CE1-CB 4.16Å; F56-P80 HydrophobicContact CE1-CG 4.42Å; F56-P80 HydrophobicContact CE2-CG 4.07Å; F56-P80 HydrophobicContact CZ-CB 3.98Å; F56-P80 HydrophobicContact CZ-CG 4.02Å; F56-D81 HydrophobicContact CE1-CB 4.49Å; F56-D81 HydrophobicContact CZ-CB 3.88Å
57	C	96.8	Very high	95.3	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	143.2	171.8	72.4	0	0	0	0	109.7	C34 C37 F41 Q45 M46 L59 C60 L61	C34-C57 HydrophobicContact CB-CB 4.04Å; C34-C57 PolarHBondContact SG-N 3.13Å; C34-C57 VanDerWaalsContact SG-SG 3.65Å; C37-C57 VanDerWaalsContact SG-SG 3.66Å; F41-C57 HydrophobicContact CD1-CB 4.37Å; F41-C57 HydrophobicContact CD2-CB 3.62Å; F41-C57 HydrophobicContact CE2-CB 3.77Å; F41-C57 HydrophobicContact CG-CB 3.94Å; F41-C57 HydrophobicContact CZ-CB 4.22Å; Q45-C57 CarbonylContact O-C 3.58Å; Q45-C57 VanDerWaalsContact O-CA 3.31Å; Q45-C57 WeakPolarHBondContact O-CA 3.33Å; M46-C57 WeakPolarHBondContact SD-CA 3.48Å; M46-C57 HydrophobicContact SD-CB 3.89Å; M46-C57 PolarHBondContact SD-N 2.87Å; C57-L59 PolarHBondContact O-N 3.34Å; C57-C60 PolarHBondContact O-N 2.9Å; C57-C60 PolarHBondContact SG-SG 2.98Å; C57-L61 PolarHBondContact O-N 3.26Å; C57-L61 VanDerWaalsContact O-N 3.13Å
58	T	95.9	Very high	95.1	Very high	33 Å²	33	47.6 Å²	47.6	20%	0.202	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-36.5	-174.2	-55.3	0	0	0	0	111.6	Q45 T47 L61 K62	Q45-T58 PolarHBondContact O-N 3.01Å; Q45-T58 PolarHBondContact O-OG1 3.29Å; Q45-T58 VanDerWaalsContact O-OG1 3.11Å; T47-T58 WeakPolarHBondContact OG1-CB 3.43Å; T47-T58 PolarHBondContact OG1-OG1 3.5Å; T58-L61 PolarHBondContact O-N 3.16Å; T58-K62 HydrophobicContact CG2-CD 4.1Å; T58-K62 HydrophobicContact CG2-CG 4.33Å; T58-K62 WeakPolarHBondContact O-CB 3.44Å; T58-K62 VanDerWaalsContact O-CG 3.22Å; T58-K62 WeakPolarHBondContact O-CG 3.43Å; T58-K62 PolarHBondContact O-N 3.24Å
59	L	96	Very high	95	Very high	115 Å²	115	44.8 Å²	44.8	60%	0.602	23%	0.227	S	C	*	.	H	α-helix	trans	-63.3	-48.9	179.2	-66.2	175.3	0	0	0	112.4	C57 L61 K62 Q63	C57-L59 PolarHBondContact O-N 3.34Å; L59-L61 PolarHBondContact O-N 3.02Å; L59-K62 PolarHBondContact O-N 3.29Å; L59-Q63 WeakPolarHBondContact O-CG 3.44Å; L59-Q63 PolarHBondContact O-N 3.21Å
60	C	97	Very high	94.7	Very high	20 Å²	20	50.4 Å²	50.4	14%	0.135	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-41.5	179.1	-74.3	0	0	0	0	111.8	L36 C37 C57 Q63 Y64	L36-C60 HydrophobicContact CB-CB 3.86Å; L36-C60 HydrophobicContact CD1-CB 3.73Å; L36-C60 HydrophobicContact CG-CB 4.46Å; C37-C60 VanDerWaalsContact CB-SG 3.52Å; C57-C60 PolarHBondContact O-N 2.9Å; C57-C60 PolarHBondContact SG-SG 2.98Å; C60-Q63 PolarHBondContact O-N 2.97Å; C60-Y64 WeakPolarHBondContact O-CB 3.39Å; C60-Y64 PolarHBondContact O-N 3.36Å
61	L	96.1	Very high	94.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-40.6	179.9	-166.6	61.6	0	0	0	111.4	T47 I49 F56 C57 T58 L59 Y64 V65 P80 L90 M98	T47-L61 HydrophobicContact CG2-CD2 3.72Å; I49-L61 HydrophobicContact CD1-CD1 4.35Å; I49-L61 HydrophobicContact CG1-CD2 4.27Å; F56-L61 HydrophobicContact CB-CB 4.46Å; F56-L61 HydrophobicContact CD2-CD1 4.35Å; C57-L61 PolarHBondContact O-N 3.26Å; C57-L61 VanDerWaalsContact O-N 3.13Å; T58-L61 PolarHBondContact O-N 3.16Å; L59-L61 PolarHBondContact O-N 3.02Å; L61-Y64 HydrophobicContact CD1-CD1 4.3Å; L61-Y64 PolarHBondContact O-N 3.48Å; L61-V65 VanDerWaalsContact O-CG2 3.24Å; L61-V65 WeakPolarHBondContact O-CG2 3.44Å; L61-V65 PolarHBondContact O-N 3.31Å; L61-P80 HydrophobicContact CD1-CG 3.83Å; L61-L90 HydrophobicContact CD1-CD2 4.23Å; L61-L90 HydrophobicContact CG-CD2 4.47Å; L61-M98 HydrophobicContact CB-SD 4.21Å; L61-M98 HydrophobicContact CD2-CE 4.12Å; L61-M98 HydrophobicContact CD2-SD 3.62Å; L61-M98 HydrophobicContact CG-CE 4.38Å; L61-M98 HydrophobicContact CG-SD 3.62Å
62	K	95.9	Very high	93.9	Very high	75 Å²	75	49.6 Å²	49.6	33%	0.326	25%	0.249	S	C	.	.	H	α-helix	trans	-58.4	-50.7	173.3	-77.1	-177.1	171.2	-173.2	0	112.3	T58 L59 Y64 V65 E66 M98	T58-K62 HydrophobicContact CG2-CD 4.1Å; T58-K62 HydrophobicContact CG2-CG 4.33Å; T58-K62 WeakPolarHBondContact O-CB 3.44Å; T58-K62 VanDerWaalsContact O-CG 3.22Å; T58-K62 WeakPolarHBondContact O-CG 3.43Å; T58-K62 PolarHBondContact O-N 3.24Å; L59-K62 PolarHBondContact O-N 3.29Å; K62-Y64 VanDerWaalsContact C-N 3.3Å; K62-Y64 PolarHBondContact O-N 3.43Å; K62-V65 PolarHBondContact O-N 2.87Å; K62-E66 WeakPolarHBondContact O-CB 3.33Å; K62-E66 WeakPolarHBondContact O-CG 3.29Å; K62-E66 PolarHBondContact O-N 2.95Å; K62-M98 HydrophobicContact CG-CB 3.92Å; K62-M98 HydrophobicContact CG-CG 4.05Å; K62-M98 WeakPolarHBondContact CG-O 3.32Å
63	Q	95.9	Very high	92.7	Very high	130 Å²	130	53.4 Å²	53.4	61%	0.607	27%	0.268	S	S	*	.	H	α-helix	trans	-59.6	-42.2	179.1	-73.6	175.3	-10.7	0	0	112.1	L59 C60 E66 L67	L59-Q63 WeakPolarHBondContact O-CG 3.44Å; L59-Q63 PolarHBondContact O-N 3.21Å; C60-Q63 PolarHBondContact O-N 2.97Å; Q63-E66 PolarHBondContact O-N 3.24Å; Q63-L67 VanDerWaalsContact O-CB 3.3Å; Q63-L67 WeakPolarHBondContact O-CB 3.47Å; Q63-L67 PolarHBondContact O-N 3.24Å
64	Y	95	Very high	91.6	Very high	55 Å²	55	50.7 Å²	50.7	22%	0.216	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-48	176.3	171.5	-103.2	0	0	0	112.1	C60 L61 K62 L67 L68 I77 S78 P80	C60-Y64 WeakPolarHBondContact O-CB 3.39Å; C60-Y64 PolarHBondContact O-N 3.36Å; L61-Y64 HydrophobicContact CD1-CD1 4.3Å; L61-Y64 PolarHBondContact O-N 3.48Å; K62-Y64 VanDerWaalsContact C-N 3.3Å; K62-Y64 PolarHBondContact O-N 3.43Å; Y64-L67 PolarHBondContact O-N 3.44Å; Y64-L68 HydrophobicContact CD1-CD1 4.19Å; Y64-L68 HydrophobicContact CD2-CD1 4.25Å; Y64-L68 HydrophobicContact CE1-CD1 3.58Å; Y64-L68 HydrophobicContact CE2-CD1 3.64Å; Y64-L68 HydrophobicContact CE2-CG 4.26Å; Y64-L68 WeakPolarHBondContact O-CG 3.36Å; Y64-L68 PolarHBondContact O-N 3.48Å; Y64-L68 VanDerWaalsContact O-N 3.11Å; Y64-L68 WeakPolarHBondContact OH-CD1 3.26Å; Y64-I77 HydrophobicContact CD1-CG2 4.33Å; Y64-I77 HydrophobicContact CE1-CG2 3.71Å; Y64-S78 VanDerWaalsContact CE1-O 3.25Å; Y64-S78 WeakPolarHBondContact CE1-O 2.9Å; Y64-S78 PolarHBondContact OH-O 2.91Å; Y64-P80 HydrophobicContact CD1-CG 3.72Å; Y64-P80 HydrophobicContact CE1-CB 4.39Å; Y64-P80 HydrophobicContact CE1-CG 3.66Å; Y64-P80 HydrophobicContact CE2-CB 4.42Å; Y64-P80 HydrophobicContact CE2-CG 4.49Å; Y64-P80 HydrophobicContact CG-CG 4.14Å
65	V	95	Very high	90.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-47.3	177.8	172.4	0	0	0	0	110.9	L61 K62 L67 L68 I69 I77 L90 I95 M98 V99	L61-V65 VanDerWaalsContact O-CG2 3.24Å; L61-V65 WeakPolarHBondContact O-CG2 3.44Å; L61-V65 PolarHBondContact O-N 3.31Å; K62-V65 PolarHBondContact O-N 2.87Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 3.49Å; V65-L68 PolarHBondContact O-N 2.95Å; V65-I69 HydrophobicContact CG1-CD1 3.71Å; V65-I69 VanDerWaalsContact O-CG1 3.28Å; V65-I69 WeakPolarHBondContact O-CG1 3.31Å; V65-I69 PolarHBondContact O-N 3.3Å; V65-I77 HydrophobicContact CB-CD1 4.49Å; V65-I77 HydrophobicContact CG1-CD1 3.82Å; V65-I77 HydrophobicContact CG2-CG2 4.37Å; V65-L90 HydrophobicContact CG2-CD2 3.34Å; V65-I95 HydrophobicContact CG1-CG1 4.4Å; V65-I95 HydrophobicContact CG1-CG2 3.88Å; V65-M98 HydrophobicContact CG2-CE 4.21Å; V65-M98 HydrophobicContact CG2-SD 4.25Å; V65-V99 HydrophobicContact CB-CG1 4.37Å; V65-V99 HydrophobicContact CG1-CG1 3.51Å
66	E	94.6	Very high	90.5	Very high	62 Å²	62	50.9 Å²	50.9	29%	0.29	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-41	178.5	-74.6	-178.4	-178.2	0	0	112.6	K62 Q63 I69 K70 V99 M103	K62-E66 WeakPolarHBondContact O-CB 3.33Å; K62-E66 WeakPolarHBondContact O-CG 3.29Å; K62-E66 PolarHBondContact O-N 2.95Å; Q63-E66 PolarHBondContact O-N 3.24Å; E66-I69 PolarHBondContact O-N 3.25Å; E66-K70 WeakPolarHBondContact O-CB 3.45Å; E66-K70 VanDerWaalsContact O-CG 3.27Å; E66-K70 WeakPolarHBondContact O-CG 3.39Å; E66-K70 PolarHBondContact O-N 2.94Å; E66-V99 HydrophobicContact CG-CG1 4.01Å; E66-M103 HydrophobicContact CB-CE 4.33Å; E66-M103 WeakPolarHBondContact O-CE 3.35Å
67	L	92.9	Very high	90.3	Very high	91 Å²	91	50.9 Å²	50.9	48%	0.476	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-49.6	177.7	-179.6	67.1	0	0	0	110.8	Q63 Y64 V65 I69 K70 E71	Q63-L67 VanDerWaalsContact O-CB 3.3Å; Q63-L67 WeakPolarHBondContact O-CB 3.47Å; Q63-L67 PolarHBondContact O-N 3.24Å; Y64-L67 PolarHBondContact O-N 3.44Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 3.49Å; L67-I69 VanDerWaalsContact C-N 3.34Å; L67-I69 PolarHBondContact O-N 3.4Å; L67-K70 WeakPolarHBondContact O-CB 3.46Å; L67-K70 PolarHBondContact O-N 3.36Å; L67-K70 VanDerWaalsContact O-N 3.1Å; L67-E71 WeakPolarHBondContact O-CG 3.44Å; L67-E71 PolarHBondContact O-N 3.29Å
68	L	91.3	Very high	90.1	Very high	22 Å²	22	52.5 Å²	52.5	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-64.8	-37	-179.1	-70.6	177	0	0	0	112.8	Y64 V65 K70 E71 G72 I77	Y64-L68 HydrophobicContact CD1-CD1 4.19Å; Y64-L68 HydrophobicContact CD2-CD1 4.25Å; Y64-L68 HydrophobicContact CE1-CD1 3.58Å; Y64-L68 HydrophobicContact CE2-CD1 3.64Å; Y64-L68 HydrophobicContact CE2-CG 4.26Å; Y64-L68 WeakPolarHBondContact O-CG 3.36Å; Y64-L68 PolarHBondContact O-N 3.48Å; Y64-L68 VanDerWaalsContact O-N 3.11Å; Y64-L68 WeakPolarHBondContact OH-CD1 3.26Å; V65-L68 PolarHBondContact O-N 2.95Å; L68-K70 VanDerWaalsContact C-N 3.34Å; L68-E71 PolarHBondContact O-N 2.96Å; L68-G72 PolarHBondContact O-N 2.87Å; L68-I77 HydrophobicContact CB-CG1 4.5Å; L68-I77 HydrophobicContact CD1-CB 4.48Å; L68-I77 HydrophobicContact CD1-CG1 4.46Å; L68-I77 HydrophobicContact CD1-CG2 3.71Å
69	I	93.1	Very high	90	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-35.7	174	-65.3	167.8	0	0	0	111.2	V65 E66 L67 I77 I95 V99 M103 R106 Y107	V65-I69 HydrophobicContact CG1-CD1 3.71Å; V65-I69 VanDerWaalsContact O-CG1 3.28Å; V65-I69 WeakPolarHBondContact O-CG1 3.31Å; V65-I69 PolarHBondContact O-N 3.3Å; E66-I69 PolarHBondContact O-N 3.25Å; L67-I69 VanDerWaalsContact C-N 3.34Å; L67-I69 PolarHBondContact O-N 3.4Å; I69-I77 HydrophobicContact CD1-CD1 4.27Å; I69-I77 HydrophobicContact CG1-CD1 3.96Å; I69-I95 HydrophobicContact CD1-CG2 4.01Å; I69-V99 HydrophobicContact CD1-CG1 4.01Å; I69-V99 HydrophobicContact CD1-CG2 4.47Å; I69-M103 HydrophobicContact CB-CE 3.8Å; I69-M103 HydrophobicContact CG2-CE 3.59Å; I69-M103 WeakPolarHBondContact CG2-O 3.48Å; I69-R106 HydrophobicContact CG2-CB 4.25Å; I69-R106 HydrophobicContact CG2-CG 4.15Å; I69-R106 PolarHBondContact O-NE 3.3Å; I69-Y107 HydrophobicContact CD1-CD2 4.36Å; I69-Y107 HydrophobicContact CD1-CG 4.37Å; I69-Y107 HydrophobicContact CG1-CD2 3.94Å; I69-Y107 HydrophobicContact CG1-CG 4.37Å
70	K	90.1	Very high	89.9	Confident	119 Å²	119	47.4 Å²	47.4	52%	0.517	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-49.6	175.4	-76.8	170.8	-174.8	168	0	110.8	E66 L67 L68 G72 M103 R106	E66-K70 WeakPolarHBondContact O-CB 3.45Å; E66-K70 VanDerWaalsContact O-CG 3.27Å; E66-K70 WeakPolarHBondContact O-CG 3.39Å; E66-K70 PolarHBondContact O-N 2.94Å; L67-K70 WeakPolarHBondContact O-CB 3.46Å; L67-K70 PolarHBondContact O-N 3.36Å; L67-K70 VanDerWaalsContact O-N 3.1Å; L68-K70 VanDerWaalsContact C-N 3.34Å; K70-G72 VanDerWaalsContact C-N 3.33Å; K70-G72 PolarHBondContact O-N 3.39Å; K70-M103 HydrophobicContact CD-CE 4.41Å; K70-M103 HydrophobicContact CG-CE 3.67Å; K70-R106 PolarHBondContact O-NH2 3.18Å
71	E	88.4	Confident	89.7	Confident	102 Å²	102	47.6 Å²	47.6	48%	0.477	25%	0.247	S	C	.	.	H	α-helix	trans	-62.1	-39	179.2	-71.8	-179.6	176.3	0	0	112.3	L67 L68 L73	L67-E71 WeakPolarHBondContact O-CG 3.44Å; L67-E71 PolarHBondContact O-N 3.29Å; L68-E71 PolarHBondContact O-N 2.96Å; E71-L73 HydrophobicContact CB-CD1 4.49Å; E71-L73 HydrophobicContact CB-CG 4.36Å; E71-L73 PolarHBondContact O-N 3.43Å; E71-L73 VanDerWaalsContact O-N 3.15Å
72	G	82.6	Confident	89.2	Confident	22 Å²	22	53.9 Å²	53.9	23%	0.227	29%	0.291	C	S	.	.			trans	65.8	13.7	175.4	0	0	0	0	0	114.9	L68 K70	L68-G72 PolarHBondContact O-N 2.87Å; K70-G72 VanDerWaalsContact C-N 3.33Å; K70-G72 PolarHBondContact O-N 3.39Å
73	L	69.5	Low	88.8	Confident	90 Å²	90	54.1 Å²	54.1	47%	0.471	31%	0.306	S	S	.	.	S	Bend	trans	-77.4	-27.4	-180	-64.7	174.7	0	0	0	112.6	E71	E71-L73 HydrophobicContact CB-CD1 4.49Å; E71-L73 HydrophobicContact CB-CG 4.36Å; E71-L73 PolarHBondContact O-N 3.43Å; E71-L73 VanDerWaalsContact O-N 3.15Å
74	E	72.8	Confident	88.5	Confident	62 Å²	62	48.3 Å²	48.3	29%	0.29	28%	0.28	S	S	.	.			trans	-130.6	132.2	-179.7	-58.7	-164.8	167	0	0	110.7	K220	E74-K220 IonicContact OE1-NZ 2.67Å; E74-K220 PolarHBondContact OE1-NZ 3.02Å
75	T	78.9	Confident	88.1	Confident	19 Å²	19	51.3 Å²	51.3	12%	0.117	31%	0.306	C	S	.	.	S	Bend	trans	-94.5	-18.4	177.6	58.4	0	0	0	0	112.7	Y107 L110 R114	T75-Y107 WeakPolarHBondContact O-CE2 3.37Å; T75-Y107 PolarHBondContact O-OH 3.11Å; T75-L110 HydrophobicContact CG2-CB 4.3Å; T75-L110 WeakPolarHBondContact CG2-O 3.44Å; T75-R114 HydrophobicContact CG2-CB 3.85Å; T75-R114 HydrophobicContact CG2-CG 4.35Å; T75-R114 WeakPolarHBondContact OG1-CD 3.28Å; T75-R114 PolarHBondContact OG1-NE 3.5Å; T75-R114 PolarHBondContact OG1-NH1 3.37Å
76	A	87	Confident	87.9	Confident	46 Å²	46	58 Å²	58	38%	0.38	34%	0.335	S	S	.	.	S	Bend	trans	-104	106.1	174	0	0	0	0	0	108.3	S78	A76-S78 PolarHBondContact O-N 3.23Å
77	I	91.6	Very high	87.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	36%	0.359	C	S	.	.			trans	-76.8	109.9	-177.3	-61.2	-179	0	0	0	108.5	Y64 V65 L68 I69 H89 L90 I95 Y107	Y64-I77 HydrophobicContact CD1-CG2 4.33Å; Y64-I77 HydrophobicContact CE1-CG2 3.71Å; V65-I77 HydrophobicContact CB-CD1 4.49Å; V65-I77 HydrophobicContact CG1-CD1 3.82Å; V65-I77 HydrophobicContact CG2-CG2 4.37Å; L68-I77 HydrophobicContact CB-CG1 4.5Å; L68-I77 HydrophobicContact CD1-CB 4.48Å; L68-I77 HydrophobicContact CD1-CG1 4.46Å; L68-I77 HydrophobicContact CD1-CG2 3.71Å; I69-I77 HydrophobicContact CD1-CD1 4.27Å; I69-I77 HydrophobicContact CG1-CD1 3.96Å; I77-H89 CarbonylContact O-C 3.56Å; I77-H89 VanDerWaalsContact O-CA 3.32Å; I77-H89 WeakPolarHBondContact O-CA 3.39Å; I77-L90 HydrophobicContact CB-CB 4.36Å; I77-L90 HydrophobicContact CG2-CB 4.38Å; I77-L90 HydrophobicContact CG2-CD1 4.13Å; I77-L90 HydrophobicContact CG2-CD2 4.02Å; I77-L90 HydrophobicContact CG2-CG 4.42Å; I77-L90 PolarHBondContact O-N 2.99Å; I77-I95 HydrophobicContact CB-CD1 4.43Å; I77-I95 HydrophobicContact CD1-CD1 3.85Å; I77-I95 HydrophobicContact CD1-CG1 4.25Å; I77-I95 HydrophobicContact CG1-CD1 4.33Å; I77-Y107 HydrophobicContact CD1-CD2 4.49Å; I77-Y107 HydrophobicContact CD1-CE2 4.12Å; I77-Y107 HydrophobicContact CG1-CE2 4.2Å
78	S	92.5	Very high	87.4	Confident	36 Å²	36	60.7 Å²	60.7	25%	0.252	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-81.5	156.7	-177.9	-58.7	0	0	0	0	111.8	Y64 A76 H89	Y64-S78 VanDerWaalsContact CE1-O 3.25Å; Y64-S78 WeakPolarHBondContact CE1-O 2.9Å; Y64-S78 PolarHBondContact OH-O 2.91Å; A76-S78 PolarHBondContact O-N 3.23Å; S78-H89 PolarHBondContact OG-CE1 2.89Å; S78-H89 PolarHBondContact OG-ND1 3.15Å
79	C	94.8	Very high	87.5	Confident	14 Å²	14	63.1 Å²	63.1	10%	0.095	35%	0.348	C	S	.	.			trans	-53.3	134	173.1	-178.7	0	0	0	0	110.8	I49 C52 D81 C84 G88	I49-C79 HydrophobicContact CD1-CB 4.2Å; C52-C79 VanDerWaalsContact SG-SG 3.62Å; C79-D81 PolarHBondContact O-N 3.43Å; C79-D81 PolarHBondContact SG-N 3.09Å; C79-C84 HydrophobicContact CB-CB 4.28Å; C79-G88 VanDerWaalsContact CB-O 3.29Å; C79-G88 WeakPolarHBondContact CB-O 3.38Å; C79-G88 PolarHBondContact N-O 3.49Å
80	P	93.5	Very high	87.6	Confident	27 Å²	27	63.4 Å²	63.4	18%	0.175	35%	0.349	C	S	.	.	S	Bend	trans	-64.6	-20.1	178.1	-17.8	26.9	0	0	0	114.7	L36 F56 L61 Y64 S82	L36-P80 HydrophobicContact CD1-CB 3.98Å; L36-P80 HydrophobicContact CD1-CG 4.13Å; L36-P80 HydrophobicContact CD2-CB 3.85Å; L36-P80 HydrophobicContact CG-CB 4.33Å; F56-P80 HydrophobicContact CD2-CG 4.46Å; F56-P80 HydrophobicContact CE1-CB 4.16Å; F56-P80 HydrophobicContact CE1-CG 4.42Å; F56-P80 HydrophobicContact CE2-CG 4.07Å; F56-P80 HydrophobicContact CZ-CB 3.98Å; F56-P80 HydrophobicContact CZ-CG 4.02Å; L61-P80 HydrophobicContact CD1-CG 3.83Å; Y64-P80 HydrophobicContact CD1-CG 3.72Å; Y64-P80 HydrophobicContact CE1-CB 4.39Å; Y64-P80 HydrophobicContact CE1-CG 3.66Å; Y64-P80 HydrophobicContact CE2-CB 4.42Å; Y64-P80 HydrophobicContact CE2-CG 4.49Å; Y64-P80 HydrophobicContact CG-CG 4.14Å; P80-S82 PolarHBondContact O-N 3.41Å
81	D	91.5	Very high	87.8	Confident	25 Å²	25	61.6 Å²	61.6	13%	0.134	34%	0.343	C	S	.	.			trans	-80.3	110.5	-179.6	-173.9	-11.6	0	0	0	110.3	K35 F56 C79 A83 C84	K35-D81 IonicContact NZ-OD2 2.9Å; K35-D81 PolarHBondContact NZ-OD2 3.19Å; F56-D81 HydrophobicContact CE1-CB 4.49Å; F56-D81 HydrophobicContact CZ-CB 3.88Å; C79-D81 PolarHBondContact O-N 3.43Å; C79-D81 PolarHBondContact SG-N 3.09Å; D81-A83 PolarHBondContact O-N 3.14Å; D81-A83 WeakPolarHBondContact OD1-CA 3.48Å; D81-A83 WeakPolarHBondContact OD1-CB 3.4Å; D81-A83 PolarHBondContact OD1-N 3.23Å; D81-C84 HydrophobicContact CB-CB 4.09Å; D81-C84 WeakPolarHBondContact O-CB 3.41Å; D81-C84 PolarHBondContact O-N 3.01Å; D81-C84 PolarHBondContact OD1-N 3.42Å
82	S	85.8	Confident	88	Confident	132 Å²	132	60.7 Å²	60.7	92%	0.923	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23	178.1	61.2	0	0	0	0	113.3	P80 C84	P80-S82 PolarHBondContact O-N 3.41Å; S82-C84 VanDerWaalsContact C-N 3.34Å
83	A	88.1	Confident	88.6	Confident	79 Å²	79	63.8 Å²	63.8	65%	0.653	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	10.9	174.5	0	0	0	0	0	112.5	D81 P85	D81-A83 PolarHBondContact O-N 3.14Å; D81-A83 WeakPolarHBondContact OD1-CA 3.48Å; D81-A83 WeakPolarHBondContact OD1-CB 3.4Å; D81-A83 PolarHBondContact OD1-N 3.23Å; A83-P85 WeakPolarHBondContact O-CD 3.5Å; A83-P85 VanDerWaalsContact O-N 3.14Å
84	C	90.3	Very high	89.8	Confident	8 Å²	8	60.6 Å²	60.6	5%	0.054	33%	0.332	C	S	.	.			trans	-59	115	178.6	174	0	0	0	0	111	C52 C79 D81 S82 K86 R87	C52-C84 WeakPolarHBondContact CB-SG 3.31Å; C79-C84 HydrophobicContact CB-CB 4.28Å; D81-C84 HydrophobicContact CB-CB 4.09Å; D81-C84 WeakPolarHBondContact O-CB 3.41Å; D81-C84 PolarHBondContact O-N 3.01Å; D81-C84 PolarHBondContact OD1-N 3.42Å; S82-C84 VanDerWaalsContact C-N 3.34Å; C84-K86 VanDerWaalsContact C-N 3.27Å; C84-K86 PolarHBondContact O-N 2.95Å; C84-R87 PolarHBondContact O-N 2.62Å; C84-R87 VanDerWaalsContact O-N 3.15Å; C84-R87 PolarHBondContact SG-N 2.76Å; C84-R87 VanDerWaalsContact SG-N 3.36Å
85	P	86.4	Confident	90.8	Very high	118 Å²	118	57.7 Å²	57.7	77%	0.766	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.9	-173.4	24.4	-33.5	0	0	0	112.4	A83	A83-P85 WeakPolarHBondContact O-CD 3.5Å; A83-P85 VanDerWaalsContact O-N 3.14Å
86	K	89.8	Confident	91.6	Very high	140 Å²	140	62 Å²	62	61%	0.609	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.1	-178.8	-60.4	-171.1	-174.5	173.5	0	113.9	Q51 C52 C84 G88	Q51-K86 WeakPolarHBondContact O-CD 3.06Å; C52-K86 HydrophobicContact CB-CB 4.16Å; C84-K86 VanDerWaalsContact C-N 3.27Å; C84-K86 PolarHBondContact O-N 2.95Å; K86-G88 PolarHBondContact O-N 3.23Å; K86-G88 VanDerWaalsContact O-N 3.1Å
87	R	88.4	Confident	91.8	Very high	208 Å²	208	65 Å²	65	79%	0.785	36%	0.355	S	S	*	.			trans	40.4	47.1	-172.4	-58	179.9	-174.4	-130.4	-1	112.8	C84	C84-R87 PolarHBondContact O-N 2.62Å; C84-R87 VanDerWaalsContact O-N 3.15Å; C84-R87 PolarHBondContact SG-N 2.76Å; C84-R87 VanDerWaalsContact SG-N 3.36Å
88	G	90	Very high	91.9	Very high	2 Å²	2	65.7 Å²	65.7	2%	0.021	36%	0.358	C	S	.	.			trans	-67.5	159.4	-172	0	0	0	0	0	112.4	C79 K86	C79-G88 VanDerWaalsContact CB-O 3.29Å; C79-G88 WeakPolarHBondContact CB-O 3.38Å; C79-G88 PolarHBondContact N-O 3.49Å; K86-G88 PolarHBondContact O-N 3.23Å; K86-G88 VanDerWaalsContact O-N 3.1Å
89	H	93.7	Very high	92	Very high	73 Å²	73	64.8 Å²	64.8	34%	0.338	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-113.7	154.9	173.1	-53.5	-78.7	0	0	0	110.4	Q51 I77 S78	Q51-H89 VanDerWaalsContact CG-O 3.31Å; Q51-H89 WeakPolarHBondContact CG-O 3.28Å; Q51-H89 PolarHBondContact NE2-O 3.4Å; I77-H89 CarbonylContact O-C 3.56Å; I77-H89 VanDerWaalsContact O-CA 3.32Å; I77-H89 WeakPolarHBondContact O-CA 3.39Å; S78-H89 PolarHBondContact OG-CE1 2.89Å; S78-H89 PolarHBondContact OG-ND1 3.15Å
90	L	94.6	Very high	92	Very high	9 Å²	9	67 Å²	67	5%	0.047	37%	0.37	C	S	.	.			trans	-75.8	134.5	171.2	-78	67.2	0	0	0	109.2	I49 L61 V65 I77 E94 I95 M98	I49-L90 HydrophobicContact CD1-CD1 3.73Å; I49-L90 HydrophobicContact CG1-CD1 4.14Å; I49-L90 HydrophobicContact CG1-CG 4.46Å; I49-L90 HydrophobicContact CG2-CD1 4.2Å; I49-L90 HydrophobicContact CG2-CG 4.47Å; L61-L90 HydrophobicContact CD1-CD2 4.23Å; L61-L90 HydrophobicContact CG-CD2 4.47Å; V65-L90 HydrophobicContact CG2-CD2 3.34Å; I77-L90 HydrophobicContact CB-CB 4.36Å; I77-L90 HydrophobicContact CG2-CB 4.38Å; I77-L90 HydrophobicContact CG2-CD1 4.13Å; I77-L90 HydrophobicContact CG2-CD2 4.02Å; I77-L90 HydrophobicContact CG2-CG 4.42Å; I77-L90 PolarHBondContact O-N 2.99Å; L90-E94 WeakPolarHBondContact CA-OE2 3.44Å; L90-I95 HydrophobicContact CB-CD1 4.19Å; L90-I95 HydrophobicContact CB-CG1 3.98Å; L90-I95 HydrophobicContact CD2-CG1 4.48Å; L90-M98 HydrophobicContact CD2-CE 3.61Å; L90-M98 HydrophobicContact CG-CE 4.5Å
91	Q	94	Very high	92.1	Very high	81 Å²	81	69.4 Å²	69.4	38%	0.379	39%	0.392	S	S	.	.			trans	-80.1	158.9	175.5	-62	-170	-25.8	0	0	111.4	Q51 N93 E94 I95	Q51-Q91 HydrophobicContact CG-CG 4.4Å; Q91-N93 VanDerWaalsContact C-N 3.33Å; Q91-N93 WeakPolarHBondContact CB-OD1 3.46Å; Q91-N93 PolarHBondContact O-N 2.83Å; Q91-N93 PolarHBondContact OE1-OD1 3.16Å; Q91-E94 HydrophobicContact CB-CG 4.24Å; Q91-E94 WeakPolarHBondContact CB-OE2 3.44Å; Q91-E94 PolarHBondContact N-OE2 3.01Å; Q91-E94 WeakPolarHBondContact O-CB 3.37Å; Q91-E94 PolarHBondContact O-N 3.11Å; Q91-E94 VanDerWaalsContact O-N 3.12Å; Q91-I95 WeakPolarHBondContact O-CG1 3.45Å; Q91-I95 PolarHBondContact O-N 3.4Å
92	E	93.6	Very high	92.2	Very high	82 Å²	82	75.6 Å²	75.6	38%	0.383	42%	0.42	S	S	.	.	H	α-helix	trans	-59.2	-41.9	-177	-170.4	-179.1	167.5	0	0	112.7	E94 I95 E96 M104 K108	E92-E94 PolarHBondContact O-N 3.41Å; E92-I95 PolarHBondContact O-N 3.36Å; E92-E96 WeakPolarHBondContact O-CB 3.01Å; E92-E96 PolarHBondContact O-N 2.86Å; E92-M104 HydrophobicContact CG-CE 3.27Å; E92-K108 WeakPolarHBondContact OE1-CE 3.3Å; E92-K108 IonicContact OE1-NZ 2.86Å; E92-K108 PolarHBondContact OE1-NZ 3.05Å
93	N	94	Very high	92.5	Very high	87 Å²	87	70.7 Å²	70.7	47%	0.465	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-37.6	176	60.6	-37.8	0	0	0	112.7	Q91 C97	Q91-N93 VanDerWaalsContact C-N 3.33Å; Q91-N93 WeakPolarHBondContact CB-OD1 3.46Å; Q91-N93 PolarHBondContact O-N 2.83Å; Q91-N93 PolarHBondContact OE1-OD1 3.16Å; N93-C97 PolarHBondContact O-N 3.12Å; N93-C97 PolarHBondContact O-SG 3.36Å
94	E	94.8	Very high	92.9	Very high	24 Å²	24	67.3 Å²	67.3	11%	0.112	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-46.1	175.1	-63.9	176	125.2	0	0	110.1	T50 L90 Q91 E92 C97 M98	T50-E94 WeakPolarHBondContact CB-OE1 2.88Å; T50-E94 VanDerWaalsContact CG2-OE1 3.23Å; T50-E94 WeakPolarHBondContact CG2-OE1 3.29Å; T50-E94 PolarHBondContact N-OE1 2.92Å; T50-E94 VanDerWaalsContact OG1-CD 3.24Å; T50-E94 PolarHBondContact OG1-OE1 3.38Å; T50-E94 PolarHBondContact OG1-OE2 2.94Å; L90-E94 WeakPolarHBondContact CA-OE2 3.44Å; Q91-E94 HydrophobicContact CB-CG 4.24Å; Q91-E94 WeakPolarHBondContact CB-OE2 3.44Å; Q91-E94 PolarHBondContact N-OE2 3.01Å; Q91-E94 WeakPolarHBondContact O-CB 3.37Å; Q91-E94 PolarHBondContact O-N 3.11Å; Q91-E94 VanDerWaalsContact O-N 3.12Å; E92-E94 PolarHBondContact O-N 3.41Å; E94-C97 PolarHBondContact O-N 3.05Å; E94-M98 VanDerWaalsContact C-CE 3.4Å; E94-M98 HydrophobicContact CB-CE 3.87Å; E94-M98 WeakPolarHBondContact O-CE 3.15Å; E94-M98 WeakPolarHBondContact O-CG 3.31Å; E94-M98 PolarHBondContact O-N 2.93Å
95	I	94.8	Very high	93.1	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-61.7	-46.1	178.3	-64.4	165.4	0	0	0	110.5	V65 I69 I77 L90 Q91 E92 C97 M98 V99 M104 Y107	V65-I95 HydrophobicContact CG1-CG1 4.4Å; V65-I95 HydrophobicContact CG1-CG2 3.88Å; I69-I95 HydrophobicContact CD1-CG2 4.01Å; I77-I95 HydrophobicContact CB-CD1 4.43Å; I77-I95 HydrophobicContact CD1-CD1 3.85Å; I77-I95 HydrophobicContact CD1-CG1 4.25Å; I77-I95 HydrophobicContact CG1-CD1 4.33Å; L90-I95 HydrophobicContact CB-CD1 4.19Å; L90-I95 HydrophobicContact CB-CG1 3.98Å; L90-I95 HydrophobicContact CD2-CG1 4.48Å; Q91-I95 WeakPolarHBondContact O-CG1 3.45Å; Q91-I95 PolarHBondContact O-N 3.4Å; E92-I95 PolarHBondContact O-N 3.36Å; I95-C97 VanDerWaalsContact C-N 3.26Å; I95-C97 PolarHBondContact O-N 3.06Å; I95-M98 WeakPolarHBondContact O-CA 3.49Å; I95-M98 PolarHBondContact O-N 3.12Å; I95-V99 HydrophobicContact CG2-CG2 4.25Å; I95-V99 WeakPolarHBondContact O-CG2 3.39Å; I95-V99 PolarHBondContact O-N 3.03Å; I95-V99 VanDerWaalsContact O-N 3.12Å; I95-M104 HydrophobicContact CG2-SD 3.95Å; I95-Y107 HydrophobicContact CD1-CE1 3.73Å; I95-Y107 HydrophobicContact CD1-CE2 4.18Å; I95-Y107 WeakPolarHBondContact CD1-OH 3.23Å; I95-Y107 HydrophobicContact CG2-CD1 4.29Å; I95-Y107 HydrophobicContact CG2-CE1 4.49Å
96	E	94.7	Very high	93.4	Very high	111 Å²	111	73.6 Å²	73.6	52%	0.519	37%	0.367	S	S	.	.	H	α-helix	trans	-58.9	-36.1	-179.8	-174.4	168.9	-148.1	0	0	112.7	E92 M98 M104	E92-E96 WeakPolarHBondContact O-CB 3.01Å; E92-E96 PolarHBondContact O-N 2.86Å; E96-M98 VanDerWaalsContact C-N 3.27Å; E96-M98 PolarHBondContact O-N 3.09Å; E96-M104 HydrophobicContact CB-CE 3.96Å; E96-M104 HydrophobicContact CB-SD 4.14Å; E96-M104 HydrophobicContact CG-CG 4.42Å
97	C	92.1	Very high	93.6	Very high	109 Å²	109	67.2 Å²	67.2	74%	0.736	34%	0.339	S	S	*	.	H	α-helix	trans	-74.2	-18.5	176	-64.6	0	0	0	0	113.2	N93 E94 I95	N93-C97 PolarHBondContact O-N 3.12Å; N93-C97 PolarHBondContact O-SG 3.36Å; E94-C97 PolarHBondContact O-N 3.05Å; I95-C97 VanDerWaalsContact C-N 3.26Å; I95-C97 PolarHBondContact O-N 3.06Å
98	M	93.4	Very high	93.8	Very high	14 Å²	14	61.5 Å²	61.5	7%	0.069	32%	0.32	C	S	.	.	H	α-helix	trans	-96.1	-26.2	-174	-77.2	-172	-84.8	0	0	113.6	L61 K62 V65 L90 E94 I95 E96	L61-M98 HydrophobicContact CB-SD 4.21Å; L61-M98 HydrophobicContact CD2-CE 4.12Å; L61-M98 HydrophobicContact CD2-SD 3.62Å; L61-M98 HydrophobicContact CG-CE 4.38Å; L61-M98 HydrophobicContact CG-SD 3.62Å; K62-M98 HydrophobicContact CG-CB 3.92Å; K62-M98 HydrophobicContact CG-CG 4.05Å; K62-M98 WeakPolarHBondContact CG-O 3.32Å; V65-M98 HydrophobicContact CG2-CE 4.21Å; V65-M98 HydrophobicContact CG2-SD 4.25Å; L90-M98 HydrophobicContact CD2-CE 3.61Å; L90-M98 HydrophobicContact CG-CE 4.5Å; E94-M98 VanDerWaalsContact C-CE 3.4Å; E94-M98 HydrophobicContact CB-CE 3.87Å; E94-M98 WeakPolarHBondContact O-CE 3.15Å; E94-M98 WeakPolarHBondContact O-CG 3.31Å; E94-M98 PolarHBondContact O-N 2.93Å; I95-M98 WeakPolarHBondContact O-CA 3.49Å; I95-M98 PolarHBondContact O-N 3.12Å; E96-M98 VanDerWaalsContact C-N 3.27Å; E96-M98 PolarHBondContact O-N 3.09Å
99	V	94.6	Very high	93.8	Very high	17 Å²	17	66.3 Å²	66.3	10%	0.103	34%	0.341	C	S	.	.	S	Bend	trans	-119.6	160	-172.3	-53.4	0	0	0	0	113.1	V65 E66 I69 I95 M103 M104	V65-V99 HydrophobicContact CB-CG1 4.37Å; V65-V99 HydrophobicContact CG1-CG1 3.51Å; E66-V99 HydrophobicContact CG-CG1 4.01Å; I69-V99 HydrophobicContact CD1-CG1 4.01Å; I69-V99 HydrophobicContact CD1-CG2 4.47Å; I95-V99 HydrophobicContact CG2-CG2 4.25Å; I95-V99 WeakPolarHBondContact O-CG2 3.39Å; I95-V99 PolarHBondContact O-N 3.03Å; I95-V99 VanDerWaalsContact O-N 3.12Å; V99-M103 HydrophobicContact CB-CB 3.88Å; V99-M103 HydrophobicContact CG2-CB 4Å; V99-M104 HydrophobicContact CG2-CB 3.99Å; V99-M104 HydrophobicContact CG2-SD 4.38Å
100	A	95	Very high	93.6	Very high	61 Å²	61	64.1 Å²	64.1	50%	0.504	33%	0.331	S	S	.	.			trans	-67.6	156.2	171.9	0	0	0	0	0	112.1	E102 M103 M104	A100-E102 VanDerWaalsContact C-N 3.25Å; A100-E102 PolarHBondContact O-N 2.8Å; A100-E102 VanDerWaalsContact O-N 3.16Å; A100-M103 WeakPolarHBondContact O-CB 3.13Å; A100-M103 PolarHBondContact O-N 2.84Å; A100-M104 PolarHBondContact O-N 3.06Å
101	A	94.3	Very high	93.4	Very high	77 Å²	77	66.1 Å²	66.1	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-54.6	-37.8	-178.5	0	0	0	0	0	113.6	M104 Q105	A101-M104 PolarHBondContact O-N 3.34Å; A101-Q105 WeakPolarHBondContact O-CG 3.22Å; A101-Q105 PolarHBondContact O-N 3.06Å
102	E	94.2	Very high	93.2	Very high	155 Å²	155	66.2 Å²	66.2	72%	0.724	34%	0.34	S	S	*	.	H	α-helix	trans	-63.1	-43.5	176.6	-175.8	179.9	-178.2	0	0	112.2	A100 M104 Q105 R106	A100-E102 VanDerWaalsContact C-N 3.25Å; A100-E102 PolarHBondContact O-N 2.8Å; A100-E102 VanDerWaalsContact O-N 3.16Å; E102-M104 VanDerWaalsContact C-N 3.32Å; E102-M104 PolarHBondContact O-N 3.15Å; E102-Q105 PolarHBondContact O-N 2.75Å; E102-R106 PolarHBondContact O-N 3.42Å
103	M	92.9	Very high	92.9	Very high	29 Å²	29	65.2 Å²	65.2	14%	0.143	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-38.2	176	-69.5	-60.6	-70	0	0	111.2	E66 I69 K70 V99 A100 R106 Y107	E66-M103 HydrophobicContact CB-CE 4.33Å; E66-M103 WeakPolarHBondContact O-CE 3.35Å; I69-M103 HydrophobicContact CB-CE 3.8Å; I69-M103 HydrophobicContact CG2-CE 3.59Å; I69-M103 WeakPolarHBondContact CG2-O 3.48Å; K70-M103 HydrophobicContact CD-CE 4.41Å; K70-M103 HydrophobicContact CG-CE 3.67Å; V99-M103 HydrophobicContact CB-CB 3.88Å; V99-M103 HydrophobicContact CG2-CB 4Å; A100-M103 WeakPolarHBondContact O-CB 3.13Å; A100-M103 PolarHBondContact O-N 2.84Å; M103-R106 WeakPolarHBondContact O-CB 3.31Å; M103-R106 PolarHBondContact O-N 2.76Å; M103-Y107 PolarHBondContact O-N 2.96Å
104	M	95.1	Very high	92.5	Very high	9 Å²	9	63.2 Å²	63.2	4%	0.044	32%	0.321	C	S	.	.	H	α-helix	trans	-65	-41.1	175.4	-169.3	59.9	-176.4	0	0	112.1	E92 I95 E96 V99 A100 A101 E102 R106 Y107 K108	E92-M104 HydrophobicContact CG-CE 3.27Å; I95-M104 HydrophobicContact CG2-SD 3.95Å; E96-M104 HydrophobicContact CB-CE 3.96Å; E96-M104 HydrophobicContact CB-SD 4.14Å; E96-M104 HydrophobicContact CG-CG 4.42Å; V99-M104 HydrophobicContact CG2-CB 3.99Å; V99-M104 HydrophobicContact CG2-SD 4.38Å; A100-M104 PolarHBondContact O-N 3.06Å; A101-M104 PolarHBondContact O-N 3.34Å; E102-M104 VanDerWaalsContact C-N 3.32Å; E102-M104 PolarHBondContact O-N 3.15Å; M104-R106 VanDerWaalsContact C-N 3.33Å; M104-R106 PolarHBondContact O-N 3.01Å; M104-Y107 HydrophobicContact CE-CD1 4.14Å; M104-Y107 WeakPolarHBondContact O-CB 3.38Å; M104-Y107 PolarHBondContact O-N 3.19Å; M104-Y107 HydrophobicContact SD-CD1 4.07Å; M104-K108 VanDerWaalsContact CE-CE 3.41Å; M104-K108 HydrophobicContact CE-CG 4.42Å; M104-K108 WeakPolarHBondContact O-CG 3.48Å; M104-K108 PolarHBondContact O-N 2.97Å
105	Q	93.9	Very high	92.1	Very high	137 Å²	137	67.2 Å²	67.2	64%	0.64	34%	0.339	S	S	*	.	H	α-helix	trans	-61.3	-42.7	174.1	-74.9	175.1	-19.2	0	0	111.7	A101 E102 K108 K109	A101-Q105 WeakPolarHBondContact O-CG 3.22Å; A101-Q105 PolarHBondContact O-N 3.06Å; E102-Q105 PolarHBondContact O-N 2.75Å; Q105-K108 PolarHBondContact O-N 3.41Å; Q105-K109 WeakPolarHBondContact O-CB 3.27Å; Q105-K109 PolarHBondContact O-N 3.5Å
106	R	93.4	Very high	91.7	Very high	120 Å²	120	67.3 Å²	67.3	45%	0.453	34%	0.34	S	S	.	.	H	α-helix	trans	-60.2	-45.3	173.7	-178.2	179.1	177.2	89.8	-2.6	111.5	I69 K70 E102 M103 M104 K108 K109 L110	I69-R106 HydrophobicContact CG2-CB 4.25Å; I69-R106 HydrophobicContact CG2-CG 4.15Å; I69-R106 PolarHBondContact O-NE 3.3Å; K70-R106 PolarHBondContact O-NH2 3.18Å; E102-R106 PolarHBondContact O-N 3.42Å; M103-R106 WeakPolarHBondContact O-CB 3.31Å; M103-R106 PolarHBondContact O-N 2.76Å; M104-R106 VanDerWaalsContact C-N 3.33Å; M104-R106 PolarHBondContact O-N 3.01Å; R106-K108 PolarHBondContact O-N 2.96Å; R106-K109 WeakPolarHBondContact O-CB 3.45Å; R106-K109 PolarHBondContact O-N 3.48Å; R106-L110 HydrophobicContact CG-CD1 4.18Å; R106-L110 WeakPolarHBondContact O-CG 3.22Å; R106-L110 PolarHBondContact O-N 3.42Å
107	Y	93.7	Very high	91.2	Very high	7 Å²	7	66 Å²	66	3%	0.027	34%	0.336	C	S	.	.	H	α-helix	trans	-58.1	-47.9	177	178.3	-113	0	0	0	112.3	I69 T75 I77 I95 M103 M104 K109 L110 Q111	I69-Y107 HydrophobicContact CD1-CD2 4.36Å; I69-Y107 HydrophobicContact CD1-CG 4.37Å; I69-Y107 HydrophobicContact CG1-CD2 3.94Å; I69-Y107 HydrophobicContact CG1-CG 4.37Å; T75-Y107 WeakPolarHBondContact O-CE2 3.37Å; T75-Y107 PolarHBondContact O-OH 3.11Å; I77-Y107 HydrophobicContact CD1-CD2 4.49Å; I77-Y107 HydrophobicContact CD1-CE2 4.12Å; I77-Y107 HydrophobicContact CG1-CE2 4.2Å; I95-Y107 HydrophobicContact CD1-CE1 3.73Å; I95-Y107 HydrophobicContact CD1-CE2 4.18Å; I95-Y107 WeakPolarHBondContact CD1-OH 3.23Å; I95-Y107 HydrophobicContact CG2-CD1 4.29Å; I95-Y107 HydrophobicContact CG2-CE1 4.49Å; M103-Y107 PolarHBondContact O-N 2.96Å; M104-Y107 HydrophobicContact CE-CD1 4.14Å; M104-Y107 WeakPolarHBondContact O-CB 3.38Å; M104-Y107 PolarHBondContact O-N 3.19Å; M104-Y107 HydrophobicContact SD-CD1 4.07Å; Y107-K109 VanDerWaalsContact C-N 3.33Å; Y107-K109 PolarHBondContact O-N 2.89Å; Y107-L110 PolarHBondContact O-N 3.38Å; Y107-Q111 HydrophobicContact CE1-CG 4.31Å; Y107-Q111 HydrophobicContact CE2-CG 4.36Å; Y107-Q111 PolarHBondContact O-N 2.84Å; Y107-Q111 PolarHBondContact OH-NE2 3.11Å
108	K	92.6	Very high	90.6	Very high	87 Å²	87	65.2 Å²	65.2	38%	0.378	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-40.5	176.1	-68.8	-175.5	-174.1	-149.2	0	112.3	E92 M104 Q105 R106 Q111 F112	E92-K108 WeakPolarHBondContact OE1-CE 3.3Å; E92-K108 IonicContact OE1-NZ 2.86Å; E92-K108 PolarHBondContact OE1-NZ 3.05Å; M104-K108 VanDerWaalsContact CE-CE 3.41Å; M104-K108 HydrophobicContact CE-CG 4.42Å; M104-K108 WeakPolarHBondContact O-CG 3.48Å; M104-K108 PolarHBondContact O-N 2.97Å; Q105-K108 PolarHBondContact O-N 3.41Å; R106-K108 PolarHBondContact O-N 2.96Å; K108-Q111 PolarHBondContact O-N 3.49Å; K108-F112 WeakPolarHBondContact O-CB 3.48Å; K108-F112 PolarHBondContact O-N 3.4Å
109	K	90.7	Very high	90.1	Very high	104 Å²	104	66.9 Å²	66.9	45%	0.452	33%	0.333	S	S	.	.	H	α-helix	trans	-60.4	-47	174.9	-177.8	176.2	175.7	170.1	0	111.5	Q105 R106 Y107 Q111 F112 E113	Q105-K109 WeakPolarHBondContact O-CB 3.27Å; Q105-K109 PolarHBondContact O-N 3.5Å; R106-K109 WeakPolarHBondContact O-CB 3.45Å; R106-K109 PolarHBondContact O-N 3.48Å; Y107-K109 VanDerWaalsContact C-N 3.33Å; Y107-K109 PolarHBondContact O-N 2.89Å; K109-Q111 PolarHBondContact O-N 2.93Å; K109-F112 PolarHBondContact O-N 2.92Å; K109-E113 WeakPolarHBondContact CE-OE1 3.01Å; K109-E113 HydrophobicContact CG-CG 4.48Å; K109-E113 IonicContact NZ-OE1 3.98Å; K109-E113 WeakPolarHBondContact O-CB 3.43Å; K109-E113 WeakPolarHBondContact O-CG 3.49Å; K109-E113 PolarHBondContact O-N 3.46Å
110	L	89.8	Confident	89.5	Confident	27 Å²	27	70.6 Å²	70.6	14%	0.141	36%	0.358	C	S	.	.	H	α-helix	trans	-62.7	-41.3	177.8	-70.3	167.5	0	0	0	112.2	T75 R106 Y107 E113 R114	T75-L110 HydrophobicContact CG2-CB 4.3Å; T75-L110 WeakPolarHBondContact CG2-O 3.44Å; R106-L110 HydrophobicContact CG-CD1 4.18Å; R106-L110 WeakPolarHBondContact O-CG 3.22Å; R106-L110 PolarHBondContact O-N 3.42Å; Y107-L110 PolarHBondContact O-N 3.38Å; L110-E113 PolarHBondContact O-N 2.95Å; L110-R114 PolarHBondContact O-N 3.15Å
111	Q	90.6	Very high	89.1	Confident	50 Å²	50	69 Å²	69	23%	0.234	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-50.3	173.4	-78.2	-165	-6.2	0	0	111.5	Y107 K108 K109 E113 R114 E115	Y107-Q111 HydrophobicContact CE1-CG 4.31Å; Y107-Q111 HydrophobicContact CE2-CG 4.36Å; Y107-Q111 PolarHBondContact O-N 2.84Å; Y107-Q111 PolarHBondContact OH-NE2 3.11Å; K108-Q111 PolarHBondContact O-N 3.49Å; K109-Q111 PolarHBondContact O-N 2.93Å; Q111-E113 VanDerWaalsContact C-N 3.35Å; Q111-E113 PolarHBondContact O-N 3.5Å; Q111-R114 WeakPolarHBondContact O-CB 3.41Å; Q111-R114 PolarHBondContact O-N 3.25Å; Q111-R114 VanDerWaalsContact O-N 3.15Å; Q111-E115 WeakPolarHBondContact O-CG 3.48Å; Q111-E115 PolarHBondContact O-N 3.36Å
112	F	89.9	Confident	88.8	Confident	84 Å²	84	69.6 Å²	69.6	37%	0.368	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-43.6	178.9	179.3	-106.3	0	0	0	112.3	K108 K109 R114 E115 V116 W124 V133	K108-F112 WeakPolarHBondContact O-CB 3.48Å; K108-F112 PolarHBondContact O-N 3.4Å; K109-F112 PolarHBondContact O-N 2.92Å; F112-R114 VanDerWaalsContact C-N 3.28Å; F112-R114 PolarHBondContact O-N 3.1Å; F112-E115 PolarHBondContact O-N 3.43Å; F112-V116 HydrophobicContact CD1-CG2 4.34Å; F112-V116 HydrophobicContact CD2-CG2 4.43Å; F112-V116 HydrophobicContact CE1-CG2 3.98Å; F112-V116 HydrophobicContact CE2-CG2 4.07Å; F112-V116 HydrophobicContact CZ-CG2 3.84Å; F112-V116 VanDerWaalsContact O-CG2 3.29Å; F112-V116 WeakPolarHBondContact O-CG2 3.44Å; F112-V116 PolarHBondContact O-N 3.36Å; F112-W124 AromaticContact CD1-CH2 3.87Å; F112-W124 HydrophobicContact CD1-CH2 3.87Å; F112-W124 HydrophobicContact CD1-CZ2 4.16Å; F112-W124 AromaticContact CE1-CH2 3.58Å; F112-W124 HydrophobicContact CE1-CH2 3.58Å; F112-W124 HydrophobicContact CE1-CZ2 4.04Å; F112-V133 HydrophobicContact CE1-CG2 3.64Å; F112-V133 HydrophobicContact CZ-CG2 3.68Å
113	E	86.9	Confident	88.5	Confident	60 Å²	60	63.1 Å²	63.1	28%	0.28	30%	0.299	S	S	.	.	H	α-helix	trans	-56.9	-43.2	174.9	-76.3	174.7	-177.9	0	0	112.2	K109 L110 Q111 L117 W124	K109-E113 WeakPolarHBondContact CE-OE1 3.01Å; K109-E113 HydrophobicContact CG-CG 4.48Å; K109-E113 IonicContact NZ-OE1 3.98Å; K109-E113 WeakPolarHBondContact O-CB 3.43Å; K109-E113 WeakPolarHBondContact O-CG 3.49Å; K109-E113 PolarHBondContact O-N 3.46Å; L110-E113 PolarHBondContact O-N 2.95Å; Q111-E113 VanDerWaalsContact C-N 3.35Å; Q111-E113 PolarHBondContact O-N 3.5Å; E113-L117 VanDerWaalsContact O-CG 3.26Å; E113-L117 WeakPolarHBondContact O-CG 3.24Å; E113-L117 PolarHBondContact O-N 3.46Å; E113-L117 VanDerWaalsContact O-N 3.09Å; E113-W124 HydrophobicContact CB-CZ2 4.36Å; E113-W124 HydrophobicContact CG-CH2 4.19Å; E113-W124 HydrophobicContact CG-CZ2 3.82Å
114	R	84.5	Confident	88.4	Confident	46 Å²	46	64.9 Å²	64.9	17%	0.174	30%	0.304	C	S	.	.	H	α-helix	trans	-67.5	-43.1	175.7	-176.2	-176.3	-178.8	130.5	2.5	112.7	T75 L110 Q111 F112 V116 L117 L118 N218	T75-R114 HydrophobicContact CG2-CB 3.85Å; T75-R114 HydrophobicContact CG2-CG 4.35Å; T75-R114 WeakPolarHBondContact OG1-CD 3.28Å; T75-R114 PolarHBondContact OG1-NE 3.5Å; T75-R114 PolarHBondContact OG1-NH1 3.37Å; L110-R114 PolarHBondContact O-N 3.15Å; Q111-R114 WeakPolarHBondContact O-CB 3.41Å; Q111-R114 PolarHBondContact O-N 3.25Å; Q111-R114 VanDerWaalsContact O-N 3.15Å; F112-R114 VanDerWaalsContact C-N 3.28Å; F112-R114 PolarHBondContact O-N 3.1Å; R114-V116 VanDerWaalsContact C-N 3.29Å; R114-V116 PolarHBondContact O-N 3.06Å; R114-L117 PolarHBondContact O-N 2.91Å; R114-L117 VanDerWaalsContact O-N 3.15Å; R114-L118 HydrophobicContact CG-CD1 3.86Å; R114-L118 HydrophobicContact CG-CG 4.26Å; R114-L118 VanDerWaalsContact O-CG 3.32Å; R114-L118 WeakPolarHBondContact O-CG 3.48Å; R114-L118 PolarHBondContact O-N 3.11Å; R114-N218 PolarHBondContact NH1-O 3.11Å; R114-N218 PolarHBondContact NH2-O 3.25Å
115	E	87.3	Confident	88.2	Confident	107 Å²	107	64.9 Å²	64.9	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-45.1	177	-74.7	176.5	-177.7	0	0	111.3	Q111 F112 L117 L118 D119	Q111-E115 WeakPolarHBondContact O-CG 3.48Å; Q111-E115 PolarHBondContact O-N 3.36Å; F112-E115 PolarHBondContact O-N 3.43Å; E115-L117 VanDerWaalsContact C-N 3.3Å; E115-L117 PolarHBondContact O-N 2.78Å; E115-L118 PolarHBondContact O-N 2.78Å; E115-D119 WeakPolarHBondContact O-CB 3.43Å; E115-D119 PolarHBondContact O-N 2.97Å
116	V	87.2	Confident	88	Confident	3 Å²	3	61 Å²	61	2%	0.018	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-36	176.9	175.6	0	0	0	0	111.8	F112 R114 L118 R122 W124 V133	F112-V116 HydrophobicContact CD1-CG2 4.34Å; F112-V116 HydrophobicContact CD2-CG2 4.43Å; F112-V116 HydrophobicContact CE1-CG2 3.98Å; F112-V116 HydrophobicContact CE2-CG2 4.07Å; F112-V116 HydrophobicContact CZ-CG2 3.84Å; F112-V116 VanDerWaalsContact O-CG2 3.29Å; F112-V116 WeakPolarHBondContact O-CG2 3.44Å; F112-V116 PolarHBondContact O-N 3.36Å; R114-V116 VanDerWaalsContact C-N 3.29Å; R114-V116 PolarHBondContact O-N 3.06Å; V116-L118 VanDerWaalsContact C-N 3.34Å; V116-R122 HydrophobicContact CG1-CB 4.02Å; V116-W124 HydrophobicContact CB-CZ2 3.94Å; V116-W124 HydrophobicContact CG1-CD2 4.29Å; V116-W124 HydrophobicContact CG1-CG 4.32Å; V116-W124 HydrophobicContact CG1-CZ2 4.05Å; V116-W124 VanDerWaalsContact CG1-NE1 3.27Å; V116-W124 HydrophobicContact CG2-CZ2 3.93Å; V116-V133 HydrophobicContact CG1-CG1 3.82Å; V116-V133 HydrophobicContact CG1-CG2 4.14Å; V116-V133 HydrophobicContact CG2-CG1 3.98Å; V116-V133 HydrophobicContact CG2-CG2 3.79Å
117	L	82.3	Confident	87.8	Confident	83 Å²	83	56.8 Å²	56.8	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-70.9	-28.8	176	-73.3	170.3	0	0	0	113.3	E113 R114 E115	E113-L117 VanDerWaalsContact O-CG 3.26Å; E113-L117 WeakPolarHBondContact O-CG 3.24Å; E113-L117 PolarHBondContact O-N 3.46Å; E113-L117 VanDerWaalsContact O-N 3.09Å; R114-L117 PolarHBondContact O-N 2.91Å; R114-L117 VanDerWaalsContact O-N 3.15Å; E115-L117 VanDerWaalsContact C-N 3.3Å; E115-L117 PolarHBondContact O-N 2.78Å
118	L	80.6	Confident	87.5	Confident	92 Å²	92	62 Å²	62	48%	0.482	32%	0.318	S	S	.	.	H	α-helix	trans	-88.2	-22.6	-179.6	-68	176.1	0	0	0	112.8	R114 E115 V116 P120	R114-L118 HydrophobicContact CG-CD1 3.86Å; R114-L118 HydrophobicContact CG-CG 4.26Å; R114-L118 VanDerWaalsContact O-CG 3.32Å; R114-L118 WeakPolarHBondContact O-CG 3.48Å; R114-L118 PolarHBondContact O-N 3.11Å; E115-L118 PolarHBondContact O-N 2.78Å; V116-L118 VanDerWaalsContact C-N 3.34Å; L118-P120 VanDerWaalsContact O-CD 3.31Å; L118-P120 WeakPolarHBondContact O-CD 3.48Å
119	D	83.6	Confident	87.3	Confident	49 Å²	49	62.9 Å²	62.9	26%	0.262	34%	0.336	S	S	.	.			trans	-81.6	111.6	177.5	-173.4	-17.2	0	0	0	110.8	E115 C121 R122	E115-D119 WeakPolarHBondContact O-CB 3.43Å; E115-D119 PolarHBondContact O-N 2.97Å; D119-C121 PolarHBondContact O-N 2.93Å; D119-C121 VanDerWaalsContact O-N 3.11Å; D119-C121 WeakPolarHBondContact OD1-CA 3.32Å; D119-C121 VanDerWaalsContact OD1-CB 3.31Å; D119-C121 WeakPolarHBondContact OD1-CB 3.14Å; D119-C121 PolarHBondContact OD1-N 3.32Å; D119-R122 HydrophobicContact CB-CB 4.15Å; D119-R122 HydrophobicContact CB-CG 4.14Å; D119-R122 PolarHBondContact O-N 2.8Å; D119-R122 VanDerWaalsContact O-N 3.16Å; D119-R122 WeakPolarHBondContact OD2-CD 3.24Å; D119-R122 VanDerWaalsContact OD2-CG 3.29Å; D119-R122 WeakPolarHBondContact OD2-CG 3.4Å; D119-R122 IonicContact OD2-CZ 3.71Å; D119-R122 IonicContact OD2-NE 2.87Å; D119-R122 PolarHBondContact OD2-NE 2.94Å
120	P	81.9	Confident	87.3	Confident	96 Å²	96	59 Å²	59	62%	0.623	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19	178.8	-19.8	33.3	0	0	0	113.6	L118	L118-P120 VanDerWaalsContact O-CD 3.31Å; L118-P120 WeakPolarHBondContact O-CD 3.48Å
121	C	85.6	Confident	87.1	Confident	26 Å²	26	63.7 Å²	63.7	18%	0.176	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.3	-177.2	-57.4	0	0	0	0	112.6	D119 L136	D119-C121 PolarHBondContact O-N 2.93Å; D119-C121 VanDerWaalsContact O-N 3.11Å; D119-C121 WeakPolarHBondContact OD1-CA 3.32Å; D119-C121 VanDerWaalsContact OD1-CB 3.31Å; D119-C121 WeakPolarHBondContact OD1-CB 3.14Å; D119-C121 PolarHBondContact OD1-N 3.32Å; C121-L136 PolarHBondContact O-N 2.92Å
122	R	88.3	Confident	87.1	Confident	91 Å²	91	62 Å²	62	34%	0.343	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152.1	179.3	-65.2	-180	-170.5	-164.1	-5.4	111.5	V116 D119 V133 C134	V116-R122 HydrophobicContact CG1-CB 4.02Å; D119-R122 HydrophobicContact CB-CB 4.15Å; D119-R122 HydrophobicContact CB-CG 4.14Å; D119-R122 PolarHBondContact O-N 2.8Å; D119-R122 VanDerWaalsContact O-N 3.16Å; D119-R122 WeakPolarHBondContact OD2-CD 3.24Å; D119-R122 VanDerWaalsContact OD2-CG 3.29Å; D119-R122 WeakPolarHBondContact OD2-CG 3.4Å; D119-R122 IonicContact OD2-CZ 3.71Å; D119-R122 IonicContact OD2-NE 2.87Å; D119-R122 PolarHBondContact OD2-NE 2.94Å; R122-V133 HydrophobicContact CB-CG1 3.99Å; R122-V133 HydrophobicContact CG-CG1 4.34Å; R122-C134 WeakPolarHBondContact CA-O 3.4Å
123	T	88.7	Confident	87.2	Confident	18 Å²	18	60.3 Å²	60.3	11%	0.11	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	144.6	179.2	-134.4	0	0	0	0	114.2	C134 L136 V148 F157 K162	T123-C134 HydrophobicContact CG2-CB 4.32Å; T123-C134 PolarHBondContact N-O 3.23Å; T123-C134 PolarHBondContact O-N 2.9Å; T123-L136 HydrophobicContact CG2-CD2 4.28Å; T123-L136 HydrophobicContact CG2-CG 4.49Å; T123-V148 HydrophobicContact CG2-CG1 4.42Å; T123-F157 HydrophobicContact CG2-CE2 3.82Å; T123-F157 HydrophobicContact CG2-CZ 3.94Å; T123-K162 PolarHBondContact OG1-NZ 2.93Å
124	W	90.7	Very high	87.4	Confident	66 Å²	66	57.9 Å²	57.9	25%	0.25	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.1	177.7	-68.4	100.4	0	0	0	111.7	F112 E113 V116 Q131 V133	F112-W124 AromaticContact CD1-CH2 3.87Å; F112-W124 HydrophobicContact CD1-CH2 3.87Å; F112-W124 HydrophobicContact CD1-CZ2 4.16Å; F112-W124 AromaticContact CE1-CH2 3.58Å; F112-W124 HydrophobicContact CE1-CH2 3.58Å; F112-W124 HydrophobicContact CE1-CZ2 4.04Å; E113-W124 HydrophobicContact CB-CZ2 4.36Å; E113-W124 HydrophobicContact CG-CH2 4.19Å; E113-W124 HydrophobicContact CG-CZ2 3.82Å; V116-W124 HydrophobicContact CB-CZ2 3.94Å; V116-W124 HydrophobicContact CG1-CD2 4.29Å; V116-W124 HydrophobicContact CG1-CG 4.32Å; V116-W124 HydrophobicContact CG1-CZ2 4.05Å; V116-W124 VanDerWaalsContact CG1-NE1 3.27Å; V116-W124 HydrophobicContact CG2-CZ2 3.93Å; W124-Q131 VanDerWaalsContact CZ3-O 3.22Å; W124-Q131 WeakPolarHBondContact CZ3-O 3.33Å; W124-V133 HydrophobicContact CD2-CG2 4.16Å; W124-V133 HydrophobicContact CE3-CG2 3.82Å; W124-V133 HydrophobicContact CH2-CG2 3.55Å; W124-V133 HydrophobicContact CZ2-CG2 3.83Å; W124-V133 HydrophobicContact CZ3-CG2 3.54Å
125	C	91.1	Very high	87.7	Confident	9 Å²	9	63.2 Å²	63.2	6%	0.061	35%	0.35	C	S	.	.			trans	-62.8	130.2	166.4	-178.1	0	0	0	0	109.4	S127 C130 A132 C153	C125-S127 PolarHBondContact O-N 3.46Å; C125-C130 HydrophobicContact CB-CB 4.32Å; C125-A132 HydrophobicContact CB-CB 4.43Å; C125-A132 WeakPolarHBondContact CB-O 3.49Å; C125-A132 PolarHBondContact N-O 3.21Å; C125-C153 VanDerWaalsContact SG-SG 3.61Å
126	P	89.8	Confident	87.6	Confident	56 Å²	56	59.5 Å²	59.5	36%	0.364	33%	0.333	S	S	.	.	S	Bend	trans	-72.2	-11.4	-179	27.1	-33.4	0	0	0	114	S128 L155 F157 K162	P126-S128 PolarHBondContact O-N 2.84Å; P126-L155 HydrophobicContact CG-CD2 3.89Å; P126-F157 HydrophobicContact CG-CB 4Å; P126-F157 HydrophobicContact CG-CD1 4.06Å; P126-F157 HydrophobicContact CG-CD2 3.93Å; P126-F157 HydrophobicContact CG-CE2 4.41Å; P126-F157 HydrophobicContact CG-CG 3.73Å; P126-K162 HydrophobicContact CB-CB 4.15Å
127	S	88.9	Confident	87.4	Confident	32 Å²	32	67.4 Å²	67.4	22%	0.224	37%	0.367	C	S	.	.			trans	-68	120.4	175.3	179.2	0	0	0	0	110.7	C125 S129 C130	C125-S127 PolarHBondContact O-N 3.46Å; S127-S129 PolarHBondContact O-N 3.21Å; S127-S129 VanDerWaalsContact O-N 3.16Å; S127-S129 PolarHBondContact OG-OG 3.25Å; S127-S129 VanDerWaalsContact OG-OG 3.13Å; S127-C130 PolarHBondContact O-N 3.49Å; S127-C130 VanDerWaalsContact O-N 3.1Å
128	S	87.3	Confident	86.9	Confident	115 Å²	115	71.8 Å²	71.8	80%	0.804	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.6	-179.1	55.7	0	0	0	0	113.8	P126	P126-S128 PolarHBondContact O-N 2.84Å
129	S	88.4	Confident	86.1	Confident	107 Å²	107	70.6 Å²	70.6	75%	0.748	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-12	179.4	54.7	0	0	0	0	114.1	S127	S127-S129 PolarHBondContact O-N 3.21Å; S127-S129 VanDerWaalsContact O-N 3.16Å; S127-S129 PolarHBondContact OG-OG 3.25Å; S127-S129 VanDerWaalsContact OG-OG 3.13Å
130	C	89.8	Confident	84.9	Confident	23 Å²	23	76.8 Å²	76.8	16%	0.155	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-50.8	-172	-175.5	0	0	0	0	112.7	C125 S127 A132 C153	C125-C130 HydrophobicContact CB-CB 4.32Å; S127-C130 PolarHBondContact O-N 3.49Å; S127-C130 VanDerWaalsContact O-N 3.1Å; C130-A132 PolarHBondContact O-N 2.9Å; C130-A132 WeakPolarHBondContact SG-CB 3.31Å; C130-C153 HydrophobicContact CB-CB 4.39Å; C130-C153 VanDerWaalsContact SG-SG 3.65Å
131	Q	86.6	Confident	83.9	Confident	125 Å²	125	74.6 Å²	74.6	58%	0.584	40%	0.402	S	S	*	.			trans	49.6	27	-174.3	-55.1	-162	-27.7	0	0	114.3	W124	W124-Q131 VanDerWaalsContact CZ3-O 3.22Å; W124-Q131 WeakPolarHBondContact CZ3-O 3.33Å
132	A	90	Very high	82.6	Confident	13 Å²	13	78.6 Å²	78.6	11%	0.107	43%	0.428	C	S	.	.			trans	-83.4	144.1	176.3	0	0	0	0	0	111.4	C125 C130 V152	C125-A132 HydrophobicContact CB-CB 4.43Å; C125-A132 WeakPolarHBondContact CB-O 3.49Å; C125-A132 PolarHBondContact N-O 3.21Å; C130-A132 PolarHBondContact O-N 2.9Å; C130-A132 WeakPolarHBondContact SG-CB 3.31Å; A132-V152 HydrophobicContact CB-CB 4Å; A132-V152 HydrophobicContact CB-CG2 3.63Å
133	V	92.7	Very high	81.2	Confident	50 Å²	50	78.6 Å²	78.6	30%	0.303	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.3	169.7	-178.1	0	0	0	0	108.9	F112 V116 R122 W124	F112-V133 HydrophobicContact CE1-CG2 3.64Å; F112-V133 HydrophobicContact CZ-CG2 3.68Å; V116-V133 HydrophobicContact CG1-CG1 3.82Å; V116-V133 HydrophobicContact CG1-CG2 4.14Å; V116-V133 HydrophobicContact CG2-CG1 3.98Å; V116-V133 HydrophobicContact CG2-CG2 3.79Å; R122-V133 HydrophobicContact CB-CG1 3.99Å; R122-V133 HydrophobicContact CG-CG1 4.34Å; W124-V133 HydrophobicContact CD2-CG2 4.16Å; W124-V133 HydrophobicContact CE3-CG2 3.82Å; W124-V133 HydrophobicContact CH2-CG2 3.55Å; W124-V133 HydrophobicContact CZ2-CG2 3.83Å; W124-V133 HydrophobicContact CZ3-CG2 3.54Å
134	C	91.3	Very high	80.5	Confident	9 Å²	9	82.7 Å²	82.7	6%	0.061	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	147.2	178.6	-54.3	0	0	0	0	109.8	R122 T123 V148 F157	R122-C134 WeakPolarHBondContact CA-O 3.4Å; T123-C134 HydrophobicContact CG2-CB 4.32Å; T123-C134 PolarHBondContact N-O 3.23Å; T123-C134 PolarHBondContact O-N 2.9Å; C134-V148 HydrophobicContact CB-CG1 3.47Å; C134-V148 VanDerWaalsContact CB-CG1 3.47Å; C134-F157 HydrophobicContact CB-CZ 4.42Å
135	Q	89.6	Confident	80	Confident	157 Å²	157	82.1 Å²	82.1	73%	0.734	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.8	-179.6	-154	156.5	21.8	0	0	110.4
136	L	85.7	Confident	79.8	Confident	29 Å²	29	83.2 Å²	83.2	15%	0.152	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-100.4	155.2	176.7	-60.9	175.9	0	0	0	109.6	C121 T123 V148	C121-L136 PolarHBondContact O-N 2.92Å; T123-L136 HydrophobicContact CG2-CD2 4.28Å; T123-L136 HydrophobicContact CG2-CG 4.49Å; L136-V148 HydrophobicContact CD2-CG1 4.48Å; L136-V148 HydrophobicContact CD2-CG2 3.31Å
137	K	81.8	Confident	79.8	Confident	169 Å²	169	84.5 Å²	84.5	74%	0.735	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-79.5	127	174.9	-67.1	179.7	-179.5	176.8	0	109.1	T139 Q146	K137-T139 PolarHBondContact O-N 2.8Å; K137-T139 VanDerWaalsContact O-N 3.13Å; K137-T139 PolarHBondContact O-OG1 3.32Å; K137-T139 VanDerWaalsContact O-OG1 3.1Å; K137-Q146 VanDerWaalsContact N-OE1 3.1Å; K137-Q146 PolarHBondContact O-NE2 2.82Å
138	E	72.2	Confident	80	Confident	176 Å²	176	83.2 Å²	83.2	82%	0.822	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-54.6	117.7	167	-118.1	160.6	-158.8	0	0	108.5
139	T	64.6	Low	80.3	Confident	66 Å²	66	83.6 Å²	83.6	41%	0.405	46%	0.46	S	S	.	.			trans	-130.4	143.4	178.4	-48.7	0	0	0	0	106.8	K137 S141 Q146	K137-T139 PolarHBondContact O-N 2.8Å; K137-T139 VanDerWaalsContact O-N 3.13Å; K137-T139 PolarHBondContact O-OG1 3.32Å; K137-T139 VanDerWaalsContact O-OG1 3.1Å; T139-S141 CarbonylContact O-C 3.55Å; T139-S141 PolarHBondContact O-N 3.4Å; T139-Q146 PolarHBondContact OG1-NE2 3.47Å; T139-Q146 VanDerWaalsContact OG1-NE2 3.08Å
140	D	59.1	Low	80.5	Confident	180 Å²	180	78.6 Å²	78.6	96%	0.963	43%	0.425	S	S	*	.	S	Bend	trans	-56	-13.9	179.4	-68.3	-35	0	0	0	113.8
141	S	60.3	Low	80.7	Confident	50 Å²	50	82.6 Å²	82.6	35%	0.35	46%	0.46	S	S	.	.			trans	-125.4	98.1	170.4	46.4	0	0	0	0	110.9	T139 A143 L144	T139-S141 CarbonylContact O-C 3.55Å; T139-S141 PolarHBondContact O-N 3.4Å; S141-A143 PolarHBondContact O-N 2.75Å; S141-L144 PolarHBondContact O-N 3.06Å; S141-L144 VanDerWaalsContact OG-CD1 3.28Å; S141-L144 WeakPolarHBondContact OG-CD1 3.45Å
142	P	57.6	Low	81	Confident	109 Å²	109	81.9 Å²	81.9	71%	0.708	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-1.6	-178.1	23.1	-32.2	0	0	0	114.8
143	A	59.2	Low	81.2	Confident	92 Å²	92	83.9 Å²	83.9	76%	0.76	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-6.4	-176.6	0	0	0	0	0	114.8	S141	S141-A143 PolarHBondContact O-N 2.75Å
144	L	73.6	Confident	81.2	Confident	103 Å²	103	84.6 Å²	84.6	54%	0.539	49%	0.488	S	S	.	.	S	Bend	trans	-77	133.7	178.7	-79.7	169.5	0	0	0	111.2	S141 Q146	S141-L144 PolarHBondContact O-N 3.06Å; S141-L144 VanDerWaalsContact OG-CD1 3.28Å; S141-L144 WeakPolarHBondContact OG-CD1 3.45Å; L144-Q146 PolarHBondContact O-N 2.95Å
145	P	81.1	Confident	81.2	Confident	54 Å²	54	87.6 Å²	87.6	35%	0.351	50%	0.503	S	S	.	.			trans	-65.3	128.6	177.3	24.5	-30.6	0	0	0	110.8	A160	P145-A160 HydrophobicContact CB-CB 4.15Å
146	Q	86.9	Confident	81.4	Confident	33 Å²	33	84.8 Å²	84.8	15%	0.154	49%	0.49	C	S	.	.			trans	-117.2	148.2	179.6	-60.4	-178.4	22.3	0	0	110.4	K137 T139 L144 S159 W165	K137-Q146 VanDerWaalsContact N-OE1 3.1Å; K137-Q146 PolarHBondContact O-NE2 2.82Å; T139-Q146 PolarHBondContact OG1-NE2 3.47Å; T139-Q146 VanDerWaalsContact OG1-NE2 3.08Å; L144-Q146 PolarHBondContact O-N 2.95Å; Q146-S159 PolarHBondContact N-OG 3.37Å; Q146-S159 PolarHBondContact O-N 2.88Å; Q146-W165 WeakPolarHBondContact O-CZ3 3.36Å
147	L	89.7	Confident	81.7	Confident	82 Å²	82	83.5 Å²	83.5	43%	0.429	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	127.1	167.4	170.6	61.5	0	0	0	108.7	E156 W165	L147-E156 HydrophobicContact CD1-CB 3.99Å; L147-E156 HydrophobicContact CD1-CG 4.35Å; L147-W165 HydrophobicContact CB-CD2 3.67Å; L147-W165 HydrophobicContact CB-CE3 3.93Å; L147-W165 HydrophobicContact CB-CG 4.17Å; L147-W165 HydrophobicContact CB-CH2 4.18Å; L147-W165 HydrophobicContact CB-CZ2 3.92Å; L147-W165 HydrophobicContact CB-CZ3 4.19Å; L147-W165 HydrophobicContact CD1-CB 3.57Å; L147-W165 HydrophobicContact CD1-CD2 3.88Å; L147-W165 HydrophobicContact CD1-CE3 4.46Å; L147-W165 HydrophobicContact CD1-CG 3.45Å; L147-W165 VanDerWaalsContact CD1-CG 3.45Å; L147-W165 HydrophobicContact CG-CD2 4.29Å; L147-W165 HydrophobicContact CG-CG 4.27Å
148	V	92.3	Very high	82.1	Confident	5 Å²	5	75.5 Å²	75.5	3%	0.03	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.8	174.5	-168.9	0	0	0	0	108.7	T123 C134 L136 E156 F157	T123-V148 HydrophobicContact CG2-CG1 4.42Å; C134-V148 HydrophobicContact CB-CG1 3.47Å; C134-V148 VanDerWaalsContact CB-CG1 3.47Å; L136-V148 HydrophobicContact CD2-CG1 4.48Å; L136-V148 HydrophobicContact CD2-CG2 3.31Å; V148-E156 WeakPolarHBondContact O-CA 3.25Å; V148-F157 HydrophobicContact CB-CD1 4.25Å; V148-F157 HydrophobicContact CB-CD2 4.28Å; V148-F157 HydrophobicContact CB-CE1 3.87Å; V148-F157 HydrophobicContact CB-CE2 3.91Å; V148-F157 HydrophobicContact CB-CG 4.44Å; V148-F157 HydrophobicContact CB-CZ 3.7Å; V148-F157 HydrophobicContact CG1-CE1 3.74Å; V148-F157 HydrophobicContact CG1-CE2 4.12Å; V148-F157 HydrophobicContact CG1-CZ 3.48Å; V148-F157 VanDerWaalsContact CG1-CZ 3.48Å; V148-F157 HydrophobicContact CG2-CE2 4.21Å; V148-F157 HydrophobicContact CG2-CZ 4.4Å; V148-F157 PolarHBondContact N-O 2.98Å; V148-F157 PolarHBondContact O-N 3.18Å
149	Q	94	Very high	82.9	Confident	124 Å²	124	67.9 Å²	67.9	58%	0.579	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.4	171.6	-170.4	178.2	21.4	0	0	109.1	A151 E156	Q149-A151 PolarHBondContact O-N 3.44Å; Q149-E156 HydrophobicContact CB-CG 4.41Å; Q149-E156 HydrophobicContact CG-CG 4.11Å
150	C	93.1	Very high	83.8	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.007	42%	0.419	C	S	.	.			trans	-73.2	123.6	177.8	-177.5	0	0	0	0	111	V152 A154 L155 F157	C150-V152 PolarHBondContact O-N 3.04Å; C150-A154 WeakPolarHBondContact O-CA 2.85Å; C150-A154 PolarHBondContact O-N 3.16Å; C150-L155 PolarHBondContact N-O 3.13Å; C150-F157 HydrophobicContact CB-CE1 4.47Å
151	A	93	Very high	85.1	Confident	108 Å²	108	60.2 Å²	60.2	89%	0.893	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.4	178.6	0	0	0	0	0	114.3	Q149	Q149-A151 PolarHBondContact O-N 3.44Å
152	V	93.8	Very high	86.4	Confident	109 Å²	109	61.2 Å²	61.2	66%	0.661	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-46.8	-175.9	178.3	0	0	0	0	112.1	A132 C150	A132-V152 HydrophobicContact CB-CB 4Å; A132-V152 HydrophobicContact CB-CG2 3.63Å; C150-V152 PolarHBondContact O-N 3.04Å
153	C	93.8	Very high	87.8	Confident	56 Å²	56	58.4 Å²	58.4	38%	0.378	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	3.4	-175.7	68.4	0	0	0	0	114.2	C125 C130 L155	C125-C153 VanDerWaalsContact SG-SG 3.61Å; C130-C153 HydrophobicContact CB-CB 4.39Å; C130-C153 VanDerWaalsContact SG-SG 3.65Å; C153-L155 PolarHBondContact O-N 3.08Å; C153-L155 VanDerWaalsContact SG-CB 3.55Å
154	A	92.4	Very high	89.3	Confident	65 Å²	65	57.7 Å²	57.7	54%	0.537	36%	0.359	S	S	.	.			trans	57.8	9.6	-177.4	0	0	0	0	0	115.6	C150 E156	C150-A154 WeakPolarHBondContact O-CA 2.85Å; C150-A154 PolarHBondContact O-N 3.16Å; A154-E156 PolarHBondContact O-N 3.4Å
155	L	92.5	Very high	90.1	Very high	72 Å²	72	56.7 Å²	56.7	38%	0.377	35%	0.348	S	S	.	.			trans	-64.7	130.6	177.8	-177.7	65.4	0	0	0	111	P126 C150 C153 F157	P126-L155 HydrophobicContact CG-CD2 3.89Å; C150-L155 PolarHBondContact N-O 3.13Å; C153-L155 PolarHBondContact O-N 3.08Å; C153-L155 VanDerWaalsContact SG-CB 3.55Å; L155-F157 HydrophobicContact CG-CD1 4.48Å
156	E	93.6	Very high	90.4	Very high	98 Å²	98	55.5 Å²	55.5	46%	0.458	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.6	175.2	-66.9	-176.9	157.3	0	0	110.6	L147 V148 Q149 A154	L147-E156 HydrophobicContact CD1-CB 3.99Å; L147-E156 HydrophobicContact CD1-CG 4.35Å; V148-E156 WeakPolarHBondContact O-CA 3.25Å; Q149-E156 HydrophobicContact CB-CG 4.41Å; Q149-E156 HydrophobicContact CG-CG 4.11Å; A154-E156 PolarHBondContact O-N 3.4Å
157	F	92.1	Very high	90.3	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.009	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	163.2	-175.7	65.5	-82.7	0	0	0	112.4	T123 P126 C134 V148 C150 L155 K162 A163	T123-F157 HydrophobicContact CG2-CE2 3.82Å; T123-F157 HydrophobicContact CG2-CZ 3.94Å; P126-F157 HydrophobicContact CG-CB 4Å; P126-F157 HydrophobicContact CG-CD1 4.06Å; P126-F157 HydrophobicContact CG-CD2 3.93Å; P126-F157 HydrophobicContact CG-CE2 4.41Å; P126-F157 HydrophobicContact CG-CG 3.73Å; C134-F157 HydrophobicContact CB-CZ 4.42Å; V148-F157 HydrophobicContact CB-CD1 4.25Å; V148-F157 HydrophobicContact CB-CD2 4.28Å; V148-F157 HydrophobicContact CB-CE1 3.87Å; V148-F157 HydrophobicContact CB-CE2 3.91Å; V148-F157 HydrophobicContact CB-CG 4.44Å; V148-F157 HydrophobicContact CB-CZ 3.7Å; V148-F157 HydrophobicContact CG1-CE1 3.74Å; V148-F157 HydrophobicContact CG1-CE2 4.12Å; V148-F157 HydrophobicContact CG1-CZ 3.48Å; V148-F157 VanDerWaalsContact CG1-CZ 3.48Å; V148-F157 HydrophobicContact CG2-CE2 4.21Å; V148-F157 HydrophobicContact CG2-CZ 4.4Å; V148-F157 PolarHBondContact N-O 2.98Å; V148-F157 PolarHBondContact O-N 3.18Å; C150-F157 HydrophobicContact CB-CE1 4.47Å; L155-F157 HydrophobicContact CG-CD1 4.48Å; F157-K162 HydrophobicContact CD2-CD 4.27Å; F157-K162 HydrophobicContact CE2-CD 4.21Å; F157-A163 CarbonylContact C-O 3.53Å; F157-A163 VanDerWaalsContact CA-O 3.25Å; F157-A163 WeakPolarHBondContact CA-O 3.48Å; F157-A163 WeakPolarHBondContact CB-O 3.29Å
158	C	90.3	Very high	89.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.7	176.1	177.1	0	0	0	0	111.2	A160 C161 K162 A163 W165	C158-A160 PolarHBondContact O-N 3.25Å; C158-C161 WeakPolarHBondContact CB-SG 3.49Å; C158-C161 VanDerWaalsContact SG-SG 3.63Å; C158-K162 VanDerWaalsContact O-CA 3.31Å; C158-K162 WeakPolarHBondContact O-CA 3.47Å; C158-K162 PolarHBondContact O-N 2.87Å; C158-A163 PolarHBondContact N-O 2.75Å; C158-W165 HydrophobicContact CB-CE3 4.19Å
159	S	87.9	Confident	89.2	Confident	17 Å²	17	65.1 Å²	65.1	12%	0.119	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.5	179.2	66.1	0	0	0	0	113.3	Q146 K162	Q146-S159 PolarHBondContact N-OG 3.37Å; Q146-S159 PolarHBondContact O-N 2.88Å; S159-K162 PolarHBondContact O-NZ 3.34Å
160	A	84.6	Confident	88.7	Confident	60 Å²	60	63.6 Å²	63.6	50%	0.496	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-55.7	-175.3	0	0	0	0	0	113.3	P145 C158	P145-A160 HydrophobicContact CB-CB 4.15Å; C158-A160 PolarHBondContact O-N 3.25Å
161	C	85.3	Confident	88.2	Confident	25 Å²	25	65.7 Å²	65.7	17%	0.169	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-10.4	-174.6	69.7	0	0	0	0	114.6	C158 A163 H166 C171	C158-C161 WeakPolarHBondContact CB-SG 3.49Å; C158-C161 VanDerWaalsContact SG-SG 3.63Å; C161-A163 PolarHBondContact O-N 3.05Å; C161-A163 VanDerWaalsContact O-N 3.14Å; C161-A163 VanDerWaalsContact SG-CB 3.59Å; C161-A163 PolarHBondContact SG-N 2.69Å; C161-A163 VanDerWaalsContact SG-N 3.43Å; C161-H166 PolarHBondContact SG-NE2 3.33Å; C161-C171 HydrophobicContact CB-CB 3.89Å
162	K	87.8	Confident	87.3	Confident	71 Å²	71	68.7 Å²	68.7	31%	0.309	43%	0.432	S	S	.	.			trans	64.2	5.4	-175.9	-49.7	-54.5	-176.5	-160.3	0	115.8	T123 P126 F157 C158 S159	T123-K162 PolarHBondContact OG1-NZ 2.93Å; P126-K162 HydrophobicContact CB-CB 4.15Å; F157-K162 HydrophobicContact CD2-CD 4.27Å; F157-K162 HydrophobicContact CE2-CD 4.21Å; C158-K162 VanDerWaalsContact O-CA 3.31Å; C158-K162 WeakPolarHBondContact O-CA 3.47Å; C158-K162 PolarHBondContact O-N 2.87Å; S159-K162 PolarHBondContact O-NZ 3.34Å
163	A	87.5	Confident	85.7	Confident	50 Å²	50	72.3 Å²	72.3	41%	0.413	44%	0.441	S	S	.	.	S	Bend	trans	-78.6	175.6	171.4	0	0	0	0	0	111.8	F157 C158 C161	F157-A163 CarbonylContact C-O 3.53Å; F157-A163 VanDerWaalsContact CA-O 3.25Å; F157-A163 WeakPolarHBondContact CA-O 3.48Å; F157-A163 WeakPolarHBondContact CB-O 3.29Å; C158-A163 PolarHBondContact N-O 2.75Å; C161-A163 PolarHBondContact O-N 3.05Å; C161-A163 VanDerWaalsContact O-N 3.14Å; C161-A163 VanDerWaalsContact SG-CB 3.59Å; C161-A163 PolarHBondContact SG-N 2.69Å; C161-A163 VanDerWaalsContact SG-N 3.43Å
164	A	89.4	Confident	83.6	Confident	76 Å²	76	72.8 Å²	72.8	63%	0.628	45%	0.445	S	S	*	.	B	Isolated β-bridge	trans	-53.5	145.5	171.7	0	0	0	0	0	111	H166	A164-H166 PolarHBondContact O-CD2 2.8Å; A164-H166 VanDerWaalsContact O-CD2 3.29Å; A164-H166 PolarHBondContact O-N 3.49Å
165	W	91.3	Very high	81.4	Confident	83 Å²	83	75 Å²	75	31%	0.314	46%	0.457	S	S	.	.			trans	-59.9	131.1	-177.1	176.4	-119	0	0	0	112.4	Q146 L147 C158 P167	Q146-W165 WeakPolarHBondContact O-CZ3 3.36Å; L147-W165 HydrophobicContact CB-CD2 3.67Å; L147-W165 HydrophobicContact CB-CE3 3.93Å; L147-W165 HydrophobicContact CB-CG 4.17Å; L147-W165 HydrophobicContact CB-CH2 4.18Å; L147-W165 HydrophobicContact CB-CZ2 3.92Å; L147-W165 HydrophobicContact CB-CZ3 4.19Å; L147-W165 HydrophobicContact CD1-CB 3.57Å; L147-W165 HydrophobicContact CD1-CD2 3.88Å; L147-W165 HydrophobicContact CD1-CE3 4.46Å; L147-W165 HydrophobicContact CD1-CG 3.45Å; L147-W165 VanDerWaalsContact CD1-CG 3.45Å; L147-W165 HydrophobicContact CG-CD2 4.29Å; L147-W165 HydrophobicContact CG-CG 4.27Å; C158-W165 HydrophobicContact CB-CE3 4.19Å; W165-P167 HydrophobicContact CZ2-CB 4.34Å
166	H	87.5	Confident	79	Confident	28 Å²	28	74.3 Å²	74.3	13%	0.13	46%	0.456	C	S	.	.			trans	-131.3	84.9	-174.7	54.4	75.5	0	0	0	110.9	C161 A164 G168 Q169 C171	C161-H166 PolarHBondContact SG-NE2 3.33Å; A164-H166 PolarHBondContact O-CD2 2.8Å; A164-H166 VanDerWaalsContact O-CD2 3.29Å; A164-H166 PolarHBondContact O-N 3.49Å; H166-G168 PolarHBondContact O-N 3.46Å; H166-Q169 HydrophobicContact CB-CB 4.26Å; H166-Q169 PolarHBondContact CE1-O 3.19Å; H166-Q169 PolarHBondContact ND1-O 2.99Å; H166-Q169 PolarHBondContact O-N 3.24Å; H166-C171 VanDerWaalsContact CE1-SG 3.53Å
167	P	85.1	Confident	76.5	Confident	91 Å²	91	73.6 Å²	73.6	59%	0.591	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	130.2	-175.5	26.3	-32.8	0	0	0	111.3	W165 Q169	W165-P167 HydrophobicContact CZ2-CB 4.34Å; P167-Q169 PolarHBondContact O-N 2.67Å
168	G	77.8	Confident	74.3	Confident	93 Å²	93	77.8 Å²	77.8	96%	0.959	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	1	175.9	0	0	0	0	0	115.7	H166	H166-G168 PolarHBondContact O-N 3.46Å
169	Q	81.5	Confident	72	Confident	138 Å²	138	81.8 Å²	81.8	65%	0.645	52%	0.515	S	S	*	.	S	Bend	trans	-102.6	139.1	173.6	-62.1	-176.4	-1.2	0	0	110.2	H166 P167	H166-Q169 HydrophobicContact CB-CB 4.26Å; H166-Q169 PolarHBondContact CE1-O 3.19Å; H166-Q169 PolarHBondContact ND1-O 2.99Å; H166-Q169 PolarHBondContact O-N 3.24Å; P167-Q169 PolarHBondContact O-N 2.67Å
170	A	81.8	Confident	69.7	Low	93 Å²	93	85 Å²	85	77%	0.769	54%	0.538	S	S	*	.			trans	-60.8	144.7	169.5	0	0	0	0	0	109.5	Q172	A170-Q172 PolarHBondContact O-N 3.13Å
171	C	83.8	Confident	67.6	Low	44 Å²	44	90 Å²	90	30%	0.297	55%	0.549	S	S	.	.			trans	-57.1	114.8	173.6	-72.8	0	0	0	0	108.7	C161 H166 E173	C161-C171 HydrophobicContact CB-CB 3.89Å; H166-C171 VanDerWaalsContact CE1-SG 3.53Å; C171-E173 PolarHBondContact O-N 3.43Å
172	Q	73.7	Confident	65.5	Low	172 Å²	172	95.3 Å²	95.3	80%	0.804	58%	0.575	S	S	*	*			trans	-67.9	120	170.8	-164.7	168.3	9.1	0	0	106.8	A170 S174	A170-Q172 PolarHBondContact O-N 3.13Å; Q172-S174 PolarHBondContact O-N 2.81Å
173	E	60.4	Low	62.9	Low	184 Å²	184	98.2 Å²	98.2	86%	0.86	60%	0.601	S	S	*	*			trans	-65.1	89	-179.9	-132.9	139.3	-156.1	0	0	108	C171 S175	C171-E173 PolarHBondContact O-N 3.43Å; E173-S175 VanDerWaalsContact C-N 3.31Å; E173-S175 PolarHBondContact O-N 3.26Å
174	S	49.6	Very low	60.7	Low	67 Å²	67	98.8 Å²	98.8	47%	0.469	61%	0.612	S	S	.	*			trans	-68.4	97.9	170	57.6	0	0	0	0	105.9	Q172 P176	Q172-S174 PolarHBondContact O-N 2.81Å; S174-P176 WeakPolarHBondContact O-CD 3.37Å; S174-P176 WeakPolarHBondContact O-CG 3.37Å
175	S	45.7	Very low	58.2	Low	111 Å²	111	103.4 Å²	103.4	78%	0.776	62%	0.62	S	S	*	*			trans	-64.1	105.6	154.9	45.3	0	0	0	0	107.1	E173	E173-S175 VanDerWaalsContact C-N 3.31Å; E173-S175 PolarHBondContact O-N 3.26Å
176	P	43.1	Very low	55.7	Low	57 Å²	57	105.8 Å²	105.8	37%	0.37	64%	0.639	S	S	.	*			trans	-84.4	166	175.7	0.1	23.7	0	0	0	109	S174 I178	S174-P176 WeakPolarHBondContact O-CD 3.37Å; S174-P176 WeakPolarHBondContact O-CG 3.37Å; P176-I178 VanDerWaalsContact C-N 3.35Å; P176-I178 PolarHBondContact O-N 3.1Å
177	P	40.8	Very low	53.7	Low	84 Å²	84	115.8 Å²	115.8	55%	0.545	68%	0.676	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.3	49.9	-135.6	36.7	-40.1	0	0	0	113.9	S180 F181	P177-S180 WeakPolarHBondContact CA-OG 3.35Å; P177-S180 WeakPolarHBondContact CB-OG 3.09Å; P177-S180 PolarHBondContact O-OG 3.03Å; P177-F181 VanDerWaalsContact O-CD2 3.22Å; P177-F181 WeakPolarHBondContact O-CD2 3.46Å; P177-F181 WeakPolarHBondContact O-CE2 3.48Å
178	I	46	Very low	51.5	Low	89 Å²	89	119.3 Å²	119.3	46%	0.456	69%	0.69	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.4	-35.7	171.9	-61.3	176.4	0	0	0	110.4	P176 S180 F181 I195 Y204	P176-I178 VanDerWaalsContact C-N 3.35Å; P176-I178 PolarHBondContact O-N 3.1Å; I178-S180 PolarHBondContact O-N 2.79Å; I178-F181 PolarHBondContact O-N 3.25Å; I178-I195 HydrophobicContact CG2-CD1 4.43Å; I178-Y204 HydrophobicContact CD1-CE1 4.49Å
179	A	41.1	Very low	50.1	Low	85 Å²	85	122.3 Å²	122.3	70%	0.702	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-67.1	-19.7	175.9	0	0	0	0	0	113.4	F181	A179-F181 VanDerWaalsContact C-N 3.34Å; A179-F181 PolarHBondContact O-N 2.73Å
180	S	39.7	Very low	49	Very low	85 Å²	85	124 Å²	124	59%	0.594	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-82.2	-3.8	-178.2	49.5	0	0	0	0	114.9	P177 I178 L182	P177-S180 WeakPolarHBondContact CA-OG 3.35Å; P177-S180 WeakPolarHBondContact CB-OG 3.09Å; P177-S180 PolarHBondContact O-OG 3.03Å; I178-S180 PolarHBondContact O-N 2.79Å; S180-L182 VanDerWaalsContact C-N 3.34Å
181	F	41.7	Very low	47.8	Very low	165 Å²	165	122.9 Å²	122.9	72%	0.724	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-87.4	-2.7	173.7	-71.3	-75.1	0	0	0	113.7	P177 I178 A179	P177-F181 VanDerWaalsContact O-CD2 3.22Å; P177-F181 WeakPolarHBondContact O-CD2 3.46Å; P177-F181 WeakPolarHBondContact O-CE2 3.48Å; I178-F181 PolarHBondContact O-N 3.25Å; A179-F181 VanDerWaalsContact C-N 3.34Å; A179-F181 PolarHBondContact O-N 2.73Å
182	L	40.5	Very low	46.9	Very low	136 Å²	136	126 Å²	126	71%	0.712	68%	0.681	S	S	*	*	S	Bend	trans	-106.9	111.8	173.1	-64	177	0	0	0	108.9	S180 G184	S180-L182 VanDerWaalsContact C-N 3.34Å; L182-G184 PolarHBondContact O-N 3.46Å
183	P	33.9	Very low	46.9	Very low	132 Å²	132	119.4 Å²	119.4	86%	0.857	66%	0.656	S	S	*	*			trans	-70.6	121.6	171.3	-6.2	21.5	0	0	0	108.9
184	G	41.2	Very low	47.8	Very low	62 Å²	62	114.7 Å²	114.7	64%	0.639	64%	0.641	S	S	*	*			trans	100.6	106.1	168.6	0	0	0	0	0	113.5	L182	L182-G184 PolarHBondContact O-N 3.46Å
185	E	37.1	Very low	49.5	Very low	172 Å²	172	114.8 Å²	114.8	80%	0.804	64%	0.636	S	S	*	*				148.6	160.5	106.3	-142.8	99.1	120.1	0	0	110.5
186	N	37.6	Very low	51.4	Low	134 Å²	134	110.8 Å²	110.8	72%	0.717	60%	0.604	S	S	*	*			trans	-65.7	154.3	-158.4	-68.4	-60.2	0	0	0	116.4	N188	N186-N188 PolarHBondContact O-N 3.44Å
187	R	44.8	Very low	53.3	Low	238 Å²	238	112.7 Å²	112.7	90%	0.898	60%	0.604	S	S	*	*	S	Bend	trans	-39.7	104.4	159.6	-65.6	169.3	169.3	-178.8	-4.8	111.3
188	N	40.2	Very low	55.4	Low	165 Å²	165	108.7 Å²	108.7	88%	0.882	58%	0.578	S	S	*	*	S	Bend	trans	171.7	8.6	149.5	-84	-19.7	0	0	0	113.8	N186	N186-N188 PolarHBondContact O-N 3.44Å
189	E	48.4	Very low	57.3	Low	156 Å²	156	105.9 Å²	105.9	73%	0.729	57%	0.566	S	S	*	*			trans	-113.2	35	-175.8	-60	-173.4	137.5	0	0	114.6	D191	E189-D191 VanDerWaalsContact C-N 3.28Å; E189-D191 PolarHBondContact O-N 3.22Å
190	E	57.1	Low	59.2	Low	173 Å²	173	107.8 Å²	107.8	81%	0.808	56%	0.558	S	S	*	*			trans	-69.7	-21.7	177.3	-80.7	-176.2	155.3	0	0	113.9	D192 K196	E190-D192 VanDerWaalsContact C-N 3.29Å; E190-D192 PolarHBondContact O-N 2.88Å; E190-K196 WeakPolarHBondContact O-CE 3.33Å; E190-K196 PolarHBondContact O-NZ 3.37Å
191	D	57.6	Low	60.9	Low	69 Å²	69	104.6 Å²	104.6	37%	0.369	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-31.8	-174.7	-152	37.8	0	0	0	111.8	E189 K196 Y226 K248	E189-D191 VanDerWaalsContact C-N 3.28Å; E189-D191 PolarHBondContact O-N 3.22Å; D191-K196 PolarHBondContact O-NZ 3.07Å; D191-Y226 VanDerWaalsContact CG-CD1 3.41Å; D191-Y226 WeakPolarHBondContact OD1-CD1 3.43Å; D191-Y226 WeakPolarHBondContact OD2-CD1 3.49Å; D191-K248 IonicContact OD2-NZ 3.78Å; D191-K248 PolarHBondContact OD2-NZ 2.94Å
192	D	64.8	Low	62.7	Low	111 Å²	111	103 Å²	103	59%	0.594	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	11.6	-174.1	-143.6	33.2	0	0	0	114.2	E190 R207	E190-D192 VanDerWaalsContact C-N 3.29Å; E190-D192 PolarHBondContact O-N 2.88Å; D192-R207 IonicContact OD1-CZ 3.44Å; D192-R207 IonicContact OD1-NH1 2.73Å; D192-R207 PolarHBondContact OD1-NH1 3.01Å
193	A	73.1	Confident	64.5	Low	32 Å²	32	99.2 Å²	99.2	26%	0.264	51%	0.511	S	S	.	.			trans	-52.9	131.9	173.4	0	0	0	0	0	109.8	I195 W225	A193-I195 PolarHBondContact O-N 2.84Å; A193-W225 WeakPolarHBondContact O-CZ2 3.38Å
194	P	80.7	Confident	66.9	Low	85 Å²	85	97.7 Å²	97.7	55%	0.552	49%	0.489	S	S	*	.	S	Bend	trans	-69.5	-18	-173.8	25.7	-34.5	0	0	0	113.4	E206 R207	P194-E206 WeakPolarHBondContact O-CA 3.37Å; P194-R207 PolarHBondContact O-N 3.29Å
195	I	84.2	Confident	68.9	Low	69 Å²	69	95.8 Å²	95.8	35%	0.354	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.6	-176.9	-57	174.2	0	0	0	109.2	I178 A193 Y204 I205	I178-I195 HydrophobicContact CG2-CD1 4.43Å; A193-I195 PolarHBondContact O-N 2.84Å; I195-Y204 HydrophobicContact CG2-CD1 3.85Å; I195-Y204 HydrophobicContact CG2-CG 4.45Å; I195-I205 WeakPolarHBondContact CA-O 3.41Å
196	K	86.1	Confident	71.3	Confident	28 Å²	28	94.1 Å²	94.1	12%	0.122	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	168.9	173.2	-62	-173.3	-174.2	-177.9	0	111.2	E190 D191 Y204 I205 W225 L228	E190-K196 WeakPolarHBondContact O-CE 3.33Å; E190-K196 PolarHBondContact O-NZ 3.37Å; D191-K196 PolarHBondContact O-NZ 3.07Å; K196-Y204 CarbonylContact O-C 3.53Å; K196-Y204 WeakPolarHBondContact O-CA 3.39Å; K196-I205 PolarHBondContact N-O 2.73Å; K196-I205 PolarHBondContact O-N 3.23Å; K196-W225 HydrophobicContact CB-CE3 4.04Å; K196-W225 HydrophobicContact CB-CH2 3.66Å; K196-W225 HydrophobicContact CB-CZ2 4.18Å; K196-W225 HydrophobicContact CB-CZ3 3.54Å; K196-W225 HydrophobicContact CD-CD2 3.76Å; K196-W225 HydrophobicContact CD-CE3 3.92Å; K196-W225 HydrophobicContact CD-CG 4.45Å; K196-W225 HydrophobicContact CD-CH2 4.21Å; K196-W225 HydrophobicContact CD-CZ2 3.92Å; K196-W225 HydrophobicContact CD-CZ3 4.19Å; K196-W225 WeakPolarHBondContact CD-O 3.33Å; K196-W225 HydrophobicContact CG-CD2 4.3Å; K196-W225 HydrophobicContact CG-CE3 4.17Å; K196-W225 HydrophobicContact CG-CH2 3.65Å; K196-W225 HydrophobicContact CG-CZ2 3.63Å; K196-W225 HydrophobicContact CG-CZ3 3.9Å; K196-W225 PolarHBondContact NZ-O 2.85Å; K196-L228 HydrophobicContact CD-CD2 4.3Å
197	R	83.4	Confident	73.4	Confident	96 Å²	96	90.1 Å²	90.1	36%	0.362	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.8	176.1	-68.8	-179	-179.1	162.2	-5.3	111.1	K202 V203 Y204	R197-K202 WeakPolarHBondContact CG-O 3.4Å; R197-V203 CarbonylContact C-O 3.59Å; R197-V203 WeakPolarHBondContact CA-O 3.14Å; R197-Y204 HydrophobicContact CG-CD1 3.79Å; R197-Y204 HydrophobicContact CG-CE1 3.76Å; R197-Y204 HydrophobicContact CG-CG 4.36Å; R197-Y204 VanDerWaalsContact NE-CZ 3.34Å; R197-Y204 PolarHBondContact NE-OH 2.93Å; R197-Y204 PolarHBondContact NH2-OH 2.92Å
198	C	85	Confident	74.6	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	42%	0.415	C	S	.	.			trans	-55.9	129	171.1	-177.6	0	0	0	0	110.6	K200 K202 V203 I205 C216	C198-K200 PolarHBondContact O-N 2.86Å; C198-K202 WeakPolarHBondContact O-CA 3.46Å; C198-K202 WeakPolarHBondContact O-CD 3.5Å; C198-K202 PolarHBondContact O-N 3.25Å; C198-V203 PolarHBondContact N-O 3.37Å; C198-I205 HydrophobicContact CB-CD1 3.61Å; C198-I205 HydrophobicContact CB-CG1 4.42Å; C198-C216 HydrophobicContact CB-CB 4.4Å
199	P	85.3	Confident	76.1	Confident	31 Å²	31	85.3 Å²	85.3	20%	0.201	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-30	-179.7	22.8	-32.2	0	0	0	112.8	K202 F223 L228	P199-K202 WeakPolarHBondContact O-CE 3.09Å; P199-K202 PolarHBondContact O-NZ 3.01Å; P199-F223 HydrophobicContact CG-CB 3.79Å; P199-F223 HydrophobicContact CG-CD1 4.21Å; P199-F223 HydrophobicContact CG-CD2 3.96Å; P199-F223 HydrophobicContact CG-CG 3.71Å; P199-L228 HydrophobicContact CB-CB 4.25Å; P199-L228 WeakPolarHBondContact CB-O 3.47Å; P199-L228 HydrophobicContact CG-CB 4.44Å; P199-L228 WeakPolarHBondContact CG-O 3.38Å
200	K	80.2	Confident	77.2	Confident	124 Å²	124	80.1 Å²	80.1	54%	0.539	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-59.4	-180	-167.9	175.9	-170.2	172.7	0	113.1	C198 H221	C198-K200 PolarHBondContact O-N 2.86Å; K200-H221 HydrophobicContact CB-CB 4.09Å; K200-H221 HydrophobicContact CD-CB 3.74Å
201	C	77.1	Confident	78.5	Confident	19 Å²	19	73.7 Å²	73.7	13%	0.128	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	3.8	-172.1	75.6	0	0	0	0	114.9	V203 C216 N218 C219	C201-V203 PolarHBondContact O-N 3.45Å; C201-C216 VanDerWaalsContact SG-SG 3.62Å; C201-N218 PolarHBondContact SG-ND2 2.77Å; C201-C219 HydrophobicContact CB-CB 3.92Å
202	K	77.6	Confident	79.8	Confident	131 Å²	131	70.4 Å²	70.4	57%	0.57	36%	0.361	S	S	*	.			trans	59.1	5.7	175.1	-49.1	-60.5	178.6	-167.2	0	117.1	R197 C198 P199	R197-K202 WeakPolarHBondContact CG-O 3.4Å; C198-K202 WeakPolarHBondContact O-CA 3.46Å; C198-K202 WeakPolarHBondContact O-CD 3.5Å; C198-K202 PolarHBondContact O-N 3.25Å; P199-K202 WeakPolarHBondContact O-CE 3.09Å; P199-K202 PolarHBondContact O-NZ 3.01Å
203	V	80.1	Confident	80.9	Confident	56 Å²	56	68.1 Å²	68.1	34%	0.339	35%	0.347	S	S	.	.			trans	-60.9	142.7	169.9	134.7	0	0	0	0	110.4	R197 C198 C201 I205 N218	R197-V203 CarbonylContact C-O 3.59Å; R197-V203 WeakPolarHBondContact CA-O 3.14Å; C198-V203 PolarHBondContact N-O 3.37Å; C201-V203 PolarHBondContact O-N 3.45Å; V203-I205 HydrophobicContact CG1-CG1 4.26Å; V203-N218 HydrophobicContact CG1-CB 4.42Å
204	Y	82.9	Confident	81.6	Confident	101 Å²	101	67.2 Å²	67.2	40%	0.396	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	135.7	173.6	-70.6	-80.6	0	0	0	111	I178 I195 K196 R197	I178-Y204 HydrophobicContact CD1-CE1 4.49Å; I195-Y204 HydrophobicContact CG2-CD1 3.85Å; I195-Y204 HydrophobicContact CG2-CG 4.45Å; K196-Y204 CarbonylContact O-C 3.53Å; K196-Y204 WeakPolarHBondContact O-CA 3.39Å; R197-Y204 HydrophobicContact CG-CD1 3.79Å; R197-Y204 HydrophobicContact CG-CE1 3.76Å; R197-Y204 HydrophobicContact CG-CG 4.36Å; R197-Y204 VanDerWaalsContact NE-CZ 3.34Å; R197-Y204 PolarHBondContact NE-OH 2.93Å; R197-Y204 PolarHBondContact NH2-OH 2.92Å
205	I	84.8	Confident	82	Confident	22 Å²	22	69 Å²	69	11%	0.113	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.6	-178.5	-56.7	173.5	0	0	0	107	I195 K196 C198 V203 M214 C216 F223 W225	I195-I205 WeakPolarHBondContact CA-O 3.41Å; K196-I205 PolarHBondContact N-O 2.73Å; K196-I205 PolarHBondContact O-N 3.23Å; C198-I205 HydrophobicContact CB-CD1 3.61Å; C198-I205 HydrophobicContact CB-CG1 4.42Å; V203-I205 HydrophobicContact CG1-CG1 4.26Å; I205-M214 HydrophobicContact CG2-CE 3.36Å; I205-C216 HydrophobicContact CD1-CB 3.83Å; I205-F223 HydrophobicContact CD1-CE1 3.6Å; I205-F223 HydrophobicContact CD1-CZ 3.52Å; I205-W225 WeakPolarHBondContact O-CH2 3.46Å
206	E	85.8	Confident	82.1	Confident	137 Å²	137	65.7 Å²	65.7	64%	0.64	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	144.5	170.1	-177.4	175.9	-168.9	0	0	110	P194 D208 M214	P194-E206 WeakPolarHBondContact O-CA 3.37Å; E206-D208 PolarHBondContact O-N 3.36Å; E206-M214 WeakPolarHBondContact O-CE 3.06Å
207	R	83	Confident	81.9	Confident	50 Å²	50	70 Å²	70	19%	0.189	34%	0.341	C	S	.	.			trans	-76	115.1	178	-168.7	-179.6	-178	179.5	-1.1	111	D192 P194 E209 M214 W225 Y226	D192-R207 IonicContact OD1-CZ 3.44Å; D192-R207 IonicContact OD1-NH1 2.73Å; D192-R207 PolarHBondContact OD1-NH1 3.01Å; P194-R207 PolarHBondContact O-N 3.29Å; R207-E209 PolarHBondContact O-N 3.37Å; R207-M214 HydrophobicContact CG-SD 4.3Å; R207-W225 HydrophobicContact CB-CH2 3.91Å; R207-W225 HydrophobicContact CB-CZ2 3.58Å; R207-W225 HydrophobicContact CG-CZ2 4.23Å; R207-Y226 PolarHBondContact NH2-OH 3.23Å
208	D	69	Low	81.7	Confident	105 Å²	105	67 Å²	67	56%	0.561	33%	0.332	S	S	*	.			trans	-68.9	122.5	162.2	-60	-43.4	0	0	0	107.8	E206	E206-D208 PolarHBondContact O-N 3.36Å
209	E	71.6	Confident	81.3	Confident	197 Å²	197	67.7 Å²	67.7	92%	0.921	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	145.2	-174.7	-65	-176.1	158.7	0	0	112.7	R207 C211	R207-E209 PolarHBondContact O-N 3.37Å; E209-C211 PolarHBondContact O-N 3.36Å
210	G	72.9	Confident	81.3	Confident	46 Å²	46	70.2 Å²	70.2	47%	0.474	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-12.2	167.5	0	0	0	0	0	117.9	G250	G210-G250 CarbonylContact O-C 3.56Å; G210-G250 VanDerWaalsContact O-CA 3.27Å; G210-G250 WeakPolarHBondContact O-CA 2.99Å
211	C	82.6	Confident	81.5	Confident	38 Å²	38	65 Å²	65	26%	0.257	32%	0.322	S	S	.	.			trans	-128.5	129.5	173.3	-167.2	0	0	0	0	112.3	E209 Q213 L249	E209-C211 PolarHBondContact O-N 3.36Å; C211-Q213 PolarHBondContact SG-N 3.15Å; C211-Q213 PolarHBondContact SG-O 3.25Å; C211-Q213 VanDerWaalsContact SG-O 3.39Å; C211-L249 WeakPolarHBondContact CA-O 3.35Å
212	A	86.8	Confident	82.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.319	C	S	.	.	S	Bend	trans	-88.7	-13.8	175.6	0	0	0	0	0	114	W225 Y226 Y240 K248 L249	A212-W225 WeakPolarHBondContact O-CB 3.44Å; A212-W225 PolarHBondContact O-N 3.04Å; A212-Y226 HydrophobicContact CB-CD2 3.86Å; A212-Y226 HydrophobicContact CB-CE2 3.48Å; A212-Y226 VanDerWaalsContact CB-CE2 3.48Å; A212-Y240 HydrophobicContact CB-CE1 3.87Å; A212-Y240 PolarHBondContact O-OH 3.32Å; A212-Y240 VanDerWaalsContact O-OH 3.04Å; A212-K248 WeakPolarHBondContact CB-O 3.39Å; A212-L249 PolarHBondContact N-O 3.45Å
213	Q	87.9	Confident	82.7	Confident	64 Å²	64	58.2 Å²	58.2	30%	0.299	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	115.1	168.9	178.7	-174.7	22	0	0	107.3	C211 L231 Y240 L249	C211-Q213 PolarHBondContact SG-N 3.15Å; C211-Q213 PolarHBondContact SG-O 3.25Å; C211-Q213 VanDerWaalsContact SG-O 3.39Å; Q213-L231 HydrophobicContact CB-CD1 4.2Å; Q213-L231 HydrophobicContact CG-CD1 3.86Å; Q213-Y240 WeakPolarHBondContact CA-OH 3.34Å; Q213-Y240 HydrophobicContact CB-CE2 4.42Å; Q213-Y240 PolarHBondContact N-OH 3.32Å; Q213-Y240 VanDerWaalsContact N-OH 3.15Å; Q213-L249 HydrophobicContact CB-CD1 4.12Å
214	M	87.5	Confident	83.1	Confident	13 Å²	13	55.6 Å²	55.6	6%	0.064	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	147	-178.6	-67.3	-172.6	69.1	0	0	110.5	I205 E206 R207 A222 F223 W225	I205-M214 HydrophobicContact CG2-CE 3.36Å; E206-M214 WeakPolarHBondContact O-CE 3.06Å; R207-M214 HydrophobicContact CG-SD 4.3Å; M214-A222 CarbonylContact O-C 3.56Å; M214-A222 VanDerWaalsContact O-CA 3.27Å; M214-A222 WeakPolarHBondContact O-CA 3.18Å; M214-F223 HydrophobicContact CB-CE1 4.17Å; M214-F223 HydrophobicContact CB-CE2 4.34Å; M214-F223 HydrophobicContact CB-CZ 3.96Å; M214-F223 PolarHBondContact N-O 3.39Å; M214-F223 PolarHBondContact O-N 2.87Å; M214-W225 HydrophobicContact CE-CE3 3.94Å; M214-W225 HydrophobicContact CE-CH2 4.34Å; M214-W225 HydrophobicContact CE-CZ3 3.66Å; M214-W225 HydrophobicContact CG-CB 4.45Å; M214-W225 HydrophobicContact CG-CE3 4.43Å; M214-W225 HydrophobicContact SD-CB 3.99Å; M214-W225 HydrophobicContact SD-CD2 3.49Å; M214-W225 HydrophobicContact SD-CE3 2.95Å; M214-W225 HydrophobicContact SD-CG 3.99Å; M214-W225 HydrophobicContact SD-CH2 4.2Å; M214-W225 HydrophobicContact SD-CZ3 3.35Å; M214-W225 WeakPolarHBondContact SD-CZ3 3.18Å
215	M	88.1	Confident	83.4	Confident	121 Å²	121	50.8 Å²	50.8	60%	0.596	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	120	174.4	-174.2	-179.7	-68.9	0	0	108.7	K217 H221	M215-K217 PolarHBondContact O-N 2.87Å; M215-K217 VanDerWaalsContact O-N 3.13Å; M215-H221 WeakPolarHBondContact CA-O 3.3Å
216	C	86	Confident	83.5	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.			trans	-63.5	116.8	177.5	179.9	0	0	0	0	110	C198 C201 I205 N218 C219 K220 H221 F223	C198-C216 HydrophobicContact CB-CB 4.4Å; C201-C216 VanDerWaalsContact SG-SG 3.62Å; I205-C216 HydrophobicContact CD1-CB 3.83Å; C216-N218 PolarHBondContact O-N 2.86Å; C216-C219 PolarHBondContact SG-N 2.87Å; C216-C219 VanDerWaalsContact SG-N 3.43Å; C216-K220 WeakPolarHBondContact O-CA 3.33Å; C216-K220 PolarHBondContact O-N 3.49Å; C216-H221 PolarHBondContact N-O 3.38Å; C216-F223 HydrophobicContact CB-CE1 4.33Å
217	K	83	Confident	83.5	Confident	119 Å²	119	48 Å²	48	52%	0.517	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-33.3	178.8	-66.6	-179.6	-177.7	170	0	112.4	M215 K220	M215-K217 PolarHBondContact O-N 2.87Å; M215-K217 VanDerWaalsContact O-N 3.13Å; K217-K220 WeakPolarHBondContact O-CE 3.46Å; K217-K220 PolarHBondContact O-NZ 3.4Å
218	N	78	Confident	83.7	Confident	33 Å²	33	48.7 Å²	48.7	18%	0.176	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-64.3	178.3	-175.4	50.2	0	0	0	113	R114 C201 V203 C216	R114-N218 PolarHBondContact NH1-O 3.11Å; R114-N218 PolarHBondContact NH2-O 3.25Å; C201-N218 PolarHBondContact SG-ND2 2.77Å; V203-N218 HydrophobicContact CG1-CB 4.42Å; C216-N218 PolarHBondContact O-N 2.86Å
219	C	78	Confident	84.5	Confident	14 Å²	14	49.1 Å²	49.1	10%	0.095	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	1.4	-173.2	71.2	0	0	0	0	115.2	C201 C216 H221	C201-C219 HydrophobicContact CB-CB 3.92Å; C216-C219 PolarHBondContact SG-N 2.87Å; C216-C219 VanDerWaalsContact SG-N 3.43Å; C219-H221 PolarHBondContact O-N 2.79Å; C219-H221 WeakPolarHBondContact SG-CB 3.49Å
220	K	83.6	Confident	85.3	Confident	85 Å²	85	42.7 Å²	42.7	37%	0.37	23%	0.23	S	C	.	.			trans	58.7	9.1	-178.1	-53	-55.1	-171.7	-169	0	115.8	E74 C216 K217 A222	E74-K220 IonicContact OE1-NZ 2.67Å; E74-K220 PolarHBondContact OE1-NZ 3.02Å; C216-K220 WeakPolarHBondContact O-CA 3.33Å; C216-K220 PolarHBondContact O-N 3.49Å; K217-K220 WeakPolarHBondContact O-CE 3.46Å; K217-K220 PolarHBondContact O-NZ 3.4Å; K220-A222 PolarHBondContact O-N 3.12Å
221	H	85.2	Confident	85.9	Confident	14 Å²	14	40.8 Å²	40.8	7%	0.065	21%	0.209	C	C	.	.			trans	-65.2	124.7	174.3	-176.8	60	0	0	0	111.2	K200 M215 C216 C219 F223 S230 D232	K200-H221 HydrophobicContact CB-CB 4.09Å; K200-H221 HydrophobicContact CD-CB 3.74Å; M215-H221 WeakPolarHBondContact CA-O 3.3Å; C216-H221 PolarHBondContact N-O 3.38Å; C219-H221 PolarHBondContact O-N 2.79Å; C219-H221 WeakPolarHBondContact SG-CB 3.49Å; H221-F223 AromaticContact CD2-CD1 3.95Å; H221-S230 PolarHBondContact CE1-OG 3.48Å; H221-D232 WeakPolarHBondContact CA-OD1 3.27Å; H221-D232 IonicContact CE1-OD2 2.65Å; H221-D232 PolarHBondContact CE1-OD2 3.24Å; H221-D232 IonicContact CG-OD2 3.31Å; H221-D232 IonicContact ND1-OD1 2.73Å; H221-D232 PolarHBondContact ND1-OD1 3.39Å; H221-D232 IonicContact ND1-OD2 3.26Å; H221-D232 PolarHBondContact ND1-OD2 3.24Å
222	A	89.3	Confident	85.8	Confident	8 Å²	8	41.7 Å²	41.7	7%	0.066	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.5	170.4	0	0	0	0	0	109.5	M214 K220 L231 D232	M214-A222 CarbonylContact O-C 3.56Å; M214-A222 VanDerWaalsContact O-CA 3.27Å; M214-A222 WeakPolarHBondContact O-CA 3.18Å; K220-A222 PolarHBondContact O-N 3.12Å; A222-L231 HydrophobicContact CB-CB 4.31Å; A222-L231 PolarHBondContact O-N 2.89Å; A222-D232 PolarHBondContact N-OD1 3.2Å
223	F	90.3	Very high	85.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	160.1	-179.3	65.8	-81.8	0	0	0	111.7	P199 I205 M214 C216 H221 W225 L228 E229	P199-F223 HydrophobicContact CG-CB 3.79Å; P199-F223 HydrophobicContact CG-CD1 4.21Å; P199-F223 HydrophobicContact CG-CD2 3.96Å; P199-F223 HydrophobicContact CG-CG 3.71Å; I205-F223 HydrophobicContact CD1-CE1 3.6Å; I205-F223 HydrophobicContact CD1-CZ 3.52Å; M214-F223 HydrophobicContact CB-CE1 4.17Å; M214-F223 HydrophobicContact CB-CE2 4.34Å; M214-F223 HydrophobicContact CB-CZ 3.96Å; M214-F223 PolarHBondContact N-O 3.39Å; M214-F223 PolarHBondContact O-N 2.87Å; C216-F223 HydrophobicContact CB-CE1 4.33Å; H221-F223 AromaticContact CD2-CD1 3.95Å; F223-W225 HydrophobicContact CE2-CE3 4.35Å; F223-L228 HydrophobicContact CD2-CD2 4.05Å; F223-L228 HydrophobicContact CE2-CD2 3.94Å; F223-E229 CarbonylContact C-O 3.14Å; F223-E229 WeakPolarHBondContact CA-O 3.15Å; F223-E229 VanDerWaalsContact CB-O 3.3Å; F223-E229 WeakPolarHBondContact CB-O 3.43Å
224	C	89.2	Confident	85	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	129.4	175.2	179.4	0	0	0	0	110.6	Y226 C227 L228 E229 L231 H239	C224-Y226 PolarHBondContact O-N 2.92Å; C224-C227 WeakPolarHBondContact CB-SG 3.47Å; C224-C227 VanDerWaalsContact SG-SG 3.67Å; C224-L228 WeakPolarHBondContact O-CA 3.2Å; C224-L228 PolarHBondContact O-N 2.98Å; C224-E229 PolarHBondContact N-O 3Å; C224-L231 HydrophobicContact CB-CD1 3.94Å; C224-L231 HydrophobicContact CB-CG 4.33Å; C224-H239 PolarHBondContact SG-NE2 3.15Å
225	W	88.6	Confident	84.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-32	179.6	-177.3	-112.7	0	0	0	114.4	A193 K196 I205 R207 A212 M214 F223	A193-W225 WeakPolarHBondContact O-CZ2 3.38Å; K196-W225 HydrophobicContact CB-CE3 4.04Å; K196-W225 HydrophobicContact CB-CH2 3.66Å; K196-W225 HydrophobicContact CB-CZ2 4.18Å; K196-W225 HydrophobicContact CB-CZ3 3.54Å; K196-W225 HydrophobicContact CD-CD2 3.76Å; K196-W225 HydrophobicContact CD-CE3 3.92Å; K196-W225 HydrophobicContact CD-CG 4.45Å; K196-W225 HydrophobicContact CD-CH2 4.21Å; K196-W225 HydrophobicContact CD-CZ2 3.92Å; K196-W225 HydrophobicContact CD-CZ3 4.19Å; K196-W225 WeakPolarHBondContact CD-O 3.33Å; K196-W225 HydrophobicContact CG-CD2 4.3Å; K196-W225 HydrophobicContact CG-CE3 4.17Å; K196-W225 HydrophobicContact CG-CH2 3.65Å; K196-W225 HydrophobicContact CG-CZ2 3.63Å; K196-W225 HydrophobicContact CG-CZ3 3.9Å; K196-W225 PolarHBondContact NZ-O 2.85Å; I205-W225 WeakPolarHBondContact O-CH2 3.46Å; R207-W225 HydrophobicContact CB-CH2 3.91Å; R207-W225 HydrophobicContact CB-CZ2 3.58Å; R207-W225 HydrophobicContact CG-CZ2 4.23Å; A212-W225 WeakPolarHBondContact O-CB 3.44Å; A212-W225 PolarHBondContact O-N 3.04Å; M214-W225 HydrophobicContact CE-CE3 3.94Å; M214-W225 HydrophobicContact CE-CH2 4.34Å; M214-W225 HydrophobicContact CE-CZ3 3.66Å; M214-W225 HydrophobicContact CG-CB 4.45Å; M214-W225 HydrophobicContact CG-CE3 4.43Å; M214-W225 HydrophobicContact SD-CB 3.99Å; M214-W225 HydrophobicContact SD-CD2 3.49Å; M214-W225 HydrophobicContact SD-CE3 2.95Å; M214-W225 HydrophobicContact SD-CG 3.99Å; M214-W225 HydrophobicContact SD-CH2 4.2Å; M214-W225 HydrophobicContact SD-CZ3 3.35Å; M214-W225 WeakPolarHBondContact SD-CZ3 3.18Å; F223-W225 HydrophobicContact CE2-CE3 4.35Å
226	Y	86.6	Confident	83.4	Confident	47 Å²	47	52.5 Å²	52.5	18%	0.184	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-50.7	-172.2	-63.7	-65.9	0	0	0	112.1	D191 R207 A212 C224 K248	D191-Y226 VanDerWaalsContact CG-CD1 3.41Å; D191-Y226 WeakPolarHBondContact OD1-CD1 3.43Å; D191-Y226 WeakPolarHBondContact OD2-CD1 3.49Å; R207-Y226 PolarHBondContact NH2-OH 3.23Å; A212-Y226 HydrophobicContact CB-CD2 3.86Å; A212-Y226 HydrophobicContact CB-CE2 3.48Å; A212-Y226 VanDerWaalsContact CB-CE2 3.48Å; C224-Y226 PolarHBondContact O-N 2.92Å; Y226-K248 HydrophobicContact CD1-CD 4.29Å; Y226-K248 HydrophobicContact CD2-CB 3.73Å; Y226-K248 HydrophobicContact CD2-CD 3.7Å; Y226-K248 HydrophobicContact CD2-CG 4.4Å; Y226-K248 HydrophobicContact CE1-CD 4.34Å; Y226-K248 HydrophobicContact CE2-CB 3.47Å; Y226-K248 VanDerWaalsContact CE2-CB 3.47Å; Y226-K248 HydrophobicContact CE2-CD 3.82Å; Y226-K248 HydrophobicContact CE2-CG 4.25Å; Y226-K248 WeakPolarHBondContact CE2-O 3.25Å; Y226-K248 HydrophobicContact CG-CD 3.93Å
227	C	86.9	Confident	83	Confident	53 Å²	53	53.4 Å²	53.4	36%	0.358	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-6.6	-178.5	65.5	0	0	0	0	114.6	C224 E229 H239 C245	C224-C227 WeakPolarHBondContact CB-SG 3.47Å; C224-C227 VanDerWaalsContact SG-SG 3.67Å; C227-E229 PolarHBondContact O-N 3.45Å; C227-E229 VanDerWaalsContact O-N 3.12Å; C227-E229 WeakPolarHBondContact SG-CB 3.36Å; C227-H239 PolarHBondContact SG-CE1 3.37Å; C227-H239 PolarHBondContact SG-NE2 3.18Å; C227-C245 VanDerWaalsContact SG-SG 3.66Å
228	L	87.1	Confident	82.9	Confident	66 Å²	66	51.9 Å²	51.9	35%	0.346	27%	0.268	S	S	.	.			trans	58.7	19.4	-176.5	-53	177.6	0	0	0	114.3	K196 P199 F223 C224	K196-L228 HydrophobicContact CD-CD2 4.3Å; P199-L228 HydrophobicContact CB-CB 4.25Å; P199-L228 WeakPolarHBondContact CB-O 3.47Å; P199-L228 HydrophobicContact CG-CB 4.44Å; P199-L228 WeakPolarHBondContact CG-O 3.38Å; F223-L228 HydrophobicContact CD2-CD2 4.05Å; F223-L228 HydrophobicContact CE2-CD2 3.94Å; C224-L228 WeakPolarHBondContact O-CA 3.2Å; C224-L228 PolarHBondContact O-N 2.98Å
229	E	85.5	Confident	83.2	Confident	114 Å²	114	52 Å²	52	53%	0.533	27%	0.267	S	S	.	.			trans	-78	145.8	177.4	-165.9	162.6	-151.2	0	0	111.3	F223 C224 C227 L231 H239	F223-E229 CarbonylContact C-O 3.14Å; F223-E229 WeakPolarHBondContact CA-O 3.15Å; F223-E229 VanDerWaalsContact CB-O 3.3Å; F223-E229 WeakPolarHBondContact CB-O 3.43Å; C224-E229 PolarHBondContact N-O 3Å; C227-E229 PolarHBondContact O-N 3.45Å; C227-E229 VanDerWaalsContact O-N 3.12Å; C227-E229 WeakPolarHBondContact SG-CB 3.36Å; E229-L231 PolarHBondContact O-N 3.08Å; E229-H239 IonicContact OE2-CE1 3.87Å; E229-H239 PolarHBondContact OE2-CE1 3.23Å; E229-H239 VanDerWaalsContact OE2-CE1 3.27Å; E229-H239 IonicContact OE2-ND1 3.46Å
230	S	87.5	Confident	83.6	Confident	61 Å²	61	51.5 Å²	51.5	43%	0.427	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-62.5	131.1	177.6	-179.6	0	0	0	0	111.2	H221	H221-S230 PolarHBondContact CE1-OG 3.48Å
231	L	86.9	Confident	83.5	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.031	26%	0.262	C	S	.	.			trans	-117.1	14.8	173.5	-61.3	179.8	0	0	0	112.1	Q213 A222 C224 E229 D233 D234 H239 Y240	Q213-L231 HydrophobicContact CB-CD1 4.2Å; Q213-L231 HydrophobicContact CG-CD1 3.86Å; A222-L231 HydrophobicContact CB-CB 4.31Å; A222-L231 PolarHBondContact O-N 2.89Å; C224-L231 HydrophobicContact CB-CD1 3.94Å; C224-L231 HydrophobicContact CB-CG 4.33Å; E229-L231 PolarHBondContact O-N 3.08Å; L231-D233 PolarHBondContact O-N 3.03Å; L231-D234 HydrophobicContact CB-CB 4.44Å; L231-D234 HydrophobicContact CD2-CB 4.02Å; L231-D234 PolarHBondContact O-N 3.18Å; L231-H239 HydrophobicContact CD2-CB 3.55Å; L231-Y240 HydrophobicContact CD1-CE2 3.95Å
232	D	80.3	Confident	83.2	Confident	57 Å²	57	57.7 Å²	57.7	31%	0.305	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-34.6	-178.9	-75.8	-23.2	0	0	0	112.2	H221 A222	H221-D232 WeakPolarHBondContact CA-OD1 3.27Å; H221-D232 IonicContact CE1-OD2 2.65Å; H221-D232 PolarHBondContact CE1-OD2 3.24Å; H221-D232 IonicContact CG-OD2 3.31Å; H221-D232 IonicContact ND1-OD1 2.73Å; H221-D232 PolarHBondContact ND1-OD1 3.39Å; H221-D232 IonicContact ND1-OD2 3.26Å; H221-D232 PolarHBondContact ND1-OD2 3.24Å; A222-D232 PolarHBondContact N-OD1 3.2Å
233	D	78.9	Confident	82.8	Confident	138 Å²	138	60 Å²	60	74%	0.738	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.2	-179.8	-62.1	-53.3	0	0	0	114.2	L231 F235	L231-D233 PolarHBondContact O-N 3.03Å; D233-F235 VanDerWaalsContact C-N 3.31Å; D233-F235 WeakPolarHBondContact O-CD2 3.27Å; D233-F235 PolarHBondContact O-N 3.11Å; D233-F235 VanDerWaalsContact O-N 3.11Å
234	D	77.6	Confident	82.4	Confident	27 Å²	27	65.5 Å²	65.5	14%	0.144	35%	0.353	C	S	.	.			trans	-90.8	60.6	-177.3	-170.2	17	0	0	0	112.3	L231 L236 L237 I238 H239	L231-D234 HydrophobicContact CB-CB 4.44Å; L231-D234 HydrophobicContact CD2-CB 4.02Å; L231-D234 PolarHBondContact O-N 3.18Å; D234-L236 PolarHBondContact O-N 3.27Å; D234-L237 PolarHBondContact O-N 3.27Å; D234-L237 VanDerWaalsContact O-N 3.08Å; D234-L237 PolarHBondContact OD1-N 3.47Å; D234-I238 VanDerWaalsContact CG-N 3.33Å; D234-I238 PolarHBondContact OD1-N 3.49Å; D234-I238 PolarHBondContact OD2-N 2.94Å; D234-H239 WeakPolarHBondContact OD2-CB 3.44Å; D234-H239 PolarHBondContact OD2-N 2.74Å
235	F	69.5	Low	82.2	Confident	148 Å²	148	65.6 Å²	65.6	65%	0.649	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.6	-177.9	-55.9	-76.2	0	0	0	114.7	D233	D233-F235 VanDerWaalsContact C-N 3.31Å; D233-F235 WeakPolarHBondContact O-CD2 3.27Å; D233-F235 PolarHBondContact O-N 3.11Å; D233-F235 VanDerWaalsContact O-N 3.11Å
236	L	73.3	Confident	82	Confident	113 Å²	113	73 Å²	73	59%	0.592	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	2.2	-177.7	-68.6	-179.1	0	0	0	112.8	D234 I238 R253	D234-L236 PolarHBondContact O-N 3.27Å; L236-I238 HydrophobicContact CB-CD1 3.84Å; L236-I238 HydrophobicContact CB-CG1 3.68Å; L236-I238 HydrophobicContact CD1-CD1 4.14Å; L236-I238 PolarHBondContact O-N 2.88Å; L236-R253 PolarHBondContact O-NH2 3.31Å
237	L	77.1	Confident	81.7	Confident	19 Å²	19	77 Å²	77	10%	0.099	41%	0.406	C	S	.	.			trans	58.2	32.8	179.7	-50.7	169.4	0	0	0	111.7	D234 H239 Y240 L249 R253	D234-L237 PolarHBondContact O-N 3.27Å; D234-L237 VanDerWaalsContact O-N 3.08Å; D234-L237 PolarHBondContact OD1-N 3.47Å; L237-H239 PolarHBondContact O-N 2.69Å; L237-Y240 HydrophobicContact CB-CD2 4.23Å; L237-Y240 PolarHBondContact O-N 3.12Å; L237-L249 HydrophobicContact CD1-CD2 3.77Å; L237-R253 PolarHBondContact O-NH1 3.39Å
238	I	81.1	Confident	81.5	Confident	86 Å²	86	77.9 Å²	77.9	44%	0.441	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-65.5	-27.8	-176.6	-61.7	166.4	0	0	0	110.3	D234 L236 Y240 D241	D234-I238 VanDerWaalsContact CG-N 3.33Å; D234-I238 PolarHBondContact OD1-N 3.49Å; D234-I238 PolarHBondContact OD2-N 2.94Å; L236-I238 HydrophobicContact CB-CD1 3.84Å; L236-I238 HydrophobicContact CB-CG1 3.68Å; L236-I238 HydrophobicContact CD1-CD1 4.14Å; L236-I238 PolarHBondContact O-N 2.88Å; I238-Y240 PolarHBondContact O-N 2.79Å; I238-Y240 VanDerWaalsContact O-N 3.12Å; I238-D241 WeakPolarHBondContact O-CB 3.43Å; I238-D241 PolarHBondContact O-N 3.33Å
239	H	85.4	Confident	81.2	Confident	36 Å²	36	75 Å²	75	17%	0.167	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-51.4	-34.7	173.6	-178.4	83.1	0	0	0	112.5	C224 C227 E229 L231 D234 L237 D241 C245	C224-H239 PolarHBondContact SG-NE2 3.15Å; C227-H239 PolarHBondContact SG-CE1 3.37Å; C227-H239 PolarHBondContact SG-NE2 3.18Å; E229-H239 IonicContact OE2-CE1 3.87Å; E229-H239 PolarHBondContact OE2-CE1 3.23Å; E229-H239 VanDerWaalsContact OE2-CE1 3.27Å; E229-H239 IonicContact OE2-ND1 3.46Å; L231-H239 HydrophobicContact CD2-CB 3.55Å; D234-H239 WeakPolarHBondContact OD2-CB 3.44Å; D234-H239 PolarHBondContact OD2-N 2.74Å; L237-H239 PolarHBondContact O-N 2.69Å; H239-D241 VanDerWaalsContact C-N 3.35Å; H239-D241 PolarHBondContact O-N 3.12Å; H239-C245 WeakPolarHBondContact NE2-CB 3.48Å; H239-C245 PolarHBondContact NE2-SG 3.01Å
240	Y	85	Confident	80.7	Confident	4 Å²	4	72.4 Å²	72.4	2%	0.016	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-86.3	1	-180	-61.5	-83.7	0	0	0	114.4	A212 Q213 L231 L237 I238 C245 R246 N247 L249	A212-Y240 HydrophobicContact CB-CE1 3.87Å; A212-Y240 PolarHBondContact O-OH 3.32Å; A212-Y240 VanDerWaalsContact O-OH 3.04Å; Q213-Y240 WeakPolarHBondContact CA-OH 3.34Å; Q213-Y240 HydrophobicContact CB-CE2 4.42Å; Q213-Y240 PolarHBondContact N-OH 3.32Å; Q213-Y240 VanDerWaalsContact N-OH 3.15Å; L231-Y240 HydrophobicContact CD1-CE2 3.95Å; L237-Y240 HydrophobicContact CB-CD2 4.23Å; L237-Y240 PolarHBondContact O-N 3.12Å; I238-Y240 PolarHBondContact O-N 2.79Å; I238-Y240 VanDerWaalsContact O-N 3.12Å; Y240-C245 HydrophobicContact CD1-CB 4.44Å; Y240-C245 WeakPolarHBondContact CD1-O 3.36Å; Y240-R246 VanDerWaalsContact O-CA 3.28Å; Y240-R246 WeakPolarHBondContact O-CA 3.04Å; Y240-N247 PolarHBondContact O-N 3.29Å; Y240-L249 HydrophobicContact CD1-CB 3.88Å; Y240-L249 HydrophobicContact CD1-CD1 4.44Å; Y240-L249 HydrophobicContact CD2-CB 4.3Å; Y240-L249 HydrophobicContact CD2-CD1 3.74Å; Y240-L249 HydrophobicContact CD2-CG 4.46Å; Y240-L249 HydrophobicContact CE1-CB 4.27Å; Y240-L249 HydrophobicContact CE1-CD1 4.24Å; Y240-L249 HydrophobicContact CE2-CD1 3.49Å; Y240-L249 VanDerWaalsContact CE2-CD1 3.49Å; Y240-L249 HydrophobicContact CG-CB 3.89Å; Y240-L249 HydrophobicContact CG-CD1 4.21Å
241	D	82.2	Confident	80	Confident	63 Å²	63	72.8 Å²	72.8	34%	0.337	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-88.6	-22.3	176.9	-70.1	-36.5	0	0	0	113	I238 H239 R246 R253	I238-D241 WeakPolarHBondContact O-CB 3.43Å; I238-D241 PolarHBondContact O-N 3.33Å; H239-D241 VanDerWaalsContact C-N 3.35Å; H239-D241 PolarHBondContact O-N 3.12Å; D241-R246 WeakPolarHBondContact O-CD 3.08Å; D241-R253 IonicContact OD1-CZ 3.53Å; D241-R253 VanDerWaalsContact OD1-CZ 3.31Å; D241-R253 IonicContact OD1-NH1 3.96Å; D241-R253 PolarHBondContact OD1-NH1 3Å; D241-R253 IonicContact OD1-NH2 2.93Å; D241-R253 IonicContact OD2-CZ 3.27Å; D241-R253 VanDerWaalsContact OD2-CZ 3.26Å; D241-R253 IonicContact OD2-NH1 2.69Å; D241-R253 PolarHBondContact OD2-NH1 3.02Å; D241-R253 IonicContact OD2-NH2 2.74Å; D241-R253 PolarHBondContact OD2-NH2 3.46Å
242	K	78.3	Confident	79	Confident	165 Å²	165	76.3 Å²	76.3	72%	0.717	41%	0.413	S	S	*	.	S	Bend	trans	-141.6	164.2	-171.1	-62.1	-177.2	-175.9	176.7	0	111.5
243	G	81.6	Confident	78.2	Confident	57 Å²	57	76.8 Å²	76.8	59%	0.588	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	70.3	-160.7	173.5	0	0	0	0	0	114.5	C245 R246	G243-C245 VanDerWaalsContact C-N 3.28Å; G243-C245 PolarHBondContact O-N 3.5Å; G243-R246 WeakPolarHBondContact O-CB 3.44Å; G243-R246 PolarHBondContact O-N 2.78Å
244	P	82.4	Confident	77.4	Confident	115 Å²	115	73 Å²	73	75%	0.747	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-71.1	-18.8	-170.6	28.4	-35	0	0	0	114.2
245	C	85.2	Confident	76.7	Confident	3 Å²	3	75.1 Å²	75.1	2%	0.02	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-95.1	6.1	179.3	-62.1	0	0	0	0	113.3	C227 H239 Y240 G243 N247 K248	C227-C245 VanDerWaalsContact SG-SG 3.66Å; H239-C245 WeakPolarHBondContact NE2-CB 3.48Å; H239-C245 PolarHBondContact NE2-SG 3.01Å; Y240-C245 HydrophobicContact CD1-CB 4.44Å; Y240-C245 WeakPolarHBondContact CD1-O 3.36Å; G243-C245 VanDerWaalsContact C-N 3.28Å; G243-C245 PolarHBondContact O-N 3.5Å; C245-N247 PolarHBondContact O-N 2.86Å; C245-K248 WeakPolarHBondContact O-CB 3.35Å; C245-K248 PolarHBondContact O-N 3.27Å; C245-K248 VanDerWaalsContact O-N 3.12Å
246	R	83.6	Confident	76.4	Confident	154 Å²	154	70.6 Å²	70.6	58%	0.581	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	132.8	-176	-176.8	176.7	174.9	-172.3	-1	111.7	Y240 D241 G243 K248	Y240-R246 VanDerWaalsContact O-CA 3.28Å; Y240-R246 WeakPolarHBondContact O-CA 3.04Å; D241-R246 WeakPolarHBondContact O-CD 3.08Å; G243-R246 WeakPolarHBondContact O-CB 3.44Å; G243-R246 PolarHBondContact O-N 2.78Å; R246-K248 PolarHBondContact O-N 3.28Å; R246-K248 VanDerWaalsContact O-N 3.14Å
247	N	79.9	Confident	76.1	Confident	131 Å²	131	69.8 Å²	69.8	70%	0.701	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	8.3	-178.9	-56.4	-33.9	0	0	0	115.9	Y240 C245 L249	Y240-N247 PolarHBondContact O-N 3.29Å; C245-N247 PolarHBondContact O-N 2.86Å; N247-L249 VanDerWaalsContact C-N 3.32Å; N247-L249 PolarHBondContact O-N 2.9Å
248	K	83	Confident	75.6	Confident	72 Å²	72	77.7 Å²	77.7	31%	0.313	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	10	-178.9	-62.5	-165.8	175.9	-176.7	0	114.4	D191 A212 Y226 C245 R246 G250	D191-K248 IonicContact OD2-NZ 3.78Å; D191-K248 PolarHBondContact OD2-NZ 2.94Å; A212-K248 WeakPolarHBondContact CB-O 3.39Å; Y226-K248 HydrophobicContact CD1-CD 4.29Å; Y226-K248 HydrophobicContact CD2-CB 3.73Å; Y226-K248 HydrophobicContact CD2-CD 3.7Å; Y226-K248 HydrophobicContact CD2-CG 4.4Å; Y226-K248 HydrophobicContact CE1-CD 4.34Å; Y226-K248 HydrophobicContact CE2-CB 3.47Å; Y226-K248 VanDerWaalsContact CE2-CB 3.47Å; Y226-K248 HydrophobicContact CE2-CD 3.82Å; Y226-K248 HydrophobicContact CE2-CG 4.25Å; Y226-K248 WeakPolarHBondContact CE2-O 3.25Å; Y226-K248 HydrophobicContact CG-CD 3.93Å; C245-K248 WeakPolarHBondContact O-CB 3.35Å; C245-K248 PolarHBondContact O-N 3.27Å; C245-K248 VanDerWaalsContact O-N 3.12Å; R246-K248 PolarHBondContact O-N 3.28Å; R246-K248 VanDerWaalsContact O-N 3.14Å; K248-G250 VanDerWaalsContact C-N 3.28Å; K248-G250 PolarHBondContact O-N 3.43Å
249	L	80.4	Confident	74.9	Confident	6 Å²	6	79.3 Å²	79.3	3%	0.031	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-29.6	-175.3	-176.6	65.8	0	0	0	113.6	C211 A212 Q213 L237 Y240 N247 H251 R253	C211-L249 WeakPolarHBondContact CA-O 3.35Å; A212-L249 PolarHBondContact N-O 3.45Å; Q213-L249 HydrophobicContact CB-CD1 4.12Å; L237-L249 HydrophobicContact CD1-CD2 3.77Å; Y240-L249 HydrophobicContact CD1-CB 3.88Å; Y240-L249 HydrophobicContact CD1-CD1 4.44Å; Y240-L249 HydrophobicContact CD2-CB 4.3Å; Y240-L249 HydrophobicContact CD2-CD1 3.74Å; Y240-L249 HydrophobicContact CD2-CG 4.46Å; Y240-L249 HydrophobicContact CE1-CB 4.27Å; Y240-L249 HydrophobicContact CE1-CD1 4.24Å; Y240-L249 HydrophobicContact CE2-CD1 3.49Å; Y240-L249 VanDerWaalsContact CE2-CD1 3.49Å; Y240-L249 HydrophobicContact CG-CB 3.89Å; Y240-L249 HydrophobicContact CG-CD1 4.21Å; N247-L249 VanDerWaalsContact C-N 3.32Å; N247-L249 PolarHBondContact O-N 2.9Å; L249-H251 VanDerWaalsContact CD2-CE1 3.48Å; L249-H251 WeakPolarHBondContact CD2-CE1 3.26Å; L249-H251 VanDerWaalsContact CG-CE1 3.44Å; L249-H251 WeakPolarHBondContact CG-CE1 3.18Å; L249-R253 HydrophobicContact CD2-CG 4.14Å
250	G	75.2	Confident	74.4	Confident	59 Å²	59	84.8 Å²	84.8	61%	0.608	45%	0.448	S	S	*	.	S	Bend	trans	90.2	-10.5	177.6	0	0	0	0	0	115.8	G210 K248	G210-G250 CarbonylContact O-C 3.56Å; G210-G250 VanDerWaalsContact O-CA 3.27Å; G210-G250 WeakPolarHBondContact O-CA 2.99Å; K248-G250 VanDerWaalsContact C-N 3.28Å; K248-G250 PolarHBondContact O-N 3.43Å
251	H	72.3	Confident	74.1	Confident	69 Å²	69	88.4 Å²	88.4	32%	0.319	47%	0.471	S	S	.	.	S	Bend	trans	-140.2	160.3	172.7	65.7	-76.8	0	0	0	111.9	L249 R253	L249-H251 VanDerWaalsContact CD2-CE1 3.48Å; L249-H251 WeakPolarHBondContact CD2-CE1 3.26Å; L249-H251 VanDerWaalsContact CG-CE1 3.44Å; L249-H251 WeakPolarHBondContact CG-CE1 3.18Å; H251-R253 PolarHBondContact O-N 3.14Å
252	S	66.8	Low	73.9	Confident	80 Å²	80	89.9 Å²	89.9	56%	0.559	48%	0.476	S	S	*	.			trans	-74.9	122.2	-179.9	-175.7	0	0	0	0	111.2	A254 S255	S252-A254 PolarHBondContact O-N 3.2Å; S252-S255 PolarHBondContact O-N 3.43Å; S252-S255 PolarHBondContact O-OG 3.05Å
253	R	63.2	Low	74.2	Confident	67 Å²	67	84.6 Å²	84.6	25%	0.253	46%	0.458	S	S	.	.	H	α-helix	trans	-54.6	-27	174.3	-65.5	169.2	73.6	130.1	-5.5	113.1	L236 L237 D241 L249 H251 S255 V256 I257	L236-R253 PolarHBondContact O-NH2 3.31Å; L237-R253 PolarHBondContact O-NH1 3.39Å; D241-R253 IonicContact OD1-CZ 3.53Å; D241-R253 VanDerWaalsContact OD1-CZ 3.31Å; D241-R253 IonicContact OD1-NH1 3.96Å; D241-R253 PolarHBondContact OD1-NH1 3Å; D241-R253 IonicContact OD1-NH2 2.93Å; D241-R253 IonicContact OD2-CZ 3.27Å; D241-R253 VanDerWaalsContact OD2-CZ 3.26Å; D241-R253 IonicContact OD2-NH1 2.69Å; D241-R253 PolarHBondContact OD2-NH1 3.02Å; D241-R253 IonicContact OD2-NH2 2.74Å; D241-R253 PolarHBondContact OD2-NH2 3.46Å; L249-R253 HydrophobicContact CD2-CG 4.14Å; H251-R253 PolarHBondContact O-N 3.14Å; R253-S255 PolarHBondContact O-N 3.01Å; R253-V256 PolarHBondContact O-N 3.46Å; R253-I257 WeakPolarHBondContact O-CG1 3.35Å; R253-I257 PolarHBondContact O-N 3.23Å
254	A	61.5	Low	74.4	Confident	60 Å²	60	86.6 Å²	86.6	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-58.6	-34.9	177.8	0	0	0	0	0	111.6	S252 W258	S252-A254 PolarHBondContact O-N 3.2Å; A254-W258 WeakPolarHBondContact O-CA 3.13Å; A254-W258 WeakPolarHBondContact O-CB 3.27Å; A254-W258 PolarHBondContact O-N 3.5Å
255	S	63.2	Low	74.7	Confident	70 Å²	70	83.2 Å²	83.2	49%	0.49	44%	0.444	S	S	.	.	H	α-helix	trans	-69.5	-39.5	179.6	66.1	0	0	0	0	112.4	S252 R253 H259	S252-S255 PolarHBondContact O-N 3.43Å; S252-S255 PolarHBondContact O-OG 3.05Å; R253-S255 PolarHBondContact O-N 3.01Å; S255-H259 VanDerWaalsContact O-CB 3.26Å; S255-H259 WeakPolarHBondContact O-CB 3.47Å; S255-H259 PolarHBondContact O-N 3.04Å
256	V	64.4	Low	75	Confident	53 Å²	53	86.7 Å²	86.7	32%	0.321	46%	0.462	S	S	.	.	H	α-helix	trans	-71.1	-44.1	179.4	-178.7	0	0	0	0	110.9	R253 H259 R260	R253-V256 PolarHBondContact O-N 3.46Å; V256-H259 PolarHBondContact O-N 2.65Å; V256-R260 VanDerWaalsContact O-CG 3.27Å; V256-R260 WeakPolarHBondContact O-CG 3.39Å; V256-R260 PolarHBondContact O-N 2.79Å
257	I	66.6	Low	75.3	Confident	97 Å²	97	86.6 Å²	86.6	50%	0.497	47%	0.465	S	S	.	.	H	α-helix	trans	-67.1	-43.3	176.6	-63.8	171.5	0	0	0	110.2	R253 H259 R260 T261	R253-I257 WeakPolarHBondContact O-CG1 3.35Å; R253-I257 PolarHBondContact O-N 3.23Å; I257-H259 PolarHBondContact O-N 2.9Å; I257-R260 PolarHBondContact O-N 2.93Å; I257-T261 HydrophobicContact CG2-CG2 4.35Å; I257-T261 WeakPolarHBondContact O-CG2 3.45Å; I257-T261 PolarHBondContact O-N 3.34Å; I257-T261 PolarHBondContact O-OG1 3.12Å; I257-T261 VanDerWaalsContact O-OG1 3.05Å
258	W	66.8	Low	75.8	Confident	184 Å²	184	83.4 Å²	83.4	70%	0.697	46%	0.458	S	S	*	.	H	α-helix	trans	-60.5	-43.4	175.9	-172.7	-87.4	0	0	0	111.8	A254 R260 T261 Q262	A254-W258 WeakPolarHBondContact O-CA 3.13Å; A254-W258 WeakPolarHBondContact O-CB 3.27Å; A254-W258 PolarHBondContact O-N 3.5Å; W258-R260 VanDerWaalsContact C-N 3.35Å; W258-R260 PolarHBondContact O-N 3.45Å; W258-T261 WeakPolarHBondContact CA-OG1 3.21Å; W258-T261 PolarHBondContact O-N 3.39Å; W258-T261 PolarHBondContact O-OG1 3.18Å; W258-T261 VanDerWaalsContact O-OG1 3.1Å; W258-Q262 WeakPolarHBondContact O-CA 3.02Å; W258-Q262 WeakPolarHBondContact O-CB 2.91Å; W258-Q262 PolarHBondContact O-N 3.1Å
259	H	66.9	Low	76.3	Confident	120 Å²	120	81.8 Å²	81.8	56%	0.556	46%	0.461	S	S	*	.	H	α-helix	trans	-64.5	-40	176.8	-165.1	-80.2	0	0	0	111.5	S255 V256 I257 V263	S255-H259 VanDerWaalsContact O-CB 3.26Å; S255-H259 WeakPolarHBondContact O-CB 3.47Å; S255-H259 PolarHBondContact O-N 3.04Å; V256-H259 PolarHBondContact O-N 2.65Å; I257-H259 PolarHBondContact O-N 2.9Å; H259-V263 WeakPolarHBondContact O-CB 3.44Å; H259-V263 WeakPolarHBondContact O-CG2 3.26Å; H259-V263 PolarHBondContact O-N 2.93Å
260	R	73.9	Confident	76.9	Confident	151 Å²	151	87.7 Å²	87.7	57%	0.57	49%	0.487	S	S	*	.	H	α-helix	trans	-66.9	-44	176.8	-70	174	100.8	172.2	6.7	112	V256 I257 W258 V264	V256-R260 VanDerWaalsContact O-CG 3.27Å; V256-R260 WeakPolarHBondContact O-CG 3.39Å; V256-R260 PolarHBondContact O-N 2.79Å; I257-R260 PolarHBondContact O-N 2.93Å; W258-R260 VanDerWaalsContact C-N 3.35Å; W258-R260 PolarHBondContact O-N 3.45Å; R260-V264 WeakPolarHBondContact O-CG2 3.28Å; R260-V264 PolarHBondContact O-N 2.97Å
261	T	78.6	Confident	77.8	Confident	81 Å²	81	86.8 Å²	86.8	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-71.3	-35.5	177.3	53.8	0	0	0	0	112.2	I257 W258 V264 G265	I257-T261 HydrophobicContact CG2-CG2 4.35Å; I257-T261 WeakPolarHBondContact O-CG2 3.45Å; I257-T261 PolarHBondContact O-N 3.34Å; I257-T261 PolarHBondContact O-OG1 3.12Å; I257-T261 VanDerWaalsContact O-OG1 3.05Å; W258-T261 WeakPolarHBondContact CA-OG1 3.21Å; W258-T261 PolarHBondContact O-N 3.39Å; W258-T261 PolarHBondContact O-OG1 3.18Å; W258-T261 VanDerWaalsContact O-OG1 3.1Å; T261-V264 PolarHBondContact O-N 3.39Å; T261-G265 PolarHBondContact O-N 3.48Å
262	Q	79	Confident	78.8	Confident	94 Å²	94	89 Å²	89	44%	0.439	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-46.1	174.7	-179.2	177.8	11.5	0	0	111.1	W258 V264 G265 I266	W258-Q262 WeakPolarHBondContact O-CA 3.02Å; W258-Q262 WeakPolarHBondContact O-CB 2.91Å; W258-Q262 PolarHBondContact O-N 3.1Å; Q262-V264 PolarHBondContact O-N 2.88Å; Q262-G265 PolarHBondContact O-N 3.48Å; Q262-I266 HydrophobicContact CG-CD1 3.85Å; Q262-I266 HydrophobicContact CG-CG1 4.43Å; Q262-I266 WeakPolarHBondContact O-CB 3.37Å; Q262-I266 WeakPolarHBondContact O-CG1 3.37Å; Q262-I266 PolarHBondContact O-N 3.04Å
263	V	84.3	Confident	80.2	Confident	54 Å²	54	90.4 Å²	90.4	33%	0.327	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-45.9	177.7	170.4	0	0	0	0	111	H259 G265 I266 F267	H259-V263 WeakPolarHBondContact O-CB 3.44Å; H259-V263 WeakPolarHBondContact O-CG2 3.26Å; H259-V263 PolarHBondContact O-N 2.93Å; V263-G265 VanDerWaalsContact C-N 3.34Å; V263-G265 PolarHBondContact O-N 3.32Å; V263-I266 PolarHBondContact O-N 3.46Å; V263-F267 HydrophobicContact CG1-CD2 3.68Å; V263-F267 HydrophobicContact CG1-CE2 3.44Å; V263-F267 VanDerWaalsContact CG1-CE2 3.44Å; V263-F267 WeakPolarHBondContact O-CD2 3.33Å; V263-F267 PolarHBondContact O-N 3.05Å
264	V	85.6	Confident	81.5	Confident	99 Å²	99	92.4 Å²	92.4	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-42.8	175.9	174.4	0	0	0	0	111.2	R260 T261 Q262 F267 A268	R260-V264 WeakPolarHBondContact O-CG2 3.28Å; R260-V264 PolarHBondContact O-N 2.97Å; T261-V264 PolarHBondContact O-N 3.39Å; Q262-V264 PolarHBondContact O-N 2.88Å; V264-F267 PolarHBondContact O-N 2.96Å; V264-A268 WeakPolarHBondContact O-CB 3.46Å; V264-A268 PolarHBondContact O-N 3.42Å
265	G	88.8	Confident	83.1	Confident	43 Å²	43	95.6 Å²	95.6	44%	0.443	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-39.7	177.1	0	0	0	0	0	113	T261 Q262 V263 G269	T261-G265 PolarHBondContact O-N 3.48Å; Q262-G265 PolarHBondContact O-N 3.48Å; V263-G265 VanDerWaalsContact C-N 3.34Å; V263-G265 PolarHBondContact O-N 3.32Å; G265-G269 PolarHBondContact O-N 3.31Å
266	I	90.5	Very high	84.6	Confident	77 Å²	77	96.2 Å²	96.2	40%	0.395	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-50.3	174.7	-72.5	167.4	0	0	0	109.9	Q262 V263 A268 G269 F270	Q262-I266 HydrophobicContact CG-CD1 3.85Å; Q262-I266 HydrophobicContact CG-CG1 4.43Å; Q262-I266 WeakPolarHBondContact O-CB 3.37Å; Q262-I266 WeakPolarHBondContact O-CG1 3.37Å; Q262-I266 PolarHBondContact O-N 3.04Å; V263-I266 PolarHBondContact O-N 3.46Å; I266-A268 PolarHBondContact O-N 2.81Å; I266-G269 PolarHBondContact O-N 3.07Å; I266-F270 HydrophobicContact CG2-CD2 3.58Å; I266-F270 HydrophobicContact CG2-CE2 3.69Å; I266-F270 VanDerWaalsContact O-CD2 3.31Å; I266-F270 WeakPolarHBondContact O-CD2 3.49Å; I266-F270 PolarHBondContact O-N 3.36Å
267	F	91.1	Very high	85.9	Confident	151 Å²	151	95 Å²	95	66%	0.662	51%	0.511	S	S	*	.	H	α-helix	trans	-64	-41.9	179.7	-76.5	-62.5	0	0	0	112.8	V263 V264 G271	V263-F267 HydrophobicContact CG1-CD2 3.68Å; V263-F267 HydrophobicContact CG1-CE2 3.44Å; V263-F267 VanDerWaalsContact CG1-CE2 3.44Å; V263-F267 WeakPolarHBondContact O-CD2 3.33Å; V263-F267 PolarHBondContact O-N 3.05Å; V264-F267 PolarHBondContact O-N 2.96Å; F267-G271 PolarHBondContact O-N 3.29Å
268	A	90.6	Very high	87.2	Confident	65 Å²	65	93 Å²	93	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-42	175	0	0	0	0	0	111.7	V264 I266 G271 L272	V264-A268 WeakPolarHBondContact O-CB 3.46Å; V264-A268 PolarHBondContact O-N 3.42Å; I266-A268 PolarHBondContact O-N 2.81Å; A268-G271 PolarHBondContact O-N 3.47Å; A268-L272 WeakPolarHBondContact O-CB 3.31Å; A268-L272 PolarHBondContact O-N 2.94Å
269	G	93.5	Very high	88.4	Confident	38 Å²	38	87.6 Å²	87.6	39%	0.392	49%	0.494	S	S	.	.	H	α-helix	trans	-64.7	-47.5	177.8	0	0	0	0	0	112.9	G265 I266 G271 L272 L273	G265-G269 PolarHBondContact O-N 3.31Å; I266-G269 PolarHBondContact O-N 3.07Å; G269-G271 VanDerWaalsContact C-N 3.34Å; G269-G271 PolarHBondContact O-N 3.37Å; G269-L272 PolarHBondContact O-N 2.86Å; G269-L273 WeakPolarHBondContact O-CB 3.24Å; G269-L273 PolarHBondContact O-N 3.27Å
270	F	92.8	Very high	89.6	Confident	130 Å²	130	88.6 Å²	88.6	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-62	-41.4	174	-88	-73	0	0	0	111.8	I266 L273 L274	I266-F270 HydrophobicContact CG2-CD2 3.58Å; I266-F270 HydrophobicContact CG2-CE2 3.69Å; I266-F270 VanDerWaalsContact O-CD2 3.31Å; I266-F270 WeakPolarHBondContact O-CD2 3.49Å; I266-F270 PolarHBondContact O-N 3.36Å; F270-L273 PolarHBondContact O-N 2.66Å; F270-L274 WeakPolarHBondContact O-CB 3.44Å; F270-L274 WeakPolarHBondContact O-CG 3.32Å; F270-L274 PolarHBondContact O-N 2.95Å
271	G	92.8	Very high	90.2	Very high	40 Å²	40	86.5 Å²	86.5	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-59.5	-47	175.5	0	0	0	0	0	112.5	F267 A268 G269 L274 L275	F267-G271 PolarHBondContact O-N 3.29Å; A268-G271 PolarHBondContact O-N 3.47Å; G269-G271 VanDerWaalsContact C-N 3.34Å; G269-G271 PolarHBondContact O-N 3.37Å; G271-L274 PolarHBondContact O-N 3.48Å; G271-L275 WeakPolarHBondContact O-CB 3.46Å; G271-L275 PolarHBondContact O-N 3.26Å
272	L	94.8	Very high	90.7	Very high	115 Å²	115	88.3 Å²	88.3	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-43.4	177	-176	66.4	0	0	0	111.9	A268 G269 L274 L275 V276	A268-L272 WeakPolarHBondContact O-CB 3.31Å; A268-L272 PolarHBondContact O-N 2.94Å; G269-L272 PolarHBondContact O-N 2.86Å; L272-L274 PolarHBondContact O-N 3.37Å; L272-L275 WeakPolarHBondContact O-CB 3.48Å; L272-L275 PolarHBondContact O-N 2.83Å; L272-V276 WeakPolarHBondContact O-CG2 3.46Å; L272-V276 PolarHBondContact O-N 3.1Å
273	L	94.7	Very high	91.1	Very high	109 Å²	109	89.9 Å²	89.9	57%	0.571	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-43.3	179.2	-173.2	146.3	0	0	0	111.4	G269 F270 L275 V276 A277	G269-L273 WeakPolarHBondContact O-CB 3.24Å; G269-L273 PolarHBondContact O-N 3.27Å; F270-L273 PolarHBondContact O-N 2.66Å; L273-L275 VanDerWaalsContact C-N 3.34Å; L273-L275 PolarHBondContact O-N 2.78Å; L273-V276 PolarHBondContact O-N 3.05Å; L273-A277 WeakPolarHBondContact O-CB 3.34Å; L273-A277 PolarHBondContact O-N 3.43Å
274	L	92	Very high	91.1	Very high	109 Å²	109	89.1 Å²	89.1	57%	0.571	51%	0.513	S	S	*	.	H	α-helix	trans	-63.9	-38.8	175.1	-73	173.5	0	0	0	112.1	F270 G271 L272 A277 S278	F270-L274 WeakPolarHBondContact O-CB 3.44Å; F270-L274 WeakPolarHBondContact O-CG 3.32Å; F270-L274 PolarHBondContact O-N 2.95Å; G271-L274 PolarHBondContact O-N 3.48Å; L272-L274 PolarHBondContact O-N 3.37Å; L274-A277 PolarHBondContact O-N 2.82Å; L274-S278 WeakPolarHBondContact O-CB 3.5Å; L274-S278 PolarHBondContact O-N 2.84Å
275	L	94.3	Very high	91	Very high	127 Å²	127	87.5 Å²	87.5	67%	0.665	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-43.4	177.8	-154.6	163.1	0	0	0	111	G271 L272 L273 P279	G271-L275 WeakPolarHBondContact O-CB 3.46Å; G271-L275 PolarHBondContact O-N 3.26Å; L272-L275 WeakPolarHBondContact O-CB 3.48Å; L272-L275 PolarHBondContact O-N 2.83Å; L273-L275 VanDerWaalsContact C-N 3.34Å; L273-L275 PolarHBondContact O-N 2.78Å; L275-P279 VanDerWaalsContact O-CD 3.27Å; L275-P279 WeakPolarHBondContact O-CD 3.39Å
276	V	95	Very high	90.7	Very high	83 Å²	83	88.9 Å²	88.9	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-72.2	-37.7	177.2	176.2	0	0	0	0	112.1	L272 L273 P279 F280	L272-V276 WeakPolarHBondContact O-CG2 3.46Å; L272-V276 PolarHBondContact O-N 3.1Å; L273-V276 PolarHBondContact O-N 3.05Å; V276-P279 WeakPolarHBondContact O-CD 3.22Å; V276-F280 VanDerWaalsContact O-CD2 3.24Å; V276-F280 WeakPolarHBondContact O-CD2 3.46Å
277	A	91.5	Very high	90.2	Very high	28 Å²	28	90.6 Å²	90.6	23%	0.231	51%	0.514	C	S	.	.	H	α-helix	trans	-74.5	-27	-180	0	0	0	0	0	112.9	L273 L274 F280 L281	L273-A277 WeakPolarHBondContact O-CB 3.34Å; L273-A277 PolarHBondContact O-N 3.43Å; L274-A277 PolarHBondContact O-N 2.82Å; A277-F280 PolarHBondContact O-N 3.48Å; A277-L281 HydrophobicContact CB-CD1 4.32Å; A277-L281 WeakPolarHBondContact O-CG 3.25Å; A277-L281 PolarHBondContact O-N 3.3Å
278	S	93.2	Very high	89.5	Confident	55 Å²	55	87.6 Å²	87.6	39%	0.385	51%	0.508	S	S	.	.	H	α-helix	trans	-53.2	-48.8	-176.2	173.6	0	0	0	0	113.7	L274 F280 L281 L282	L274-S278 WeakPolarHBondContact O-CB 3.5Å; L274-S278 PolarHBondContact O-N 2.84Å; S278-F280 VanDerWaalsContact C-N 3.34Å; S278-F280 PolarHBondContact O-N 2.87Å; S278-L281 PolarHBondContact O-N 2.95Å; S278-L282 VanDerWaalsContact O-CG 3.32Å; S278-L282 WeakPolarHBondContact O-CG 3.35Å; S278-L282 PolarHBondContact O-N 3.06Å
279	P	92.8	Very high	88.8	Confident	70 Å²	70	89.6 Å²	89.6	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-57.6	-40.9	174.1	-25.6	32.9	0	0	0	114.3	L275 V276 L282 L283	L275-P279 VanDerWaalsContact O-CD 3.27Å; L275-P279 WeakPolarHBondContact O-CD 3.39Å; V276-P279 WeakPolarHBondContact O-CD 3.22Å; P279-L282 PolarHBondContact O-N 3.5Å; P279-L283 VanDerWaalsContact O-CG 3.31Å; P279-L283 WeakPolarHBondContact O-CG 3.16Å; P279-L283 PolarHBondContact O-N 3.21Å; P279-L283 VanDerWaalsContact O-N 3.08Å
280	F	91	Very high	87.8	Confident	142 Å²	142	91.7 Å²	91.7	62%	0.623	52%	0.517	S	S	*	.	H	α-helix	trans	-71	-38.9	179.9	-63.2	-80.2	0	0	0	111.9	V276 A277 S278 L283 A284	V276-F280 VanDerWaalsContact O-CD2 3.24Å; V276-F280 WeakPolarHBondContact O-CD2 3.46Å; A277-F280 PolarHBondContact O-N 3.48Å; S278-F280 VanDerWaalsContact C-N 3.34Å; S278-F280 PolarHBondContact O-N 2.87Å; F280-L283 PolarHBondContact O-N 3.47Å; F280-A284 WeakPolarHBondContact O-CB 3.33Å; F280-A284 PolarHBondContact O-N 3.48Å
281	L	86.3	Confident	86.5	Confident	106 Å²	106	89.2 Å²	89.2	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-64.1	-42.1	175.1	-68.7	174.6	0	0	0	111.1	A277 S278 L283 A284 T285	A277-L281 HydrophobicContact CB-CD1 4.32Å; A277-L281 WeakPolarHBondContact O-CG 3.25Å; A277-L281 PolarHBondContact O-N 3.3Å; S278-L281 PolarHBondContact O-N 2.95Å; L281-L283 PolarHBondContact O-N 3.35Å; L281-A284 PolarHBondContact O-N 2.9Å; L281-T285 PolarHBondContact O-N 3.45Å; L281-T285 PolarHBondContact O-OG1 3.4Å
282	L	89.3	Confident	85.2	Confident	119 Å²	119	95 Å²	95	62%	0.623	53%	0.528	S	S	*	.	H	α-helix	trans	-63.5	-38.7	175.8	-71	173.4	0	0	0	112.4	S278 P279 P286	S278-L282 VanDerWaalsContact O-CG 3.32Å; S278-L282 WeakPolarHBondContact O-CG 3.35Å; S278-L282 PolarHBondContact O-N 3.06Å; P279-L282 PolarHBondContact O-N 3.5Å; L282-P286 VanDerWaalsContact O-CD 3.24Å; L282-P286 WeakPolarHBondContact O-CD 3.5Å
283	L	89.1	Confident	83.3	Confident	127 Å²	127	93.8 Å²	93.8	67%	0.665	53%	0.528	S	S	*	.	H	α-helix	trans	-70.4	-34.6	175.1	-70.8	171.4	0	0	0	113	P279 F280 L281 P286	P279-L283 VanDerWaalsContact O-CG 3.31Å; P279-L283 WeakPolarHBondContact O-CG 3.16Å; P279-L283 PolarHBondContact O-N 3.21Å; P279-L283 VanDerWaalsContact O-N 3.08Å; F280-L283 PolarHBondContact O-N 3.47Å; L281-L283 PolarHBondContact O-N 3.35Å; L283-P286 WeakPolarHBondContact O-CD 3.47Å; L283-P286 WeakPolarHBondContact O-CG 3.39Å
284	A	83.6	Confident	81.2	Confident	39 Å²	39	97.2 Å²	97.2	32%	0.322	54%	0.539	S	S	.	.	H	α-helix	trans	-77.1	-24.4	178.1	0	0	0	0	0	113.1	F280 L281 I287 V288	F280-A284 WeakPolarHBondContact O-CB 3.33Å; F280-A284 PolarHBondContact O-N 3.48Å; L281-A284 PolarHBondContact O-N 2.9Å; A284-I287 WeakPolarHBondContact O-CB 3.31Å; A284-I287 PolarHBondContact O-N 2.92Å; A284-I287 VanDerWaalsContact O-N 3.11Å; A284-V288 WeakPolarHBondContact O-CG2 3.4Å; A284-V288 PolarHBondContact O-N 2.9Å
285	T	83.8	Confident	79.4	Confident	64 Å²	64	97.4 Å²	97.4	39%	0.393	55%	0.548	S	S	.	.	H	α-helix	trans	-53.4	-51.1	-178.1	-60.4	0	0	0	0	113.6	L281 I287 V288 L289	L281-T285 PolarHBondContact O-N 3.45Å; L281-T285 PolarHBondContact O-OG1 3.4Å; T285-I287 VanDerWaalsContact C-N 3.3Å; T285-I287 PolarHBondContact O-N 2.93Å; T285-V288 PolarHBondContact O-N 3.36Å; T285-L289 HydrophobicContact CG2-CD1 3.73Å; T285-L289 HydrophobicContact CG2-CG 4.36Å; T285-L289 WeakPolarHBondContact O-CB 3.24Å; T285-L289 VanDerWaalsContact O-CG 3.26Å; T285-L289 WeakPolarHBondContact O-CG 3.38Å; T285-L289 PolarHBondContact O-N 2.91Å
286	P	81.5	Confident	77.4	Confident	73 Å²	73	96.7 Å²	96.7	47%	0.474	55%	0.553	S	S	.	*	H	α-helix	trans	-64.6	-31.6	177.4	22.8	-32.7	0	0	0	113.2	L282 L283 C290	L282-P286 VanDerWaalsContact O-CD 3.24Å; L282-P286 WeakPolarHBondContact O-CD 3.5Å; L283-P286 WeakPolarHBondContact O-CD 3.47Å; L283-P286 WeakPolarHBondContact O-CG 3.39Å; P286-C290 VanDerWaalsContact O-CB 3.25Å; P286-C290 WeakPolarHBondContact O-CB 3.49Å; P286-C290 PolarHBondContact O-N 3.22Å; P286-C290 PolarHBondContact O-SG 3.31Å
287	I	79.8	Confident	75.2	Confident	113 Å²	113	101.7 Å²	101.7	58%	0.579	57%	0.568	S	S	*	*	H	α-helix	trans	-70.2	-47.1	178.5	-59.5	173.2	0	0	0	110.1	A284 T285 C290 C291	A284-I287 WeakPolarHBondContact O-CB 3.31Å; A284-I287 PolarHBondContact O-N 2.92Å; A284-I287 VanDerWaalsContact O-N 3.11Å; T285-I287 VanDerWaalsContact C-N 3.3Å; T285-I287 PolarHBondContact O-N 2.93Å; I287-C290 PolarHBondContact O-N 3.49Å; I287-C291 WeakPolarHBondContact O-CB 3.27Å; I287-C291 PolarHBondContact O-N 3.1Å; I287-C291 PolarHBondContact O-SG 3.11Å
288	V	78	Confident	73.3	Confident	88 Å²	88	103.2 Å²	103.2	53%	0.533	59%	0.586	S	S	.	*	H	α-helix	trans	-65.5	-41.1	178.9	174.9	0	0	0	0	111.4	A284 T285 C291 K292	A284-V288 WeakPolarHBondContact O-CG2 3.4Å; A284-V288 PolarHBondContact O-N 2.9Å; T285-V288 PolarHBondContact O-N 3.36Å; V288-C291 PolarHBondContact O-N 3.35Å; V288-K292 PolarHBondContact O-N 2.93Å
289	L	75.9	Confident	71.4	Confident	106 Å²	106	107.9 Å²	107.9	56%	0.555	61%	0.607	S	S	*	*	H	α-helix	trans	-65.6	-39.3	175.1	-70.7	172.2	0	0	0	112	T285 K292 C293	T285-L289 HydrophobicContact CG2-CD1 3.73Å; T285-L289 HydrophobicContact CG2-CG 4.36Å; T285-L289 WeakPolarHBondContact O-CB 3.24Å; T285-L289 VanDerWaalsContact O-CG 3.26Å; T285-L289 WeakPolarHBondContact O-CG 3.38Å; T285-L289 PolarHBondContact O-N 2.91Å; L289-K292 PolarHBondContact O-N 3.36Å; L289-C293 PolarHBondContact O-N 2.9Å; L289-C293 VanDerWaalsContact O-N 3.1Å; L289-C293 PolarHBondContact O-SG 2.82Å
290	C	70.9	Confident	69.4	Low	83 Å²	83	112.4 Å²	112.4	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-66.9	-38.7	174.4	-74.1	0	0	0	0	112.7	P286 I287 C293 K294	P286-C290 VanDerWaalsContact O-CB 3.25Å; P286-C290 WeakPolarHBondContact O-CB 3.49Å; P286-C290 PolarHBondContact O-N 3.22Å; P286-C290 PolarHBondContact O-SG 3.31Å; I287-C290 PolarHBondContact O-N 3.49Å; C290-C293 PolarHBondContact O-N 3.07Å; C290-K294 PolarHBondContact O-N 3.4Å; C290-K294 VanDerWaalsContact O-N 3.12Å
291	C	67.1	Low	67.6	Low	78 Å²	78	113.2 Å²	113.2	53%	0.527	64%	0.638	S	S	.	*	H	α-helix	trans	-64.9	-39.3	176	-70.4	0	0	0	0	112	I287 V288 K294 C295	I287-C291 WeakPolarHBondContact O-CB 3.27Å; I287-C291 PolarHBondContact O-N 3.1Å; I287-C291 PolarHBondContact O-SG 3.11Å; V288-C291 PolarHBondContact O-N 3.35Å; C291-K294 PolarHBondContact O-N 2.93Å; C291-C295 PolarHBondContact O-N 2.96Å
292	K	63.7	Low	66.2	Low	160 Å²	160	113.8 Å²	113.8	70%	0.696	65%	0.648	S	S	*	*	H	α-helix	trans	-65.2	-38.6	173.3	-96.6	-162.6	159	108.7	0	112.8	V288 L289 K294	V288-K292 PolarHBondContact O-N 2.93Å; L289-K292 PolarHBondContact O-N 3.36Å; K292-K294 VanDerWaalsContact C-N 3.28Å; K292-K294 PolarHBondContact O-N 3.08Å
293	C	56.2	Low	64.2	Low	90 Å²	90	115.9 Å²	115.9	61%	0.608	66%	0.66	S	S	*	*	H	α-helix	trans	-69.6	-23.7	177.5	-65.3	0	0	0	0	113.5	L289 C290	L289-C293 PolarHBondContact O-N 2.9Å; L289-C293 VanDerWaalsContact O-N 3.1Å; L289-C293 PolarHBondContact O-SG 2.82Å; C290-C293 PolarHBondContact O-N 3.07Å
294	K	51.2	Low	62.7	Low	182 Å²	182	115.4 Å²	115.4	79%	0.791	66%	0.664	S	S	*	*	H	α-helix	trans	-83.4	-27.1	179.7	-132.6	157.9	179.1	168.1	0	113.1	C290 C291 K292	C290-K294 PolarHBondContact O-N 3.4Å; C290-K294 VanDerWaalsContact O-N 3.12Å; C291-K294 PolarHBondContact O-N 2.93Å; K292-K294 VanDerWaalsContact C-N 3.28Å; K292-K294 PolarHBondContact O-N 3.08Å
295	C	52.8	Low	61.4	Low	112 Å²	112	123.8 Å²	123.8	76%	0.757	71%	0.712	S	S	*	*	H	α-helix	trans	-73.2	-25.6	172	-86.7	0	0	0	0	113.9	C291 K297	C291-C295 PolarHBondContact O-N 2.96Å; C295-K297 VanDerWaalsContact C-N 3.32Å; C295-K297 PolarHBondContact O-N 2.9Å
296	S	52.4	Low	60.3	Low	112 Å²	112	126.8 Å²	126.8	78%	0.783	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	3.2	179.8	-73.9	0	0	0	0	115
297	K	49.2	Very low	59.2	Low	189 Å²	189	129.6 Å²	129.6	82%	0.822	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	20.7	-170.6	-141	163.8	-175.8	166.7	0	114.1	C295	C295-K297 VanDerWaalsContact C-N 3.32Å; C295-K297 PolarHBondContact O-N 2.9Å
298	G	52.1	Low	58	Low	59 Å²	59	130.6 Å²	130.6	61%	0.608	75%	0.75	S	S	*	*	S	Bend	trans	-118.4	7.6	-168.9	0	0	0	0	0	117.1
299	D	52.8	Low	56.8	Low	154 Å²	154	133.1 Å²	133.1	82%	0.824	76%	0.762	S	S	*	*			trans	-139.1	78.4	178.5	-69.5	-47	0	0	0	110.5
300	D	49.8	Very low	55.6	Low	165 Å²	165	134.8 Å²	134.8	88%	0.882	78%	0.775	S	S	*	*			trans	-136.4	82	160.8	-80.6	-56.7	0	0	0	107.5
301	D	53.3	Low	54.6	Low	158 Å²	158	138.2 Å²	138.2	85%	0.845	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.5	126.9	166.9	-96.1	-46.8	0	0	0	109.5
302	P	57.2	Low	53.7	Low	118 Å²	118	142.5 Å²	142.5	77%	0.766	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79.8	127.2	173.6	29.6	-29.2	0	0	0	111.6
303	L	47.1	Very low	53	Low	164 Å²	164	141.2 Å²	141.2	86%	0.859	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-56.7	142.3	173	-125.6	88.3	0	0	0	111.7
304	P	57.4	Low	52.7	Low	117 Å²	117	145.4 Å²	145.4	76%	0.76	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-80.7	141.3	177.1	32.9	-30.4	0	0	0	111.4
305	T	56.9	Low	52.8	Low	215 Å²	215	142.1 Å²	142.1	100%	1.319	84%	0.839	S	S	*	*			trans	-68.4	0	168	46	0	0	0	0	113.1

Retrieved 305 of 305 residues in 142.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).