A0A087YD19_POEFO Loading...

Exosome complex component MTR3

Non-catalytic component of the RNA exosome complex which has 3'->5' exoribonuclease activity and participates in a multitude of cellular RNA processing and degradation events.

AlphaFold DB , UniProt , Accession A0A087YD19, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 274 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	M	54.4	Low	78.4	Confident	226 Å²	226	135.3 Å²	135.3	100%	1.113	73%	0.728	S	S	*	*				0	141.4	0	-74.2	-179.7	172.5	0	0	108.3	T3	M1-T3 PolarHBondContact O-N 3.1Å
2	P	59.2	Low	78.9	Confident	137 Å²	137	141.5 Å²	141.5	89%	0.89	75%	0.75	S	S	*	*			trans	-62	113.2	178.6	24.5	-30.5	0	0	0	109.1	D4	P2-D4 PolarHBondContact O-N 3.16Å
3	T	72.3	Confident	79.2	Confident	118 Å²	118	136.8 Å²	136.8	72%	0.724	74%	0.743	S	S	*	*			trans	-70.1	123.2	176.5	48.9	0	0	0	0	108.9	M1 T5	M1-T3 PolarHBondContact O-N 3.1Å; T3-T5 PolarHBondContact O-N 3.28Å; T3-T5 VanDerWaalsContact O-N 3.07Å
4	D	78.6	Confident	79.5	Confident	65 Å²	65	133.1 Å²	133.1	35%	0.348	73%	0.733	S	S	.	*			trans	-62.1	110.3	175.4	-173.9	-3.3	0	0	0	109.6	P2 K6 R7	P2-D4 PolarHBondContact O-N 3.16Å; D4-K6 VanDerWaalsContact C-N 3.35Å; D4-K6 WeakPolarHBondContact OD1-CB 3.29Å; D4-K6 PolarHBondContact OD1-N 3.08Å; D4-R7 VanDerWaalsContact OD2-CD 3.28Å; D4-R7 WeakPolarHBondContact OD2-CD 3.3Å; D4-R7 WeakPolarHBondContact OD2-CG 3.45Å; D4-R7 IonicContact OD2-CZ 3.68Å; D4-R7 IonicContact OD2-NE 3.52Å; D4-R7 PolarHBondContact OD2-NE 3.2Å; D4-R7 IonicContact OD2-NH1 3.18Å; D4-R7 PolarHBondContact OD2-NH1 3.28Å; D4-R7 IonicContact OD2-NH2 2.79Å
5	T	85.1	Confident	79.9	Confident	119 Å²	119	133.5 Å²	133.5	73%	0.73	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-9.1	-179.7	53.9	0	0	0	0	113	T3	T3-T5 PolarHBondContact O-N 3.28Å; T3-T5 VanDerWaalsContact O-N 3.07Å
6	K	86.5	Confident	80.1	Confident	192 Å²	192	126.1 Å²	126.1	84%	0.835	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-2.9	-177	-63.4	-177.8	178.6	-179.6	0	113	D4	D4-K6 VanDerWaalsContact C-N 3.35Å; D4-K6 WeakPolarHBondContact OD1-CB 3.29Å; D4-K6 PolarHBondContact OD1-N 3.08Å
7	R	83.9	Confident	80.4	Confident	91 Å²	91	124.8 Å²	124.8	34%	0.343	69%	0.688	S	S	.	*	S	Bend	trans	-132	166.4	-174	-62.7	-168.8	-165.8	129.4	29.1	112.9	D4 R9	D4-R7 VanDerWaalsContact OD2-CD 3.28Å; D4-R7 WeakPolarHBondContact OD2-CD 3.3Å; D4-R7 WeakPolarHBondContact OD2-CG 3.45Å; D4-R7 IonicContact OD2-CZ 3.68Å; D4-R7 IonicContact OD2-NE 3.52Å; D4-R7 PolarHBondContact OD2-NE 3.2Å; D4-R7 IonicContact OD2-NH1 3.18Å; D4-R7 PolarHBondContact OD2-NH1 3.28Å; D4-R7 IonicContact OD2-NH2 2.79Å; R7-R9 PolarHBondContact O-N 3.03Å
8	V	87.2	Confident	80.4	Confident	144 Å²	144	122.6 Å²	122.6	87%	0.873	67%	0.674	S	S	*	*			trans	-58.7	131.7	173.1	-177.4	0	0	0	0	109.3	G10	V8-G10 PolarHBondContact O-N 3.4Å; V8-G10 VanDerWaalsContact O-N 3.11Å
9	R	84.3	Confident	80.4	Confident	232 Å²	232	122.2 Å²	122.2	88%	0.875	67%	0.67	S	S	*	*			trans	-72.2	104	178.3	-64.6	-176	-177.1	-179	0.8	109.4	R7	R7-R9 PolarHBondContact O-N 3.03Å
10	G	83.7	Confident	80.4	Confident	57 Å²	57	123.8 Å²	123.8	59%	0.588	67%	0.67	S	S	*	*			trans	-90.5	-177.5	170.9	0	0	0	0	0	112.6	V8	V8-G10 PolarHBondContact O-N 3.4Å; V8-G10 VanDerWaalsContact O-N 3.11Å
11	P	87.7	Confident	80.3	Confident	107 Å²	107	126.2 Å²	126.2	70%	0.695	67%	0.67	S	S	*	*			trans	-61.2	152.3	168.1	28.8	-35	0	0	0	110.9	A13	P11-A13 VanDerWaalsContact C-N 3.29Å; P11-A13 PolarHBondContact O-N 2.89Å
12	E	84.3	Confident	80.5	Confident	210 Å²	210	120.7 Å²	120.7	98%	0.981	65%	0.654	S	S	*	*	S	Bend	trans	-64.7	-34.4	-179.3	-63.1	-171.6	162.9	0	0	112.7
13	A	82.5	Confident	80.6	Confident	80 Å²	80	121.6 Å²	121.6	66%	0.661	64%	0.639	S	S	*	*			trans	-134.9	141.9	175.8	0	0	0	0	0	110.5	P11	P11-A13 VanDerWaalsContact C-N 3.29Å; P11-A13 PolarHBondContact O-N 2.89Å
14	S	83.9	Confident	79.7	Confident	86 Å²	86	120.9 Å²	120.9	60%	0.601	64%	0.637	S	S	*	*			trans	-132.1	119.8	169.7	59.6	0	0	0	0	108.1
15	Q	84.6	Confident	78.5	Confident	138 Å²	138	122.1 Å²	122.1	65%	0.645	66%	0.656	S	S	*	*			trans	-100.5	143.8	176	-70.2	-178.4	-4.7	0	0	109.9	L19 F20	Q15-L19 HydrophobicContact CB-CD1 4.31Å; Q15-F20 HydrophobicContact CB-CE2 4.4Å
16	S	84.1	Confident	76.9	Confident	16 Å²	16	123 Å²	123	11%	0.112	65%	0.652	C	S	.	*			trans	-72	140.5	176.4	70.7	0	0	0	0	110.1	L18 L19	S16-L18 PolarHBondContact O-N 3.37Å; S16-L19 PolarHBondContact O-N 3.28Å
17	P	85.3	Confident	75.1	Confident	104 Å²	104	119.1 Å²	119.1	68%	0.675	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-64.9	-19	176.7	26.2	-33.8	0	0	0	112.4	L19 F20 W21	P17-L19 PolarHBondContact O-N 2.94Å; P17-F20 PolarHBondContact O-N 3.17Å; P17-W21 PolarHBondContact O-N 3.45Å
18	L	80	Confident	73.8	Confident	84 Å²	84	116.1 Å²	116.1	44%	0.44	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-61.1	-27.1	177.7	-64.6	175.2	0	0	0	113	S16 F20 W21 P106	S16-L18 PolarHBondContact O-N 3.37Å; L18-F20 VanDerWaalsContact C-N 3.27Å; L18-F20 PolarHBondContact O-N 2.95Å; L18-W21 PolarHBondContact O-N 2.93Å; L18-P106 HydrophobicContact CD1-CB 3.65Å
19	L	79.1	Confident	72.1	Confident	115 Å²	115	112 Å²	112	60%	0.602	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-65.8	-31.4	175.1	-66.6	171.2	0	0	0	112.5	Q15 S16 P17	Q15-L19 HydrophobicContact CB-CD1 4.31Å; S16-L19 PolarHBondContact O-N 3.28Å; P17-L19 PolarHBondContact O-N 2.94Å
20	F	82.3	Confident	70.5	Confident	154 Å²	154	104.7 Å²	104.7	68%	0.675	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-6.5	-179.9	-55.3	-75.6	0	0	0	112.4	Q15 P17 L18	Q15-F20 HydrophobicContact CB-CE2 4.4Å; P17-F20 PolarHBondContact O-N 3.17Å; L18-F20 VanDerWaalsContact C-N 3.27Å; L18-F20 PolarHBondContact O-N 2.95Å
21	W	76.8	Confident	68.9	Low	175 Å²	175	110 Å²	110	66%	0.663	61%	0.605	S	S	*	*			trans	-88.7	111.2	176.5	-171.3	-84.7	0	0	0	109.7	P17 L18 R23	P17-W21 PolarHBondContact O-N 3.45Å; L18-W21 PolarHBondContact O-N 2.93Å; W21-R23 VanDerWaalsContact C-N 3.28Å; W21-R23 PolarHBondContact O-N 3.07Å
22	S	60.1	Low	67.4	Low	110 Å²	110	106.9 Å²	106.9	77%	0.769	59%	0.592	S	S	*	*			trans	-69.5	88.6	167.4	57.5	0	0	0	0	108.8	P24	S22-P24 WeakPolarHBondContact O-CD 3.43Å
23	R	59.7	Low	66.3	Low	156 Å²	156	100.7 Å²	100.7	59%	0.589	57%	0.57	S	S	*	*			trans	-62.4	123.1	168.7	-112.6	177.5	-175.5	-178.5	-1.5	106.8	W21 A25	W21-R23 VanDerWaalsContact C-N 3.28Å; W21-R23 PolarHBondContact O-N 3.07Å; R23-A25 PolarHBondContact O-N 3.46Å
24	P	53.8	Low	65.6	Low	104 Å²	104	97.2 Å²	97.2	68%	0.675	54%	0.539	S	S	*	.			trans	-54.8	130.7	159.2	24.9	-29.7	0	0	0	105.6	S22 E26	S22-P24 WeakPolarHBondContact O-CD 3.43Å; P24-E26 PolarHBondContact O-N 2.98Å
25	A	53.2	Low	64.5	Low	90 Å²	90	96.9 Å²	96.9	74%	0.744	54%	0.542	S	S	*	.			trans	-54.7	104.8	179	0	0	0	0	0	107.1	R23 V27	R23-A25 PolarHBondContact O-N 3.46Å; A25-V27 VanDerWaalsContact C-N 3.3Å; A25-V27 VanDerWaalsContact O-CG2 3.31Å; A25-V27 WeakPolarHBondContact O-CG2 3.31Å; A25-V27 PolarHBondContact O-N 2.96Å
26	E	51.2	Low	63.3	Low	137 Å²	137	95 Å²	95	64%	0.64	54%	0.537	S	S	*	.			trans	-61.2	103.2	176.1	-98.3	177.6	160.9	0	0	105.6	P24 L28	P24-E26 PolarHBondContact O-N 2.98Å; E26-L28 VanDerWaalsContact C-N 3.27Å; E26-L28 PolarHBondContact O-N 2.95Å
27	V	50.4	Low	62.1	Low	112 Å²	112	96.8 Å²	96.8	68%	0.679	56%	0.557	S	S	*	*			trans	-72.8	93.8	-178.9	-174.3	0	0	0	0	105	A25 P29	A25-V27 VanDerWaalsContact C-N 3.3Å; A25-V27 VanDerWaalsContact O-CG2 3.31Å; A25-V27 WeakPolarHBondContact O-CG2 3.31Å; A25-V27 PolarHBondContact O-N 2.96Å; V27-P29 WeakPolarHBondContact O-CD 3.27Å; V27-P29 VanDerWaalsContact O-N 3.08Å
28	L	55.5	Low	61.3	Low	28 Å²	28	92.9 Å²	92.9	15%	0.147	53%	0.529	C	S	.	.			trans	-51.6	120.2	162.3	-75.2	164.7	0	0	0	106.1	E26 S30 E198 R203	E26-L28 VanDerWaalsContact C-N 3.27Å; E26-L28 PolarHBondContact O-N 2.95Å; L28-S30 PolarHBondContact O-N 3.44Å; L28-E198 HydrophobicContact CD1-CG 4.1Å; L28-R203 PolarHBondContact O-NH2 3.35Å; L28-R203 VanDerWaalsContact O-NH2 3.15Å
29	P	52.3	Low	60.6	Low	56 Å²	56	94.6 Å²	94.6	36%	0.364	53%	0.534	S	S	.	.			trans	-57	133.7	-174.4	19.1	-29.6	0	0	0	108.6	V27 H31 R40	V27-P29 WeakPolarHBondContact O-CD 3.27Å; V27-P29 VanDerWaalsContact O-N 3.08Å; P29-H31 PolarHBondContact O-N 3.19Å; P29-R40 PolarHBondContact O-NH1 3.47Å; P29-R40 PolarHBondContact O-NH2 3.01Å
30	S	50.4	Low	59.7	Low	79 Å²	79	90.9 Å²	90.9	55%	0.552	51%	0.513	S	S	*	.	S	Bend	trans	-69.6	-25.3	179.5	48	0	0	0	0	112.3	L28 R40	L28-S30 PolarHBondContact O-N 3.44Å; S30-R40 PolarHBondContact O-NH1 3.24Å
31	H	50.2	Low	58.7	Low	170 Å²	170	87.7 Å²	87.7	79%	0.787	50%	0.502	S	S	*	.	S	Bend	trans	-137.9	133.6	176.7	-66.8	-77	0	0	0	109.7	P29	P29-H31 PolarHBondContact O-N 3.19Å
32	G	56.8	Low	58.1	Low	41 Å²	41	84.4 Å²	84.4	42%	0.423	50%	0.495	S	S	.	.	S	Bend	trans	128.9	-178.9	178.5	0	0	0	0	0	113.9
33	P	60.3	Low	58.5	Low	80 Å²	80	79.8 Å²	79.8	52%	0.519	46%	0.461	S	S	.	.	S	Bend	trans	-59.6	148.2	173.2	25.9	-32.8	0	0	0	110.8
34	R	67.7	Low	59	Low	6 Å²	6	75 Å²	75	2%	0.023	45%	0.448	C	S	.	.			trans	-59	168.4	174.2	-63.1	-175.8	-152.7	-177.4	3.3	110.3	D36 G37 R38 Q39 R40 V191 V192	R34-D36 PolarHBondContact O-N 3.48Å; R34-G37 PolarHBondContact O-N 2.89Å; R34-R38 HydrophobicContact CB-CB 4.36Å; R34-R38 WeakPolarHBondContact CB-O 3.45Å; R34-R38 HydrophobicContact CG-CB 4.43Å; R34-R38 VanDerWaalsContact CG-O 3.27Å; R34-R38 WeakPolarHBondContact CG-O 3.44Å; R34-R38 PolarHBondContact N-O 3.46Å; R34-Q39 PolarHBondContact NE-O 2.82Å; R34-Q39 PolarHBondContact NH2-O 2.93Å; R34-R40 HydrophobicContact CG-CG 4.11Å; R34-V191 VanDerWaalsContact CZ-CG1 3.45Å; R34-V192 PolarHBondContact NH1-O 2.99Å
35	A	59.9	Low	60.2	Low	80 Å²	80	71.3 Å²	71.3	66%	0.661	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-29.9	175.7	0	0	0	0	0	112.7
36	D	59.4	Low	61.6	Low	99 Å²	99	67.6 Å²	67.6	53%	0.529	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4	177.4	-60.6	-19.7	0	0	0	114.4	R34 R38	R34-D36 PolarHBondContact O-N 3.48Å; D36-R38 VanDerWaalsContact C-N 3.3Å; D36-R38 HydrophobicContact CB-CG 4.43Å; D36-R38 PolarHBondContact O-N 2.92Å; D36-R38 IonicContact OD2-CZ 2.76Å; D36-R38 IonicContact OD2-NE 3.98Å; D36-R38 IonicContact OD2-NH2 2.79Å; D36-R38 PolarHBondContact OD2-NH2 2.89Å
37	G	59.8	Low	63.3	Low	52 Å²	52	66.1 Å²	66.1	54%	0.536	39%	0.392	S	S	.	.	S	Bend	trans	83.8	-7.2	-175.4	0	0	0	0	0	115.4	R34	R34-G37 PolarHBondContact O-N 2.89Å
38	R	68.4	Low	65.3	Low	22 Å²	22	62.2 Å²	62.2	8%	0.083	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-68.9	148	179.4	-65	-173.4	-88	152.3	-3.5	112.1	R34 D36 D44 R46 D193	R34-R38 HydrophobicContact CB-CB 4.36Å; R34-R38 WeakPolarHBondContact CB-O 3.45Å; R34-R38 HydrophobicContact CG-CB 4.43Å; R34-R38 VanDerWaalsContact CG-O 3.27Å; R34-R38 WeakPolarHBondContact CG-O 3.44Å; R34-R38 PolarHBondContact N-O 3.46Å; D36-R38 VanDerWaalsContact C-N 3.3Å; D36-R38 HydrophobicContact CB-CG 4.43Å; D36-R38 PolarHBondContact O-N 2.92Å; D36-R38 IonicContact OD2-CZ 2.76Å; D36-R38 IonicContact OD2-NE 3.98Å; D36-R38 IonicContact OD2-NH2 2.79Å; D36-R38 PolarHBondContact OD2-NH2 2.89Å; R38-D44 WeakPolarHBondContact CB-OD2 3.25Å; R38-D44 VanDerWaalsContact CG-OD2 3.24Å; R38-D44 WeakPolarHBondContact CG-OD2 3.43Å; R38-R46 VanDerWaalsContact CZ-CG 3.44Å; R38-D193 PolarHBondContact NH1-O 3.44Å
39	Q	65.3	Low	67.1	Low	120 Å²	120	66.1 Å²	66.1	56%	0.561	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-80.5	148.6	178.3	-69.2	-171	-9.5	0	0	112.1	R34 Q42	R34-Q39 PolarHBondContact NE-O 2.82Å; R34-Q39 PolarHBondContact NH2-O 2.93Å; Q39-Q42 HydrophobicContact CB-CB 4.45Å
40	R	61.1	Low	69.1	Low	38 Å²	38	64.3 Å²	64.3	14%	0.143	37%	0.372	C	S	.	.	S	Bend	trans	-79.3	151.1	168.1	-64.8	-178.5	177.8	-174.3	-0.2	108.6	P29 S30 R34 Q42	P29-R40 PolarHBondContact O-NH1 3.47Å; P29-R40 PolarHBondContact O-NH2 3.01Å; S30-R40 PolarHBondContact O-NH1 3.24Å; R34-R40 HydrophobicContact CG-CG 4.11Å; R40-Q42 PolarHBondContact O-N 2.83Å; R40-Q42 VanDerWaalsContact O-N 3.1Å
41	D	59.7	Low	71.1	Confident	87 Å²	87	65.8 Å²	65.8	47%	0.465	37%	0.366	S	S	.	.	S	Bend	trans	66.5	0.4	-178.4	-48.7	-36.2	0	0	0	116.8
42	Q	65.1	Low	73.2	Confident	106 Å²	106	58 Å²	58	50%	0.495	33%	0.33	S	S	.	.	S	Bend	trans	-99.3	140.9	166	-163.5	160.3	59.8	0	0	110.3	Q39 R40 D44	Q39-Q42 HydrophobicContact CB-CB 4.45Å; R40-Q42 PolarHBondContact O-N 2.83Å; R40-Q42 VanDerWaalsContact O-N 3.1Å; Q42-D44 PolarHBondContact O-N 3.49Å
43	V	67.4	Low	74.8	Confident	12 Å²	12	58.2 Å²	58.2	7%	0.073	33%	0.332	C	S	.	.			trans	-71.5	74.6	172.2	-175.5	0	0	0	0	108.5	V192 E247 K251	V43-V192 HydrophobicContact CG1-CG1 4.47Å; V43-E247 HydrophobicContact CG1-CB 4.39Å; V43-E247 HydrophobicContact CG2-CB 4.16Å; V43-K251 HydrophobicContact CB-CD 4.42Å; V43-K251 HydrophobicContact CG1-CD 3.95Å; V43-K251 PolarHBondContact O-NZ 3.14Å
44	D	70.9	Confident	76.2	Confident	57 Å²	57	58 Å²	58	31%	0.305	33%	0.326	S	S	.	.			trans	-108.7	105.2	-177.5	-164.8	16	0	0	0	109.4	R38 Q42	R38-D44 WeakPolarHBondContact CB-OD2 3.25Å; R38-D44 VanDerWaalsContact CG-OD2 3.24Å; R38-D44 WeakPolarHBondContact CG-OD2 3.43Å; Q42-D44 PolarHBondContact O-N 3.49Å
45	V	78.3	Confident	77.4	Confident	25 Å²	25	59.6 Å²	59.6	15%	0.152	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-89.9	144	-176.4	-171.8	0	0	0	0	108.7	V48 L252	V45-V48 HydrophobicContact CG1-CG2 4.37Å; V45-L252 HydrophobicContact CG1-CD1 4.09Å; V45-L252 HydrophobicContact CG1-CD2 3.71Å; V45-L252 HydrophobicContact CG1-CG 3.98Å; V45-L252 HydrophobicContact CG2-CG 4.5Å
46	R	84.4	Confident	78.7	Confident	12 Å²	12	61.2 Å²	61.2	5%	0.045	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-54.1	152.8	174.7	-74.1	178.2	-82.9	-166.7	-12.9	111.4	R38 V48 T69 S152 G153 S154 D193 P194	R38-R46 VanDerWaalsContact CZ-CG 3.44Å; R46-V48 VanDerWaalsContact O-CG2 3.23Å; R46-V48 WeakPolarHBondContact O-CG2 3.4Å; R46-V48 PolarHBondContact O-N 3.45Å; R46-V48 VanDerWaalsContact O-N 3.11Å; R46-T69 PolarHBondContact NH1-OG1 3.31Å; R46-S152 PolarHBondContact NH1-O 3.49Å; R46-G153 PolarHBondContact NH2-O 3.13Å; R46-S154 PolarHBondContact NH2-OG 3.39Å; R46-D193 VanDerWaalsContact CB-OD2 3.3Å; R46-D193 WeakPolarHBondContact CB-OD2 3.39Å; R46-D193 WeakPolarHBondContact CD-OD2 3.31Å; R46-D193 WeakPolarHBondContact CG-OD2 3.4Å; R46-D193 IonicContact CZ-OD1 3.34Å; R46-D193 IonicContact CZ-OD2 2.75Å; R46-D193 PolarHBondContact N-OD2 3.35Å; R46-D193 VanDerWaalsContact N-OD2 3.07Å; R46-D193 IonicContact NE-OD1 3.61Å; R46-D193 PolarHBondContact NE-OD1 3.17Å; R46-D193 IonicContact NE-OD2 3.63Å; R46-D193 PolarHBondContact NE-OD2 3.23Å; R46-D193 IonicContact NH2-OD1 3.33Å; R46-D193 PolarHBondContact NH2-OD1 2.91Å; R46-D193 IonicContact NH2-OD2 3.74Å; R46-P194 PolarHBondContact NH2-O 3.22Å
47	P	86.5	Confident	80.2	Confident	106 Å²	106	64.2 Å²	64.2	69%	0.688	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-58.4	121.6	168.1	25.9	-33.2	0	0	0	108.9	G67	P47-G67 PolarHBondContact O-N 2.97Å
48	V	90.9	Very high	81.8	Confident	30 Å²	30	62.3 Å²	62.3	18%	0.182	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.8	-178.6	-171.5	0	0	0	0	109.7	V45 R46 V50 I64 E65 A66 L252	V45-V48 HydrophobicContact CG1-CG2 4.37Å; R46-V48 VanDerWaalsContact O-CG2 3.23Å; R46-V48 WeakPolarHBondContact O-CG2 3.4Å; R46-V48 PolarHBondContact O-N 3.45Å; R46-V48 VanDerWaalsContact O-N 3.11Å; V48-V50 HydrophobicContact CG1-CG2 3.51Å; V48-I64 HydrophobicContact CG1-CD1 3.77Å; V48-I64 HydrophobicContact CG1-CG1 3.69Å; V48-E65 CarbonylContact C-O 3.59Å; V48-E65 VanDerWaalsContact CA-O 3.32Å; V48-E65 WeakPolarHBondContact CA-O 3.38Å; V48-A66 HydrophobicContact CG2-CB 4.16Å; V48-L252 HydrophobicContact CB-CD2 4.37Å; V48-L252 HydrophobicContact CG2-CD2 3.61Å
49	F	93.9	Very high	83	Confident	111 Å²	111	67 Å²	67	49%	0.487	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131	165.6	175.4	-98.2	0	0	0	109.1	R51 Y63 I64 E65	F49-R51 HydrophobicContact CE1-CB 4.15Å; F49-R51 HydrophobicContact CZ-CB 4.31Å; F49-Y63 HydrophobicContact CD1-CD1 4.33Å; F49-Y63 HydrophobicContact CD1-CE1 4.23Å; F49-Y63 HydrophobicContact CE1-CD1 4.25Å; F49-Y63 HydrophobicContact CE1-CE1 4.36Å; F49-I64 WeakPolarHBondContact O-CA 3.28Å; F49-E65 HydrophobicContact CB-CB 4.27Å; F49-E65 PolarHBondContact N-O 2.69Å; F49-E65 PolarHBondContact O-N 3.28Å
50	V	94	Very high	84.4	Confident	17 Å²	17	61.4 Å²	61.4	10%	0.103	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.6	179.1	-157.1	0	0	0	0	111.8	V48 Y63 I64 M165 A259	V48-V50 HydrophobicContact CG1-CG2 3.51Å; V50-Y63 WeakPolarHBondContact CA-O 3.46Å; V50-Y63 WeakPolarHBondContact CG1-O 3.46Å; V50-I64 HydrophobicContact CG1-CB 4.39Å; V50-I64 HydrophobicContact CG2-CD1 4.19Å; V50-I64 HydrophobicContact CG2-CG1 4.11Å; V50-M165 HydrophobicContact CB-CE 4.04Å; V50-M165 HydrophobicContact CB-SD 4.39Å; V50-M165 HydrophobicContact CG1-CE 3.24Å; V50-M165 HydrophobicContact CG1-SD 3.4Å; V50-M165 WeakPolarHBondContact CG1-SD 3.41Å; V50-A259 HydrophobicContact CB-CB 4.12Å
51	R	93.4	Very high	86.1	Confident	110 Å²	110	59.6 Å²	59.6	42%	0.415	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	121.8	177.6	-177.6	175	177.8	172.8	-1.8	111	F49 A62 Y63	F49-R51 HydrophobicContact CE1-CB 4.15Å; F49-R51 HydrophobicContact CZ-CB 4.31Å; R51-A62 CarbonylContact O-C 3.5Å; R51-A62 WeakPolarHBondContact O-CA 3.48Å; R51-Y63 PolarHBondContact N-O 3.35Å; R51-Y63 PolarHBondContact O-N 3.2Å
52	C	94.1	Very high	87.8	Confident	7 Å²	7	55.4 Å²	55.4	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	162	168.3	-48.7	0	0	0	0	111.6	S61 M165 D169 A263	C52-S61 CarbonylContact C-O 3.52Å; C52-S61 VanDerWaalsContact CA-O 3.31Å; C52-S61 WeakPolarHBondContact CA-O 3.48Å; C52-M165 WeakPolarHBondContact SG-CE 3.21Å; C52-D169 HydrophobicContact CB-CB 4.11Å; C52-A263 HydrophobicContact CB-CB 3.74Å
53	G	90.1	Very high	89.3	Confident	45 Å²	45	52.1 Å²	52.1	46%	0.464	28%	0.282	S	S	.	.			trans	66.4	41.2	175.6	0	0	0	0	0	113.7	S61 D169	G53-S61 WeakPolarHBondContact CA-OG 3.35Å; G53-S61 PolarHBondContact N-O 2.98Å; G53-D169 WeakPolarHBondContact CA-OD2 3.4Å; G53-D169 PolarHBondContact N-OD2 2.76Å
54	L	90.1	Very high	90.7	Very high	76 Å²	76	51.8 Å²	51.8	40%	0.398	28%	0.28	S	S	.	.			trans	-81.8	-40.9	178.2	-171.8	69.3	0	0	0	112.5	S61 Y63 L72	L54-S61 PolarHBondContact N-OG 3.49Å; L54-Y63 HydrophobicContact CD2-CD2 4.48Å; L54-Y63 HydrophobicContact CD2-CG 4.18Å; L54-L72 HydrophobicContact CD2-CD1 3.81Å
55	V	92	Very high	91.8	Very high	40 Å²	40	51.9 Å²	51.9	24%	0.242	28%	0.279	C	S	.	.			trans	-100.9	116.4	-175.1	-178.2	0	0	0	0	109.3	Q57 A58 S61 L72	V55-Q57 HydrophobicContact CG1-CB 4.45Å; V55-A58 HydrophobicContact CB-CB 4.34Å; V55-A58 HydrophobicContact CG1-CB 4.1Å; V55-S61 PolarHBondContact N-OG 3.06Å; V55-S61 PolarHBondContact O-OG 3.42Å; V55-L72 HydrophobicContact CG2-CD1 4.23Å; V55-L72 HydrophobicContact CG2-CD2 4.43Å
56	S	88.2	Confident	92.4	Very high	114 Å²	114	50.7 Å²	50.7	80%	0.797	27%	0.272	S	S	*	.	S	Bend	trans	-74.6	-23.9	-177.4	57	0	0	0	0	114.6
57	Q	91.5	Very high	92.6	Very high	162 Å²	162	51.4 Å²	51.4	76%	0.757	28%	0.282	S	S	*	.	S	Bend	trans	-81.8	-21.9	-178.4	-62.2	-62.8	-28.8	0	0	113	V55	V55-Q57 HydrophobicContact CG1-CB 4.45Å
58	A	93.3	Very high	92.8	Very high	11 Å²	11	50.9 Å²	50.9	9%	0.091	27%	0.274	C	S	.	.	S	Bend	trans	-86.8	150.3	174.8	0	0	0	0	0	109.2	V55 G60 C74 Y76	V55-A58 HydrophobicContact CB-CB 4.34Å; V55-A58 HydrophobicContact CG1-CB 4.1Å; A58-G60 VanDerWaalsContact C-N 3.32Å; A58-G60 WeakPolarHBondContact CB-O 3.44Å; A58-C74 HydrophobicContact CB-CB 3.99Å; A58-Y76 HydrophobicContact CB-CE1 4.03Å
59	K	93.2	Very high	92.9	Very high	122 Å²	122	49.5 Å²	49.5	53%	0.53	27%	0.266	S	S	.	.	S	Bend	trans	-70	-36.3	178.6	-169.7	-179.4	-177.6	177	0	111.4	V75 G77 A170	K59-V75 PolarHBondContact N-O 3.4Å; K59-G77 WeakPolarHBondContact CD-O 3.49Å; K59-G77 PolarHBondContact NZ-O 3.33Å; K59-A170 HydrophobicContact CG-CB 4.41Å
60	G	94.8	Very high	93	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	147.4	168.2	0	0	0	0	0	109.9	A58 V75 D169	A58-G60 VanDerWaalsContact C-N 3.32Å; A58-G60 WeakPolarHBondContact CB-O 3.44Å; G60-V75 PolarHBondContact N-O 3.16Å; G60-V75 PolarHBondContact O-N 2.96Å; G60-D169 WeakPolarHBondContact CA-OD2 3.28Å
61	S	96.1	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.1	176.7	58.8	0	0	0	0	111.1	C52 G53 L54 V55 C73 D169	C52-S61 CarbonylContact C-O 3.52Å; C52-S61 VanDerWaalsContact CA-O 3.31Å; C52-S61 WeakPolarHBondContact CA-O 3.48Å; G53-S61 WeakPolarHBondContact CA-OG 3.35Å; G53-S61 PolarHBondContact N-O 2.98Å; L54-S61 PolarHBondContact N-OG 3.49Å; V55-S61 PolarHBondContact N-OG 3.06Å; V55-S61 PolarHBondContact O-OG 3.42Å; S61-C73 CarbonylContact C-O 3.48Å; S61-C73 VanDerWaalsContact CA-O 3.24Å; S61-C73 WeakPolarHBondContact CA-O 3.36Å; S61-D169 PolarHBondContact N-OD2 3.12Å
62	A	96.6	Very high	93.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	149.6	173.9	0	0	0	0	0	110.1	R51 C73 C162 M165 A166	R51-A62 CarbonylContact O-C 3.5Å; R51-A62 WeakPolarHBondContact O-CA 3.48Å; A62-C73 PolarHBondContact N-O 2.83Å; A62-C73 PolarHBondContact O-N 3.15Å; A62-C162 VanDerWaalsContact C-SG 3.56Å; A62-C162 WeakPolarHBondContact CB-O 3.41Å; A62-C162 PolarHBondContact O-SG 3.29Å; A62-M165 HydrophobicContact CB-CB 3.87Å; A62-A166 HydrophobicContact CB-CB 3.9Å
63	Y	96.5	Very high	93.4	Very high	37 Å²	37	42.1 Å²	42.1	15%	0.145	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.2	174.1	175.1	-104.1	0	0	0	108.5	F49 V50 R51 L54 E65 K70 V71 L72 L149	F49-Y63 HydrophobicContact CD1-CD1 4.33Å; F49-Y63 HydrophobicContact CD1-CE1 4.23Å; F49-Y63 HydrophobicContact CE1-CD1 4.25Å; F49-Y63 HydrophobicContact CE1-CE1 4.36Å; V50-Y63 WeakPolarHBondContact CA-O 3.46Å; V50-Y63 WeakPolarHBondContact CG1-O 3.46Å; R51-Y63 PolarHBondContact N-O 3.35Å; R51-Y63 PolarHBondContact O-N 3.2Å; L54-Y63 HydrophobicContact CD2-CD2 4.48Å; L54-Y63 HydrophobicContact CD2-CG 4.18Å; Y63-E65 HydrophobicContact CE1-CB 4.03Å; Y63-K70 HydrophobicContact CE2-CB 4.27Å; Y63-K70 WeakPolarHBondContact OH-CD 3.37Å; Y63-K70 WeakPolarHBondContact OH-CG 3.39Å; Y63-V71 WeakPolarHBondContact CA-O 2.93Å; Y63-V71 WeakPolarHBondContact CD2-O 3.47Å; Y63-L72 HydrophobicContact CD2-CD1 4.31Å; Y63-L149 HydrophobicContact CE2-CD1 4.17Å
64	I	95.8	Very high	93.8	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.3	176.3	-171.4	160.7	0	0	0	109.6	V48 F49 V50 V71 H158 T161 C162	V48-I64 HydrophobicContact CG1-CD1 3.77Å; V48-I64 HydrophobicContact CG1-CG1 3.69Å; F49-I64 WeakPolarHBondContact O-CA 3.28Å; V50-I64 HydrophobicContact CG1-CB 4.39Å; V50-I64 HydrophobicContact CG2-CD1 4.19Å; V50-I64 HydrophobicContact CG2-CG1 4.11Å; I64-V71 HydrophobicContact CG2-CB 3.72Å; I64-V71 HydrophobicContact CG2-CG2 4.43Å; I64-V71 PolarHBondContact N-O 3.31Å; I64-V71 PolarHBondContact O-N 2.99Å; I64-H158 HydrophobicContact CG2-CB 4.35Å; I64-T161 HydrophobicContact CD1-CG2 4.14Å; I64-C162 HydrophobicContact CB-CB 4.37Å; I64-C162 HydrophobicContact CG2-CB 3.66Å
65	E	94.8	Very high	94.1	Very high	60 Å²	60	37 Å²	37	28%	0.28	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	117.4	173	177.3	171.6	-154.1	0	0	107.9	V48 F49 Y63 G67 T69 K70	V48-E65 CarbonylContact C-O 3.59Å; V48-E65 VanDerWaalsContact CA-O 3.32Å; V48-E65 WeakPolarHBondContact CA-O 3.38Å; F49-E65 HydrophobicContact CB-CB 4.27Å; F49-E65 PolarHBondContact N-O 2.69Å; F49-E65 PolarHBondContact O-N 3.28Å; Y63-E65 HydrophobicContact CE1-CB 4.03Å; E65-G67 WeakPolarHBondContact CG-O 3.22Å; E65-T69 CarbonylContact C-O 3.53Å; E65-T69 VanDerWaalsContact CA-O 3.31Å; E65-T69 WeakPolarHBondContact CA-O 3.49Å; E65-K70 HydrophobicContact CB-CG 4.38Å; E65-K70 HydrophobicContact CG-CG 4.03Å; E65-K70 WeakPolarHBondContact OE1-CE 3.43Å; E65-K70 IonicContact OE1-NZ 2.55Å
66	A	91.2	Very high	94.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	99.7	178.7	0	0	0	0	0	109.4	V48 N68 T69 H158	V48-A66 HydrophobicContact CG2-CB 4.16Å; A66-N68 PolarHBondContact O-N 2.55Å; A66-N68 VanDerWaalsContact O-N 3.14Å; A66-T69 PolarHBondContact N-O 3.11Å; A66-T69 PolarHBondContact O-N 3.33Å; A66-H158 WeakPolarHBondContact CB-CD2 2.86Å; A66-H158 WeakPolarHBondContact CB-NE2 3.25Å
67	G	88.6	Confident	94	Very high	26 Å²	26	32.9 Å²	32.9	27%	0.268	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-116	-161.8	0	0	0	0	0	110.1	P47 E65	P47-G67 PolarHBondContact O-N 2.97Å; E65-G67 WeakPolarHBondContact CG-O 3.22Å
68	N	90	Very high	93.9	Very high	96 Å²	96	27.4 Å²	27.4	51%	0.513	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-8.6	177.9	-60.4	-18.2	0	0	0	113.4	A66 K70 E150	A66-N68 PolarHBondContact O-N 2.55Å; A66-N68 VanDerWaalsContact O-N 3.14Å; N68-K70 PolarHBondContact O-N 3.05Å; N68-E150 WeakPolarHBondContact O-CB 3.32Å; N68-E150 WeakPolarHBondContact O-CG 3.4Å
69	T	93.4	Very high	93.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	118.8	178.6	-62.4	0	0	0	0	109	R46 E65 A66 V71 E150 S152 G153 V155	R46-T69 PolarHBondContact NH1-OG1 3.31Å; E65-T69 CarbonylContact C-O 3.53Å; E65-T69 VanDerWaalsContact CA-O 3.31Å; E65-T69 WeakPolarHBondContact CA-O 3.49Å; A66-T69 PolarHBondContact N-O 3.11Å; A66-T69 PolarHBondContact O-N 3.33Å; T69-V71 HydrophobicContact CG2-CG2 4.11Å; T69-E150 WeakPolarHBondContact CA-O 3.2Å; T69-S152 WeakPolarHBondContact OG1-CA 3.3Å; T69-S152 WeakPolarHBondContact OG1-CB 3.48Å; T69-S152 PolarHBondContact OG1-N 2.99Å; T69-S152 VanDerWaalsContact OG1-N 3.13Å; T69-G153 PolarHBondContact OG1-N 3.38Å; T69-G153 PolarHBondContact OG1-O 3.43Å; T69-V155 HydrophobicContact CG2-CG2 4.37Å
70	K	95.8	Very high	93.4	Very high	54 Å²	54	34.3 Å²	34.3	24%	0.235	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.3	-177.6	-66.5	171.5	-174.2	138.6	0	110.2	Y63 E65 N68 L149 E150	Y63-K70 HydrophobicContact CE2-CB 4.27Å; Y63-K70 WeakPolarHBondContact OH-CD 3.37Å; Y63-K70 WeakPolarHBondContact OH-CG 3.39Å; E65-K70 HydrophobicContact CB-CG 4.38Å; E65-K70 HydrophobicContact CG-CG 4.03Å; E65-K70 WeakPolarHBondContact OE1-CE 3.43Å; E65-K70 IonicContact OE1-NZ 2.55Å; N68-K70 PolarHBondContact O-N 3.05Å; K70-L149 HydrophobicContact CB-CB 4.06Å; K70-L149 PolarHBondContact O-N 2.78Å; K70-E150 HydrophobicContact CB-CB 4.12Å; K70-E150 HydrophobicContact CD-CB 4.37Å; K70-E150 HydrophobicContact CG-CB 4.41Å; K70-E150 PolarHBondContact N-O 3.18Å; K70-E150 IonicContact NZ-OE2 3.92Å; K70-E150 PolarHBondContact NZ-OE2 2.88Å; K70-E150 PolarHBondContact O-N 2.85Å
71	V	96.7	Very high	92.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.6	-178.1	-175.1	0	0	0	0	109.9	Y63 I64 T69 V146 V148 V155 H158 A159 C162	Y63-V71 WeakPolarHBondContact CA-O 2.93Å; Y63-V71 WeakPolarHBondContact CD2-O 3.47Å; I64-V71 HydrophobicContact CG2-CB 3.72Å; I64-V71 HydrophobicContact CG2-CG2 4.43Å; I64-V71 PolarHBondContact N-O 3.31Å; I64-V71 PolarHBondContact O-N 2.99Å; T69-V71 HydrophobicContact CG2-CG2 4.11Å; V71-V146 HydrophobicContact CG1-CG1 3.35Å; V71-V148 HydrophobicContact CG2-CG1 4.47Å; V71-V155 HydrophobicContact CG2-CG1 4.39Å; V71-H158 HydrophobicContact CG2-CB 4.43Å; V71-A159 HydrophobicContact CG1-CB 4.47Å; V71-C162 HydrophobicContact CG1-CB 4.48Å
72	L	96.8	Very high	91.4	Very high	36 Å²	36	44 Å²	44	19%	0.188	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.9	175.2	-177.9	71.7	0	0	0	108.8	L54 V55 Y63 V146 M147	L54-L72 HydrophobicContact CD2-CD1 3.81Å; V55-L72 HydrophobicContact CG2-CD1 4.23Å; V55-L72 HydrophobicContact CG2-CD2 4.43Å; Y63-L72 HydrophobicContact CD2-CD1 4.31Å; L72-V146 CarbonylContact O-C 3.58Å; L72-V146 WeakPolarHBondContact O-CA 3.31Å; L72-M147 PolarHBondContact N-O 2.85Å; L72-M147 PolarHBondContact O-N 3.28Å
73	C	97.1	Very high	90	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.6	173.3	-173.6	0	0	0	0	110.8	S61 A62 V144 N145 V146 C162 A163 A166	S61-C73 CarbonylContact C-O 3.48Å; S61-C73 VanDerWaalsContact CA-O 3.24Å; S61-C73 WeakPolarHBondContact CA-O 3.36Å; A62-C73 PolarHBondContact N-O 2.83Å; A62-C73 PolarHBondContact O-N 3.15Å; C73-V144 VanDerWaalsContact SG-CG1 3.57Å; C73-N145 WeakPolarHBondContact CA-O 3.44Å; C73-V146 HydrophobicContact CB-CG2 4.27Å; C73-C162 HydrophobicContact CB-CB 4.2Å; C73-C162 WeakPolarHBondContact CB-SG 3.19Å; C73-A163 VanDerWaalsContact SG-CA 3.58Å; C73-A166 HydrophobicContact CB-CB 4Å
74	C	97	Very high	88.6	Confident	14 Å²	14	57.4 Å²	57.4	10%	0.095	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.2	174.1	-63.4	0	0	0	0	109.2	A58 Y76 N145	A58-C74 HydrophobicContact CB-CB 3.99Å; C74-Y76 HydrophobicContact CB-CE2 3.81Å; C74-N145 PolarHBondContact N-O 2.92Å; C74-N145 PolarHBondContact O-N 2.8Å
75	V	96.9	Very high	87.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.5	176.5	175.8	0	0	0	0	109.5	K59 G60 I142 E143 V144 A166 L167 A170 I172	K59-V75 PolarHBondContact N-O 3.4Å; G60-V75 PolarHBondContact N-O 3.16Å; G60-V75 PolarHBondContact O-N 2.96Å; V75-I142 HydrophobicContact CG1-CG2 4.16Å; V75-E143 WeakPolarHBondContact CA-O 3.41Å; V75-V144 HydrophobicContact CG2-CG1 4.27Å; V75-V144 HydrophobicContact CG2-CG2 4.16Å; V75-A166 HydrophobicContact CG2-CB 3.58Å; V75-L167 HydrophobicContact CG1-CD2 3.96Å; V75-L167 HydrophobicContact CG2-CD2 4.06Å; V75-L167 HydrophobicContact CG2-CG 4.2Å; V75-A170 HydrophobicContact CB-CB 4.27Å; V75-A170 HydrophobicContact CG1-CB 3.98Å; V75-I172 HydrophobicContact CG1-CD1 3.61Å
76	Y	94.4	Very high	85.6	Confident	57 Å²	57	67 Å²	67	22%	0.224	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113.4	174.6	-56.7	-81.8	0	0	0	108.6	A58 C74 E143 N145	A58-Y76 HydrophobicContact CB-CE1 4.03Å; C74-Y76 HydrophobicContact CB-CE2 3.81Å; Y76-E143 PolarHBondContact N-O 2.94Å; Y76-E143 PolarHBondContact O-N 2.83Å; Y76-N145 HydrophobicContact CE2-CB 4.45Å; Y76-N145 WeakPolarHBondContact CE2-ND2 3.39Å
77	G	84.3	Confident	84.3	Confident	9 Å²	9	68.1 Å²	68.1	9%	0.093	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.7	176.1	178.1	0	0	0	0	0	113.3	K59	K59-G77 WeakPolarHBondContact CD-O 3.49Å; K59-G77 PolarHBondContact NZ-O 3.33Å
78	P	88.6	Confident	83.2	Confident	47 Å²	47	72.2 Å²	72.2	31%	0.305	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-72.3	130.8	-12.8	26.1	-27.7	0	0	0	110.9	Y137 I142	P78-Y137 HydrophobicContact CB-CD1 4.15Å; P78-Y137 HydrophobicContact CG-CD1 3.99Å; P78-Y137 HydrophobicContact CG-CE1 4.14Å; P78-I142 HydrophobicContact CB-CG1 4.42Å
79	R	89.8	Confident	82.3	Confident	133 Å²	133	74.9 Å²	74.9	50%	0.502	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	150.4	174.8	-69.2	179.3	177.7	171.5	-1.3	109.6	S140 Q141	R79-S140 CarbonylContact O-C 3.55Å; R79-S140 WeakPolarHBondContact O-CA 3.5Å; R79-Q141 PolarHBondContact N-O 3.37Å; R79-Q141 PolarHBondContact O-N 2.84Å
80	E	86.3	Confident	81.6	Confident	145 Å²	145	83.7 Å²	83.7	68%	0.678	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	132.4	172.9	-169.8	174.8	179.8	0	0	109.8
81	T	78.3	Confident	81	Confident	10 Å²	10	83.1 Å²	83.1	6%	0.061	40%	0.395	C	S	.	.			trans	-71.3	128.2	179.4	-49.2	0	0	0	0	110.3	R83 T87 Q141	T81-R83 VanDerWaalsContact C-N 3.26Å; T81-R83 HydrophobicContact CG2-CB 4.3Å; T81-R83 PolarHBondContact O-N 3.38Å; T81-T87 WeakPolarHBondContact CB-OG1 3.32Å; T81-T87 WeakPolarHBondContact CG2-OG1 3.46Å; T81-Q141 WeakPolarHBondContact OG1-CB 3.33Å
82	E	69.8	Low	80.5	Confident	194 Å²	194	83.4 Å²	83.4	91%	0.907	40%	0.398	S	S	*	.	S	Bend	trans	-66.3	-30.2	176.9	-64.3	-169.2	151.6	0	0	112.5	K84	E82-K84 PolarHBondContact O-N 3.14Å
83	R	68.4	Low	80.1	Confident	162 Å²	162	86.3 Å²	86.3	61%	0.611	41%	0.407	S	S	*	.			trans	-89.8	86.5	177.9	-65.8	-171.9	-178.4	-176.3	2.6	111.6	T81 D85 E86 T87	T81-R83 VanDerWaalsContact C-N 3.26Å; T81-R83 HydrophobicContact CG2-CB 4.3Å; T81-R83 PolarHBondContact O-N 3.38Å; R83-D85 PolarHBondContact O-N 2.96Å; R83-E86 IonicContact NH1-OE1 3.39Å; R83-E86 PolarHBondContact NH1-OE1 3.42Å; R83-E86 PolarHBondContact O-N 3.47Å; R83-T87 PolarHBondContact O-OG1 3.35Å
84	K	66.9	Low	79.9	Confident	157 Å²	157	86.5 Å²	86.5	68%	0.683	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-58.8	-27.8	177.5	-67.1	-178.8	178.2	178.4	0	113.4	E82	E82-K84 PolarHBondContact O-N 3.14Å
85	D	64.6	Low	79.7	Confident	171 Å²	171	87.2 Å²	87.2	91%	0.914	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-77.5	-26.5	-175.4	-56.6	-34.9	0	0	0	113.9	R83	R83-D85 PolarHBondContact O-N 2.96Å
86	E	63.4	Low	79.7	Confident	95 Å²	95	87.9 Å²	87.9	44%	0.444	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-95.5	5.5	177.7	-72.4	-179.4	-151.9	0	0	112.7	R83 R93	R83-E86 IonicContact NH1-OE1 3.39Å; R83-E86 PolarHBondContact NH1-OE1 3.42Å; R83-E86 PolarHBondContact O-N 3.47Å; E86-R93 IonicContact OE2-CZ 2.87Å; E86-R93 IonicContact OE2-NH1 3.71Å; E86-R93 PolarHBondContact OE2-NH1 2.83Å; E86-R93 IonicContact OE2-NH2 2.99Å
87	T	62.5	Low	79.7	Confident	24 Å²	24	86.6 Å²	86.6	15%	0.147	41%	0.413	C	S	.	.			trans	-97.6	115.5	-170.7	-57.7	0	0	0	0	110.8	T81 R83 M89 R139	T81-T87 WeakPolarHBondContact CB-OG1 3.32Å; T81-T87 WeakPolarHBondContact CG2-OG1 3.46Å; R83-T87 PolarHBondContact O-OG1 3.35Å; T87-M89 PolarHBondContact O-N 2.9Å; T87-R139 HydrophobicContact CG2-CB 4.32Å
88	D	66.8	Low	80.1	Confident	112 Å²	112	86.2 Å²	86.2	60%	0.599	41%	0.408	S	S	*	.			trans	-59.9	124.4	170.2	-79.4	-43.3	0	0	0	110.2	K90 S91	D88-K90 PolarHBondContact O-N 3.2Å; D88-S91 WeakPolarHBondContact CB-OG 3.47Å; D88-S91 VanDerWaalsContact O-O 3.1Å
89	M	71.3	Confident	80.4	Confident	151 Å²	151	88.6 Å²	88.6	74%	0.744	41%	0.412	S	S	*	.	S	Bend	trans	-68.1	-17.5	-178.3	-65.6	-166.5	179.9	0	0	113.1	T87	T87-M89 PolarHBondContact O-N 2.9Å
90	K	77.7	Confident	80.6	Confident	186 Å²	186	84 Å²	84	81%	0.809	40%	0.395	S	S	*	.	S	Bend	trans	-107.3	-18.7	-171.6	-63	-176.5	-178.6	178.8	0	114.2	D88	D88-K90 PolarHBondContact O-N 3.2Å
91	S	83.1	Confident	80.9	Confident	43 Å²	43	77.3 Å²	77.3	30%	0.301	37%	0.365	S	S	.	.	S	Bend	trans	-138.9	143.8	-175.9	45.3	0	0	0	0	111	D88	D88-S91 WeakPolarHBondContact CB-OG 3.47Å; D88-S91 VanDerWaalsContact O-O 3.1Å
92	G	85.8	Confident	81.5	Confident	6 Å²	6	78.3 Å²	78.3	6%	0.062	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-67.4	158.3	168.6	0	0	0	0	0	111.9	L134 Y137 S140	G92-L134 PolarHBondContact N-O 3.15Å; G92-Y137 WeakPolarHBondContact CA-O 3.24Å; G92-Y137 PolarHBondContact N-O 2.82Å; G92-Y137 VanDerWaalsContact N-O 3.14Å; G92-S140 CarbonylContact C-O 3.59Å; G92-S140 VanDerWaalsContact CA-O 3.24Å; G92-S140 WeakPolarHBondContact CA-O 3.3Å
93	R	89.4	Confident	82.5	Confident	97 Å²	97	76.3 Å²	76.3	37%	0.366	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.7	176.6	-171.2	174.9	177.1	171.2	-3.7	109.8	E86 T95 S140 Q141 I142	E86-R93 IonicContact OE2-CZ 2.87Å; E86-R93 IonicContact OE2-NH1 3.71Å; E86-R93 PolarHBondContact OE2-NH1 2.83Å; E86-R93 IonicContact OE2-NH2 2.99Å; R93-T95 HydrophobicContact CG-CG2 4.12Å; R93-S140 PolarHBondContact N-O 3.32Å; R93-Q141 WeakPolarHBondContact O-CA 3.05Å; R93-I142 PolarHBondContact O-N 3.26Å
94	L	92.7	Very high	83.6	Confident	4 Å²	4	69 Å²	69	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.7	167.9	-177.9	65.2	0	0	0	108.3	T96 Q125 L128 L134 I142 V144	L94-T96 HydrophobicContact CD1-CG2 4.47Å; L94-T96 HydrophobicContact CD2-CG2 4.43Å; L94-T96 HydrophobicContact CG-CG2 4.16Å; L94-Q125 PolarHBondContact O-NE2 3.41Å; L94-L128 HydrophobicContact CD2-CB 3.69Å; L94-L134 HydrophobicContact CB-CD1 4.49Å; L94-L134 HydrophobicContact CB-CD2 4.19Å; L94-I142 HydrophobicContact CD1-CB 4.17Å; L94-I142 HydrophobicContact CD1-CG2 3.95Å; L94-V144 HydrophobicContact CD1-CG2 3.71Å
95	T	93.3	Very high	84.5	Confident	28 Å²	28	63.3 Å²	63.3	17%	0.172	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.3	170.9	51.9	0	0	0	0	109	R93 Q141 I142 E143 V144	R93-T95 HydrophobicContact CG-CG2 4.12Å; T95-Q141 HydrophobicContact CG2-CG 4.32Å; T95-Q141 PolarHBondContact OG1-NE2 2.85Å; T95-I142 PolarHBondContact N-O 3.35Å; T95-I142 PolarHBondContact OG1-O 2.83Å; T95-E143 CarbonylContact O-C 3.43Å; T95-E143 WeakPolarHBondContact O-CA 3.47Å; T95-V144 PolarHBondContact O-N 2.96Å
96	T	95.3	Very high	85.5	Confident	15 Å²	15	58.6 Å²	58.6	9%	0.092	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.1	-176.4	46.8	0	0	0	0	108.5	L94 S121 L124 Q125 L128 V144	L94-T96 HydrophobicContact CD1-CG2 4.47Å; L94-T96 HydrophobicContact CD2-CG2 4.43Å; L94-T96 HydrophobicContact CG-CG2 4.16Å; T96-S121 WeakPolarHBondContact O-CB 3.49Å; T96-S121 PolarHBondContact OG1-O 2.93Å; T96-L124 HydrophobicContact CG2-CD2 3.37Å; T96-Q125 HydrophobicContact CG2-CB 4.37Å; T96-Q125 HydrophobicContact CG2-CG 4.41Å; T96-Q125 WeakPolarHBondContact OG1-CA 3.18Å; T96-Q125 WeakPolarHBondContact OG1-CB 3.37Å; T96-Q125 PolarHBondContact OG1-N 2.87Å; T96-L128 HydrophobicContact CG2-CD1 4.22Å; T96-V144 CarbonylContact C-O 3.55Å; T96-V144 VanDerWaalsContact CA-O 3.3Å; T96-V144 WeakPolarHBondContact CA-O 3.44Å; T96-V144 HydrophobicContact CG2-CB 3.87Å; T96-V144 HydrophobicContact CG2-CG1 4.49Å; T96-V144 HydrophobicContact CG2-CG2 4.32Å
97	D	94.9	Very high	86.5	Confident	30 Å²	30	59.7 Å²	59.7	16%	0.16	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	114.5	176.3	-174.4	-9.4	0	0	0	108.2	R99 Q113 V144 N145 V146	D97-R99 VanDerWaalsContact OD1-CG 3.24Å; D97-R99 WeakPolarHBondContact OD1-CG 3.38Å; D97-R99 IonicContact OD1-NE 3.21Å; D97-R99 PolarHBondContact OD1-NE 3.22Å; D97-R99 IonicContact OD2-CZ 2.68Å; D97-R99 IonicContact OD2-NE 2.73Å; D97-R99 PolarHBondContact OD2-NE 3.3Å; D97-R99 IonicContact OD2-NH2 3.84Å; D97-R99 PolarHBondContact OD2-NH2 3.46Å; D97-Q113 PolarHBondContact OD1-NE2 3.25Å; D97-Q113 PolarHBondContact OD2-NE2 2.72Å; D97-V144 PolarHBondContact N-O 2.83Å; D97-N145 WeakPolarHBondContact CB-OD1 3.22Å; D97-N145 CarbonylContact O-C 3.57Å; D97-N145 WeakPolarHBondContact O-CA 3.43Å; D97-V146 PolarHBondContact O-N 2.94Å
98	M	94.3	Very high	87.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.9	174.3	-174.6	164.3	172	0	0	109.4	F100 F120 S121 L124 V146 V148 V155 A159	M98-F100 HydrophobicContact CE-CE2 3.98Å; M98-F100 HydrophobicContact CE-CZ 3.73Å; M98-F120 HydrophobicContact CB-CB 4.4Å; M98-F120 HydrophobicContact CE-CB 4.4Å; M98-F120 HydrophobicContact CG-CB 4.3Å; M98-F120 HydrophobicContact SD-CB 3.57Å; M98-F120 VanDerWaalsContact SD-CB 3.57Å; M98-F120 HydrophobicContact SD-CG 4.28Å; M98-S121 PolarHBondContact N-OG 3.19Å; M98-L124 HydrophobicContact SD-CD1 4.44Å; M98-V146 HydrophobicContact CG-CB 4.38Å; M98-V146 HydrophobicContact CG-CG1 4.48Å; M98-V148 HydrophobicContact CE-CG2 3.65Å; M98-V155 HydrophobicContact CE-CB 4.35Å; M98-V155 HydrophobicContact CE-CG1 3.47Å; M98-V155 VanDerWaalsContact CE-CG1 3.47Å; M98-A159 HydrophobicContact CE-CB 3.97Å; M98-A159 HydrophobicContact SD-CB 3.99Å
99	R	93.4	Very high	88.4	Confident	98 Å²	98	63.8 Å²	63.8	37%	0.37	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.6	178.7	-60.5	-169	-173	-178.5	1	111.1	D97 Q113 V146 M147 V148	D97-R99 VanDerWaalsContact OD1-CG 3.24Å; D97-R99 WeakPolarHBondContact OD1-CG 3.38Å; D97-R99 IonicContact OD1-NE 3.21Å; D97-R99 PolarHBondContact OD1-NE 3.22Å; D97-R99 IonicContact OD2-CZ 2.68Å; D97-R99 IonicContact OD2-NE 2.73Å; D97-R99 PolarHBondContact OD2-NE 3.3Å; D97-R99 IonicContact OD2-NH2 3.84Å; D97-R99 PolarHBondContact OD2-NH2 3.46Å; R99-Q113 HydrophobicContact CG-CG 4.31Å; R99-V146 PolarHBondContact N-O 2.79Å; R99-M147 HydrophobicContact CB-CE 4.09Å; R99-M147 HydrophobicContact CB-SD 4.11Å; R99-M147 WeakPolarHBondContact O-CA 3.45Å; R99-V148 PolarHBondContact O-N 2.89Å
100	F	93.6	Very high	89	Confident	35 Å²	35	60.5 Å²	60.5	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.7	168.9	-69.9	-98.9	0	0	0	109.2	M98 D117 F120 V148 V155	M98-F100 HydrophobicContact CE-CE2 3.98Å; M98-F100 HydrophobicContact CE-CZ 3.73Å; F100-D117 WeakPolarHBondContact CD2-OD1 3.24Å; F100-F120 AromaticContact CE2-CD2 3.77Å; F100-F120 HydrophobicContact CE2-CD2 3.77Å; F100-F120 HydrophobicContact CE2-CE2 4.16Å; F100-F120 HydrophobicContact CZ-CD2 4.02Å; F100-F120 HydrophobicContact CZ-CE2 4.05Å; F100-V148 HydrophobicContact CD1-CB 3.8Å; F100-V148 HydrophobicContact CD1-CG1 3.9Å; F100-V148 HydrophobicContact CD1-CG2 4.03Å; F100-V148 HydrophobicContact CE1-CB 4.14Å; F100-V148 HydrophobicContact CE1-CG1 4.04Å; F100-V148 HydrophobicContact CE1-CG2 3.96Å; F100-V148 HydrophobicContact CG-CB 4.32Å; F100-V148 HydrophobicContact CG-CG2 4.43Å; F100-V148 HydrophobicContact CZ-CG2 4.3Å; F100-V155 HydrophobicContact CE1-CB 4.48Å; F100-V155 HydrophobicContact CE1-CG1 3.99Å; F100-V155 HydrophobicContact CE1-CG2 4.45Å; F100-V155 HydrophobicContact CZ-CG1 4.2Å
101	A	93	Very high	89.3	Confident	6 Å²	6	59.2 Å²	59.2	5%	0.05	29%	0.294	C	S	.	.			trans	-62.9	143	170.4	0	0	0	0	0	108.8	F103 S104 M147 V148	A101-F103 HydrophobicContact CB-CD1 4.24Å; A101-F103 HydrophobicContact CB-CD2 4.23Å; A101-F103 HydrophobicContact CB-CE1 3.88Å; A101-F103 HydrophobicContact CB-CE2 3.85Å; A101-F103 HydrophobicContact CB-CG 4.41Å; A101-F103 HydrophobicContact CB-CZ 3.67Å; A101-F103 PolarHBondContact O-N 3.1Å; A101-S104 VanDerWaalsContact O-CB 3.25Å; A101-S104 WeakPolarHBondContact O-CB 3.23Å; A101-S104 PolarHBondContact O-N 2.87Å; A101-S104 PolarHBondContact O-OG 3.17Å; A101-M147 HydrophobicContact CB-SD 4.24Å; A101-V148 VanDerWaalsContact CB-O 3.24Å; A101-V148 WeakPolarHBondContact CB-O 3.5Å; A101-V148 PolarHBondContact N-O 2.89Å
102	P	90.9	Very high	89.4	Confident	31 Å²	31	61.8 Å²	61.8	20%	0.201	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.8	-178.7	-28.5	35.5	0	0	0	114.5	R108 G109	P102-R108 HydrophobicContact CB-CG 4.45Å; P102-R108 WeakPolarHBondContact O-CA 3.37Å; P102-R108 WeakPolarHBondContact O-CG 3.32Å; P102-G109 PolarHBondContact O-N 2.99Å; P102-G109 VanDerWaalsContact O-N 3.14Å
103	F	91.8	Very high	89.3	Confident	151 Å²	151	64.2 Å²	64.2	66%	0.662	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	3	179	56.9	-102.7	0	0	0	113.9	A101 L149	A101-F103 HydrophobicContact CB-CD1 4.24Å; A101-F103 HydrophobicContact CB-CD2 4.23Å; A101-F103 HydrophobicContact CB-CE1 3.88Å; A101-F103 HydrophobicContact CB-CE2 3.85Å; A101-F103 HydrophobicContact CB-CG 4.41Å; A101-F103 HydrophobicContact CB-CZ 3.67Å; A101-F103 PolarHBondContact O-N 3.1Å; F103-L149 WeakPolarHBondContact CE2-O 3.34Å
104	S	90.4	Very high	89.1	Confident	8 Å²	8	61.2 Å²	61.2	6%	0.056	31%	0.313	C	S	.	.	S	Bend	trans	-73.8	-28.6	-173.2	61.4	0	0	0	0	114	A101 V148 L149 N151	A101-S104 VanDerWaalsContact O-CB 3.25Å; A101-S104 WeakPolarHBondContact O-CB 3.23Å; A101-S104 PolarHBondContact O-N 2.87Å; A101-S104 PolarHBondContact O-OG 3.17Å; S104-V148 WeakPolarHBondContact CB-O 3.26Å; S104-L149 VanDerWaalsContact CA-O 3.28Å; S104-L149 WeakPolarHBondContact CA-O 3.46Å; S104-L149 WeakPolarHBondContact CB-O 3.5Å; S104-N151 PolarHBondContact O-N 2.75Å
105	C	87.1	Confident	89	Confident	38 Å²	38	65.1 Å²	65.1	26%	0.257	34%	0.34	S	S	.	.	S	Bend	trans	-106.9	159	179.6	-68.9	0	0	0	0	110.9	E107	C105-E107 CarbonylContact C-O 3.54Å; C105-E107 WeakPolarHBondContact CB-O 3.47Å; C105-E107 PolarHBondContact O-N 2.94Å
106	P	84.4	Confident	88.8	Confident	72 Å²	72	70.1 Å²	70.1	47%	0.468	36%	0.362	S	S	.	.	S	Bend	trans	-58.6	-33.2	174.2	-24.4	34.4	0	0	0	113.1	L18 Y196	L18-P106 HydrophobicContact CD1-CB 3.65Å; P106-Y196 HydrophobicContact CG-CD1 4.35Å; P106-Y196 HydrophobicContact CG-CE1 3.67Å
107	E	85.8	Confident	88.6	Confident	118 Å²	118	70.5 Å²	70.5	55%	0.551	36%	0.363	S	S	*	.	S	Bend	trans	-92	133.8	167.2	-173.7	171.4	-169.8	0	0	110.1	C105 G109	C105-E107 CarbonylContact C-O 3.54Å; C105-E107 WeakPolarHBondContact CB-O 3.47Å; C105-E107 PolarHBondContact O-N 2.94Å; E107-G109 PolarHBondContact O-N 3.22Å
108	R	86.1	Confident	88.5	Confident	187 Å²	187	74.8 Å²	74.8	71%	0.706	38%	0.38	S	S	*	.			trans	-68.4	115.7	-178.9	-175.3	176.6	-175.6	-107.5	1.2	110.2	P102	P102-R108 HydrophobicContact CB-CG 4.45Å; P102-R108 WeakPolarHBondContact O-CA 3.37Å; P102-R108 WeakPolarHBondContact O-CG 3.32Å
109	G	82.9	Confident	88.4	Confident	35 Å²	35	78.9 Å²	78.9	36%	0.361	40%	0.403	S	S	.	.			trans	-69.4	153	175.5	0	0	0	0	0	112.9	P102 E107	P102-G109 PolarHBondContact O-N 2.99Å; P102-G109 VanDerWaalsContact O-N 3.14Å; E107-G109 PolarHBondContact O-N 3.22Å
110	S	83.9	Confident	88.5	Confident	82 Å²	82	76.8 Å²	76.8	57%	0.573	40%	0.396	S	S	*	.			trans	-67	148.4	165.1	-174.5	0	0	0	0	109.6	I112	S110-I112 VanDerWaalsContact C-N 3.28Å; S110-I112 PolarHBondContact OG-N 3.02Å
111	W	82.3	Confident	88.5	Confident	159 Å²	159	75.7 Å²	75.7	60%	0.602	39%	0.393	S	S	*	.	S	Bend	trans	-71.8	-28	171.4	-178.5	97.8	0	0	0	111.9	Q113	W111-Q113 PolarHBondContact O-N 3.36Å
112	I	85.8	Confident	88.6	Confident	97 Å²	97	79.5 Å²	79.5	50%	0.497	41%	0.412	S	S	.	.	S	Bend	trans	-73.9	129.4	176	-60.7	169.2	0	0	0	106.9	S110 G114	S110-I112 VanDerWaalsContact C-N 3.28Å; S110-I112 PolarHBondContact OG-N 3.02Å; I112-G114 PolarHBondContact O-N 2.84Å
113	Q	83.7	Confident	88.8	Confident	58 Å²	58	79.4 Å²	79.4	27%	0.271	41%	0.409	S	S	.	.			trans	-51.2	123	176.9	-76.7	169.6	-15.1	0	0	110.9	D97 R99 W111 D117	D97-Q113 PolarHBondContact OD1-NE2 3.25Å; D97-Q113 PolarHBondContact OD2-NE2 2.72Å; R99-Q113 HydrophobicContact CG-CG 4.31Å; W111-Q113 PolarHBondContact O-N 3.36Å; Q113-D117 WeakPolarHBondContact CA-OD2 3.42Å; Q113-D117 HydrophobicContact CB-CB 4.28Å; Q113-D117 HydrophobicContact CG-CB 4.39Å
114	G	86.6	Confident	89	Confident	34 Å²	34	72.2 Å²	72.2	35%	0.351	38%	0.378	S	S	.	.			trans	-70.6	-179.5	171.8	0	0	0	0	0	112	I112 D117 K118	I112-G114 PolarHBondContact O-N 2.84Å; G114-D117 PolarHBondContact N-OD2 3.11Å; G114-D117 VanDerWaalsContact N-OD2 3.08Å; G114-K118 WeakPolarHBondContact O-CG 3.09Å
115	S	89.9	Confident	89.3	Confident	85 Å²	85	74.4 Å²	74.4	59%	0.594	39%	0.387	S	S	*	.	H	α-helix	trans	-65.2	-44.5	167.3	51.9	0	0	0	0	111.1	D117 K118 D119	S115-D117 VanDerWaalsContact C-N 3.32Å; S115-D117 PolarHBondContact O-N 3.06Å; S115-K118 WeakPolarHBondContact O-CB 3.36Å; S115-K118 PolarHBondContact O-N 3.14Å; S115-D119 VanDerWaalsContact O-CG 3.24Å; S115-D119 PolarHBondContact O-N 3.21Å
116	Q	87.9	Confident	89.7	Confident	134 Å²	134	77.9 Å²	77.9	63%	0.626	40%	0.399	S	S	*	.	H	α-helix	trans	-56.4	-44	-180	-67.7	-178	-13	0	0	112.4	K118 D119 F120	Q116-K118 VanDerWaalsContact C-N 3.27Å; Q116-K118 PolarHBondContact O-N 2.96Å; Q116-D119 PolarHBondContact O-N 2.87Å; Q116-F120 HydrophobicContact CB-CE2 4.35Å; Q116-F120 WeakPolarHBondContact O-CD2 3.39Å; Q116-F120 PolarHBondContact O-N 2.89Å
117	D	91.2	Very high	90.2	Very high	22 Å²	22	74.9 Å²	74.9	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-59.4	-40.1	177.6	-58.5	-10.4	0	0	0	111.8	F100 Q113 G114 S115 S121	F100-D117 WeakPolarHBondContact CD2-OD1 3.24Å; Q113-D117 WeakPolarHBondContact CA-OD2 3.42Å; Q113-D117 HydrophobicContact CB-CB 4.28Å; Q113-D117 HydrophobicContact CG-CB 4.39Å; G114-D117 PolarHBondContact N-OD2 3.11Å; G114-D117 VanDerWaalsContact N-OD2 3.08Å; S115-D117 VanDerWaalsContact C-N 3.32Å; S115-D117 PolarHBondContact O-N 3.06Å; D117-S121 WeakPolarHBondContact O-CB 3.45Å; D117-S121 PolarHBondContact O-N 3.21Å; D117-S121 PolarHBondContact O-OG 2.9Å
118	K	92.6	Very high	90.6	Very high	120 Å²	120	69.3 Å²	69.3	52%	0.522	35%	0.354	S	S	.	.	H	α-helix	trans	-70.1	-39.4	177.3	-67	175.8	-178.9	179.3	0	111.6	G114 S115 Q116 S121 L122	G114-K118 WeakPolarHBondContact O-CG 3.09Å; S115-K118 WeakPolarHBondContact O-CB 3.36Å; S115-K118 PolarHBondContact O-N 3.14Å; Q116-K118 VanDerWaalsContact C-N 3.27Å; Q116-K118 PolarHBondContact O-N 2.96Å; K118-S121 WeakPolarHBondContact O-CB 3.28Å; K118-S121 PolarHBondContact O-N 3.28Å; K118-L122 PolarHBondContact O-N 2.86Å
119	D	93.8	Very high	91	Very high	87 Å²	87	65 Å²	65	47%	0.465	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-45	176.7	-60	-25.7	0	0	0	110.2	S115 Q116 S121 L122 M123	S115-D119 VanDerWaalsContact O-CG 3.24Å; S115-D119 PolarHBondContact O-N 3.21Å; Q116-D119 PolarHBondContact O-N 2.87Å; D119-S121 VanDerWaalsContact C-N 3.34Å; D119-S121 PolarHBondContact O-N 2.76Å; D119-L122 PolarHBondContact O-N 3.14Å; D119-M123 HydrophobicContact CB-CE 4.13Å; D119-M123 WeakPolarHBondContact O-CE 3.37Å; D119-M123 WeakPolarHBondContact O-CG 3.45Å; D119-M123 PolarHBondContact O-N 3.24Å
120	F	93.9	Very high	91.5	Very high	53 Å²	53	65.8 Å²	65.8	23%	0.232	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-37.1	173.1	-70.7	-56.9	0	0	0	113.2	M98 F100 Q116 L122 M123 L124 L156	M98-F120 HydrophobicContact CB-CB 4.4Å; M98-F120 HydrophobicContact CE-CB 4.4Å; M98-F120 HydrophobicContact CG-CB 4.3Å; M98-F120 HydrophobicContact SD-CB 3.57Å; M98-F120 VanDerWaalsContact SD-CB 3.57Å; M98-F120 HydrophobicContact SD-CG 4.28Å; F100-F120 AromaticContact CE2-CD2 3.77Å; F100-F120 HydrophobicContact CE2-CD2 3.77Å; F100-F120 HydrophobicContact CE2-CE2 4.16Å; F100-F120 HydrophobicContact CZ-CD2 4.02Å; F100-F120 HydrophobicContact CZ-CE2 4.05Å; Q116-F120 HydrophobicContact CB-CE2 4.35Å; Q116-F120 WeakPolarHBondContact O-CD2 3.39Å; Q116-F120 PolarHBondContact O-N 2.89Å; F120-L122 VanDerWaalsContact C-N 3.33Å; F120-L122 PolarHBondContact O-N 3.47Å; F120-M123 HydrophobicContact CD1-CE 3.45Å; F120-M123 VanDerWaalsContact CD1-CE 3.45Å; F120-M123 HydrophobicContact CE1-CE 3.85Å; F120-M123 HydrophobicContact CG-CE 4.15Å; F120-M123 PolarHBondContact O-N 3.39Å; F120-L124 VanDerWaalsContact O-CB 3.24Å; F120-L124 WeakPolarHBondContact O-CB 3.39Å; F120-L124 PolarHBondContact O-N 2.7Å; F120-L156 HydrophobicContact CD1-CB 4.11Å; F120-L156 HydrophobicContact CD1-CD1 3.97Å; F120-L156 HydrophobicContact CD1-CD2 4.1Å; F120-L156 HydrophobicContact CD1-CG 4.27Å; F120-L156 HydrophobicContact CE1-CB 4.17Å; F120-L156 HydrophobicContact CE1-CD2 4.3Å
121	S	95.4	Very high	92	Very high	12 Å²	12	61.9 Å²	61.9	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-60.9	-43.5	174.8	-60	0	0	0	0	111.5	T96 M98 D117 K118 D119 L124 Q125	T96-S121 WeakPolarHBondContact O-CB 3.49Å; T96-S121 PolarHBondContact OG1-O 2.93Å; M98-S121 PolarHBondContact N-OG 3.19Å; D117-S121 WeakPolarHBondContact O-CB 3.45Å; D117-S121 PolarHBondContact O-N 3.21Å; D117-S121 PolarHBondContact O-OG 2.9Å; K118-S121 WeakPolarHBondContact O-CB 3.28Å; K118-S121 PolarHBondContact O-N 3.28Å; D119-S121 VanDerWaalsContact C-N 3.34Å; D119-S121 PolarHBondContact O-N 2.76Å; S121-L124 PolarHBondContact O-N 3.14Å; S121-Q125 PolarHBondContact O-N 3.03Å
122	L	94.9	Very high	92.6	Very high	87 Å²	87	54.6 Å²	54.6	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-66.5	-48.1	177.1	-178.9	64.4	0	0	0	111.5	K118 D119 F120 L124 Q125 E126	K118-L122 PolarHBondContact O-N 2.86Å; D119-L122 PolarHBondContact O-N 3.14Å; F120-L122 VanDerWaalsContact C-N 3.33Å; F120-L122 PolarHBondContact O-N 3.47Å; L122-L124 PolarHBondContact O-N 2.95Å; L122-Q125 WeakPolarHBondContact O-CA 3.39Å; L122-Q125 WeakPolarHBondContact O-CB 2.92Å; L122-Q125 PolarHBondContact O-N 2.89Å; L122-E126 WeakPolarHBondContact O-CG 3.16Å; L122-E126 PolarHBondContact O-N 3.02Å
123	M	95.1	Very high	93	Very high	28 Å²	28	50.2 Å²	50.2	14%	0.138	26%	0.264	C	S	.	.	H	α-helix	trans	-57.7	-39.3	176.8	-73.5	-174.8	-95.7	0	0	112.1	D119 F120 S127 L156 Q228	D119-M123 HydrophobicContact CB-CE 4.13Å; D119-M123 WeakPolarHBondContact O-CE 3.37Å; D119-M123 WeakPolarHBondContact O-CG 3.45Å; D119-M123 PolarHBondContact O-N 3.24Å; F120-M123 HydrophobicContact CD1-CE 3.45Å; F120-M123 VanDerWaalsContact CD1-CE 3.45Å; F120-M123 HydrophobicContact CE1-CE 3.85Å; F120-M123 HydrophobicContact CG-CE 4.15Å; F120-M123 PolarHBondContact O-N 3.39Å; M123-S127 VanDerWaalsContact O-CB 3.3Å; M123-S127 WeakPolarHBondContact O-CB 3.19Å; M123-S127 PolarHBondContact O-N 3.31Å; M123-S127 PolarHBondContact O-OG 3.18Å; M123-L156 HydrophobicContact CB-CD1 4.21Å; M123-L156 HydrophobicContact CB-CD2 4.2Å; M123-L156 HydrophobicContact CE-CD2 4.41Å; M123-L156 HydrophobicContact SD-CD2 3.66Å; M123-Q228 HydrophobicContact SD-CB 3.93Å; M123-Q228 HydrophobicContact SD-CG 3.51Å; M123-Q228 VanDerWaalsContact SD-CG 3.51Å
124	L	96	Very high	93.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69.3	-36	176.4	-169.3	139.9	0	0	0	111.5	T96 M98 F120 S121 L122 L128 V144 V146 A159 V160 A163	T96-L124 HydrophobicContact CG2-CD2 3.37Å; M98-L124 HydrophobicContact SD-CD1 4.44Å; F120-L124 VanDerWaalsContact O-CB 3.24Å; F120-L124 WeakPolarHBondContact O-CB 3.39Å; F120-L124 PolarHBondContact O-N 2.7Å; S121-L124 PolarHBondContact O-N 3.14Å; L122-L124 PolarHBondContact O-N 2.95Å; L124-L128 HydrophobicContact CD2-CD1 3.48Å; L124-L128 VanDerWaalsContact CD2-CD1 3.48Å; L124-L128 HydrophobicContact CD2-CG 4.49Å; L124-L128 HydrophobicContact CG-CD1 4.09Å; L124-L128 WeakPolarHBondContact O-CB 3.48Å; L124-L128 VanDerWaalsContact O-CG 3.3Å; L124-L128 WeakPolarHBondContact O-CG 3.36Å; L124-L128 PolarHBondContact O-N 3.29Å; L124-V144 HydrophobicContact CD2-CG1 4.44Å; L124-V146 HydrophobicContact CD1-CG2 3.93Å; L124-V146 HydrophobicContact CD2-CG2 4.4Å; L124-A159 HydrophobicContact CD1-CB 3.68Å; L124-V160 HydrophobicContact CD1-CG2 4.35Å; L124-V160 HydrophobicContact CG-CG2 4.31Å; L124-A163 HydrophobicContact CD2-CB 4.32Å
125	Q	95.5	Very high	93.6	Very high	55 Å²	55	51.7 Å²	51.7	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-59.5	-53.8	172.9	-154.5	-177.4	-50.5	0	0	111.3	L94 T96 S121 L122 S127 L128 Q129	L94-Q125 PolarHBondContact O-NE2 3.41Å; T96-Q125 HydrophobicContact CG2-CB 4.37Å; T96-Q125 HydrophobicContact CG2-CG 4.41Å; T96-Q125 WeakPolarHBondContact OG1-CA 3.18Å; T96-Q125 WeakPolarHBondContact OG1-CB 3.37Å; T96-Q125 PolarHBondContact OG1-N 2.87Å; S121-Q125 PolarHBondContact O-N 3.03Å; L122-Q125 WeakPolarHBondContact O-CA 3.39Å; L122-Q125 WeakPolarHBondContact O-CB 2.92Å; L122-Q125 PolarHBondContact O-N 2.89Å; Q125-S127 VanDerWaalsContact C-N 3.28Å; Q125-S127 PolarHBondContact O-N 2.82Å; Q125-L128 PolarHBondContact O-N 2.79Å; Q125-Q129 WeakPolarHBondContact O-CB 3.43Å; Q125-Q129 PolarHBondContact O-N 2.84Å
126	E	95.1	Very high	93.7	Very high	110 Å²	110	52.6 Å²	52.6	51%	0.514	26%	0.256	S	S	.	.	H	α-helix	trans	-61.9	-38.5	-177.9	-69.1	177.7	170.5	0	0	111.2	L122 L128 P130	L122-E126 WeakPolarHBondContact O-CG 3.16Å; L122-E126 PolarHBondContact O-N 3.02Å; E126-L128 VanDerWaalsContact C-N 3.34Å; E126-L128 PolarHBondContact O-N 2.77Å; E126-P130 WeakPolarHBondContact O-CD 3Å
127	S	95.6	Very high	93.8	Very high	10 Å²	10	47.9 Å²	47.9	7%	0.07	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-30	179	-62	0	0	0	0	113.8	M123 Q125 S225	M123-S127 VanDerWaalsContact O-CB 3.3Å; M123-S127 WeakPolarHBondContact O-CB 3.19Å; M123-S127 PolarHBondContact O-N 3.31Å; M123-S127 PolarHBondContact O-OG 3.18Å; Q125-S127 VanDerWaalsContact C-N 3.28Å; Q125-S127 PolarHBondContact O-N 2.82Å; S127-S225 WeakPolarHBondContact O-CB 3.11Å; S127-S225 PolarHBondContact O-OG 2.92Å
128	L	95.4	Very high	93.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-96.6	-27.5	-176.8	-68.4	173.9	0	0	0	113.1	L94 T96 L124 Q125 E126 P130 A131 V132 V160 A163 L167 V178	L94-L128 HydrophobicContact CD2-CB 3.69Å; T96-L128 HydrophobicContact CG2-CD1 4.22Å; L124-L128 HydrophobicContact CD2-CD1 3.48Å; L124-L128 VanDerWaalsContact CD2-CD1 3.48Å; L124-L128 HydrophobicContact CD2-CG 4.49Å; L124-L128 HydrophobicContact CG-CD1 4.09Å; L124-L128 WeakPolarHBondContact O-CB 3.48Å; L124-L128 VanDerWaalsContact O-CG 3.3Å; L124-L128 WeakPolarHBondContact O-CG 3.36Å; L124-L128 PolarHBondContact O-N 3.29Å; Q125-L128 PolarHBondContact O-N 2.79Å; E126-L128 VanDerWaalsContact C-N 3.34Å; E126-L128 PolarHBondContact O-N 2.77Å; L128-P130 VanDerWaalsContact C-CD 3.47Å; L128-A131 WeakPolarHBondContact O-CB 3.46Å; L128-A131 PolarHBondContact O-N 2.82Å; L128-V132 PolarHBondContact O-N 3.07Å; L128-V160 HydrophobicContact CD2-CG1 4.36Å; L128-A163 HydrophobicContact CD1-CB 3.61Å; L128-A163 HydrophobicContact CD2-CB 4.33Å; L128-L167 HydrophobicContact CD1-CD1 4.24Å; L128-L167 HydrophobicContact CD2-CD1 4.18Å; L128-V178 HydrophobicContact CD2-CB 4.18Å; L128-V178 HydrophobicContact CD2-CG2 3.97Å
129	Q	93.7	Very high	93.4	Very high	97 Å²	97	51.5 Å²	51.5	45%	0.453	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-44.2	-179.4	-175.5	168.4	-7.1	0	0	114.7	Q125 A131 L134	Q125-Q129 WeakPolarHBondContact O-CB 3.43Å; Q125-Q129 PolarHBondContact O-N 2.84Å; Q129-A131 VanDerWaalsContact C-N 3.26Å; Q129-A131 PolarHBondContact O-N 3.46Å; Q129-L134 HydrophobicContact CG-CD1 4.05Å
130	P	94	Very high	93.1	Very high	52 Å²	52	48.6 Å²	48.6	34%	0.338	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19	178.8	29.1	-36	0	0	0	113.3	E126 L128 S225	E126-P130 WeakPolarHBondContact O-CD 3Å; L128-P130 VanDerWaalsContact C-CD 3.47Å; P130-S225 VanDerWaalsContact CG-CB 3.48Å
131	A	94.6	Very high	93	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-33	-179.9	0	0	0	0	0	112.5	L128 Q129 M174 Y175 V178 L218	L128-A131 WeakPolarHBondContact O-CB 3.46Å; L128-A131 PolarHBondContact O-N 2.82Å; Q129-A131 VanDerWaalsContact C-N 3.26Å; Q129-A131 PolarHBondContact O-N 3.46Å; A131-M174 CarbonylContact O-C 3.52Å; A131-M174 WeakPolarHBondContact O-CA 3.32Å; A131-M174 WeakPolarHBondContact O-CB 3.47Å; A131-Y175 PolarHBondContact O-N 3.38Å; A131-V178 HydrophobicContact CB-CG2 3.27Å; A131-L218 HydrophobicContact CB-CD2 3.75Å
132	V	94.9	Very high	93	Very high	5 Å²	5	47 Å²	47	3%	0.03	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-88.9	133.9	-173.5	-179.5	0	0	0	0	111.6	L128 L134 I142 L167 I172 M174	L128-V132 PolarHBondContact O-N 3.07Å; V132-L134 HydrophobicContact CB-CD2 4.4Å; V132-L134 HydrophobicContact CB-CG 4.43Å; V132-L134 HydrophobicContact CG1-CD2 3.78Å; V132-L134 HydrophobicContact CG1-CG 4.18Å; V132-L134 PolarHBondContact O-N 3.44Å; V132-I142 HydrophobicContact CG1-CD1 4.31Å; V132-L167 HydrophobicContact CG2-CD1 3.81Å; V132-I172 HydrophobicContact CG1-CG2 3.89Å; V132-M174 HydrophobicContact CG2-CG 4.2Å; V132-M174 HydrophobicContact CG2-SD 4.4Å
133	C	93.7	Very high	93	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.034	22%	0.219	C	C	.	.			trans	-77.1	65.2	177.5	-68.6	0	0	0	0	112.5	H135 K136 E173 Y175	C133-H135 PolarHBondContact O-N 3.34Å; C133-H135 VanDerWaalsContact O-N 3.11Å; C133-K136 HydrophobicContact CB-CD 4.11Å; C133-K136 HydrophobicContact CB-CG 4.24Å; C133-K136 PolarHBondContact O-N 2.77Å; C133-E173 HydrophobicContact CB-CB 4.2Å; C133-E173 WeakPolarHBondContact CB-O 3.36Å; C133-E173 PolarHBondContact N-O 3.04Å; C133-Y175 VanDerWaalsContact SG-CZ 3.52Å
134	L	91.4	Very high	93	Very high	21 Å²	21	44.2 Å²	44.2	11%	0.11	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-59.2	-26.6	-174.9	-65.9	175.3	0	0	0	114.3	G92 L94 Q129 V132 K136 Y137 I142	G92-L134 PolarHBondContact N-O 3.15Å; L94-L134 HydrophobicContact CB-CD1 4.49Å; L94-L134 HydrophobicContact CB-CD2 4.19Å; Q129-L134 HydrophobicContact CG-CD1 4.05Å; V132-L134 HydrophobicContact CB-CD2 4.4Å; V132-L134 HydrophobicContact CB-CG 4.43Å; V132-L134 HydrophobicContact CG1-CD2 3.78Å; V132-L134 HydrophobicContact CG1-CG 4.18Å; V132-L134 PolarHBondContact O-N 3.44Å; L134-K136 PolarHBondContact O-N 3.48Å; L134-Y137 PolarHBondContact O-N 3.28Å; L134-Y137 VanDerWaalsContact O-N 3.14Å; L134-I142 HydrophobicContact CD2-CD1 4.46Å
135	H	91.4	Very high	93.1	Very high	102 Å²	102	47 Å²	47	47%	0.472	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-62	-22.3	176.8	65.4	-84.4	0	0	0	113.6	C133 Y137 Y175	C133-H135 PolarHBondContact O-N 3.34Å; C133-H135 VanDerWaalsContact O-N 3.11Å; H135-Y137 VanDerWaalsContact C-N 3.33Å; H135-Y175 PolarHBondContact CE1-OH 3.31Å; H135-Y175 VanDerWaalsContact CE1-OH 3.28Å
136	K	90.9	Very high	93.1	Very high	105 Å²	105	44.5 Å²	44.5	46%	0.457	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-82.2	-13.1	178.6	-60.5	-171.1	179.2	-171.2	0	113.4	C133 L134 P138 E173	C133-K136 HydrophobicContact CB-CD 4.11Å; C133-K136 HydrophobicContact CB-CG 4.24Å; C133-K136 PolarHBondContact O-N 2.77Å; L134-K136 PolarHBondContact O-N 3.48Å; K136-P138 VanDerWaalsContact O-CD 3.25Å; K136-P138 WeakPolarHBondContact O-CD 3.4Å; K136-E173 HydrophobicContact CD-CB 4.39Å; K136-E173 WeakPolarHBondContact CD-OE2 3.24Å; K136-E173 VanDerWaalsContact CE-OE2 3.22Å; K136-E173 WeakPolarHBondContact CE-OE2 3.33Å; K136-E173 IonicContact NZ-OE2 2.79Å; K136-E173 PolarHBondContact NZ-OE2 3.49Å
137	Y	90.1	Very high	93.1	Very high	35 Å²	35	42.6 Å²	42.6	14%	0.137	21%	0.208	C	C	.	.	S	Bend	trans	-119.6	58.2	-175.3	-57	-72.2	0	0	0	111.7	P78 G92 L134 H135 S140 I142 I172 E173	P78-Y137 HydrophobicContact CB-CD1 4.15Å; P78-Y137 HydrophobicContact CG-CD1 3.99Å; P78-Y137 HydrophobicContact CG-CE1 4.14Å; G92-Y137 WeakPolarHBondContact CA-O 3.24Å; G92-Y137 PolarHBondContact N-O 2.82Å; G92-Y137 VanDerWaalsContact N-O 3.14Å; L134-Y137 PolarHBondContact O-N 3.28Å; L134-Y137 VanDerWaalsContact O-N 3.14Å; H135-Y137 VanDerWaalsContact C-N 3.33Å; Y137-S140 WeakPolarHBondContact O-CB 3.11Å; Y137-S140 PolarHBondContact O-N 2.85Å; Y137-I142 HydrophobicContact CD2-CD1 4.13Å; Y137-I172 HydrophobicContact CE2-CG2 3.98Å; Y137-E173 HydrophobicContact CE2-CB 4.4Å; Y137-E173 PolarHBondContact OH-N 2.8Å
138	P	88.8	Confident	93.1	Very high	63 Å²	63	42.1 Å²	42.1	41%	0.409	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	146	178.2	29.1	-35.5	0	0	0	110.7	K136 S140	K136-P138 VanDerWaalsContact O-CD 3.25Å; K136-P138 WeakPolarHBondContact O-CD 3.4Å; P138-S140 PolarHBondContact O-N 3.48Å; P138-S140 PolarHBondContact O-OG 3.25Å
139	R	86.4	Confident	93.1	Very high	154 Å²	154	44.7 Å²	44.7	58%	0.581	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	15	-179.1	-52.4	-177.4	-174.1	179	0.9	115.5	T87	T87-R139 HydrophobicContact CG2-CB 4.32Å
140	S	89.4	Confident	93.2	Very high	26 Å²	26	43.3 Å²	43.3	18%	0.182	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144	-179.6	-56.8	0	0	0	0	110.4	R79 G92 R93 Y137 P138	R79-S140 CarbonylContact O-C 3.55Å; R79-S140 WeakPolarHBondContact O-CA 3.5Å; G92-S140 CarbonylContact C-O 3.59Å; G92-S140 VanDerWaalsContact CA-O 3.24Å; G92-S140 WeakPolarHBondContact CA-O 3.3Å; R93-S140 PolarHBondContact N-O 3.32Å; Y137-S140 WeakPolarHBondContact O-CB 3.11Å; Y137-S140 PolarHBondContact O-N 2.85Å; P138-S140 PolarHBondContact O-N 3.48Å; P138-S140 PolarHBondContact O-OG 3.25Å
141	Q	91.3	Very high	93	Very high	30 Å²	30	42 Å²	42	14%	0.14	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133	169.9	-178.6	169.6	-24.9	0	0	109.6	R79 T81 R93 T95 E143	R79-Q141 PolarHBondContact N-O 3.37Å; R79-Q141 PolarHBondContact O-N 2.84Å; T81-Q141 WeakPolarHBondContact OG1-CB 3.33Å; R93-Q141 WeakPolarHBondContact O-CA 3.05Å; T95-Q141 HydrophobicContact CG2-CG 4.32Å; T95-Q141 PolarHBondContact OG1-NE2 2.85Å; Q141-E143 HydrophobicContact CG-CG 3.92Å; Q141-E143 PolarHBondContact NE2-OE1 3.47Å
142	I	94.3	Very high	92.8	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.7	171.1	-62.5	166.3	0	0	0	106.3	V75 P78 R93 L94 T95 V132 L134 Y137 V144 L167 I172	V75-I142 HydrophobicContact CG1-CG2 4.16Å; P78-I142 HydrophobicContact CB-CG1 4.42Å; R93-I142 PolarHBondContact O-N 3.26Å; L94-I142 HydrophobicContact CD1-CB 4.17Å; L94-I142 HydrophobicContact CD1-CG2 3.95Å; T95-I142 PolarHBondContact N-O 3.35Å; T95-I142 PolarHBondContact OG1-O 2.83Å; V132-I142 HydrophobicContact CG1-CD1 4.31Å; L134-I142 HydrophobicContact CD2-CD1 4.46Å; Y137-I142 HydrophobicContact CD2-CD1 4.13Å; I142-V144 HydrophobicContact CG2-CG2 4.32Å; I142-L167 HydrophobicContact CG2-CD2 3.94Å; I142-I172 HydrophobicContact CD1-CD1 4.2Å; I142-I172 HydrophobicContact CD1-CG2 3.97Å; I142-I172 HydrophobicContact CG1-CD1 4.36Å; I142-I172 HydrophobicContact CG2-CD1 3.62Å
143	E	94.8	Very high	92.4	Very high	57 Å²	57	43 Å²	43	27%	0.266	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.7	-180	-49.4	-170.7	144.6	0	0	109.7	V75 Y76 T95 Q141	V75-E143 WeakPolarHBondContact CA-O 3.41Å; Y76-E143 PolarHBondContact N-O 2.94Å; Y76-E143 PolarHBondContact O-N 2.83Å; T95-E143 CarbonylContact O-C 3.43Å; T95-E143 WeakPolarHBondContact O-CA 3.47Å; Q141-E143 HydrophobicContact CG-CG 3.92Å; Q141-E143 PolarHBondContact NE2-OE1 3.47Å
144	V	96.6	Very high	92.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	109.8	178.6	-178.2	0	0	0	0	108.1	C73 V75 L94 T95 T96 D97 L124 I142 V146 A163 L167	C73-V144 VanDerWaalsContact SG-CG1 3.57Å; V75-V144 HydrophobicContact CG2-CG1 4.27Å; V75-V144 HydrophobicContact CG2-CG2 4.16Å; L94-V144 HydrophobicContact CD1-CG2 3.71Å; T95-V144 PolarHBondContact O-N 2.96Å; T96-V144 CarbonylContact C-O 3.55Å; T96-V144 VanDerWaalsContact CA-O 3.3Å; T96-V144 WeakPolarHBondContact CA-O 3.44Å; T96-V144 HydrophobicContact CG2-CB 3.87Å; T96-V144 HydrophobicContact CG2-CG1 4.49Å; T96-V144 HydrophobicContact CG2-CG2 4.32Å; D97-V144 PolarHBondContact N-O 2.83Å; L124-V144 HydrophobicContact CD2-CG1 4.44Å; I142-V144 HydrophobicContact CG2-CG2 4.32Å; V144-V146 HydrophobicContact CG1-CG2 4.35Å; V144-A163 HydrophobicContact CG1-CB 3.81Å; V144-L167 HydrophobicContact CG2-CD2 3.83Å; V144-L167 HydrophobicContact CG2-CG 4.35Å
145	N	96.5	Very high	92.3	Very high	57 Å²	57	42.3 Å²	42.3	31%	0.305	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.9	-178.1	-67.4	-28.1	0	0	0	109.6	C73 C74 Y76 D97	C73-N145 WeakPolarHBondContact CA-O 3.44Å; C74-N145 PolarHBondContact N-O 2.92Å; C74-N145 PolarHBondContact O-N 2.8Å; Y76-N145 HydrophobicContact CE2-CB 4.45Å; Y76-N145 WeakPolarHBondContact CE2-ND2 3.39Å; D97-N145 WeakPolarHBondContact CB-OD1 3.22Å; D97-N145 CarbonylContact O-C 3.57Å; D97-N145 WeakPolarHBondContact O-CA 3.43Å
146	V	96.6	Very high	92.4	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.6	178	-175.9	0	0	0	0	109.5	V71 L72 C73 D97 M98 R99 L124 V144 A159 A163	V71-V146 HydrophobicContact CG1-CG1 3.35Å; L72-V146 CarbonylContact O-C 3.58Å; L72-V146 WeakPolarHBondContact O-CA 3.31Å; C73-V146 HydrophobicContact CB-CG2 4.27Å; D97-V146 PolarHBondContact O-N 2.94Å; M98-V146 HydrophobicContact CG-CB 4.38Å; M98-V146 HydrophobicContact CG-CG1 4.48Å; R99-V146 PolarHBondContact N-O 2.79Å; L124-V146 HydrophobicContact CD1-CG2 3.93Å; L124-V146 HydrophobicContact CD2-CG2 4.4Å; V144-V146 HydrophobicContact CG1-CG2 4.35Å; V146-A159 HydrophobicContact CG1-CB 3.93Å; V146-A163 HydrophobicContact CG2-CB 4.42Å
147	M	95.6	Very high	92.6	Very high	70 Å²	70	33.1 Å²	33.1	35%	0.345	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.1	174	-175.4	67.1	65.5	0	0	109.6	L72 R99 A101 L149	L72-M147 PolarHBondContact N-O 2.85Å; L72-M147 PolarHBondContact O-N 3.28Å; R99-M147 HydrophobicContact CB-CE 4.09Å; R99-M147 HydrophobicContact CB-SD 4.11Å; R99-M147 WeakPolarHBondContact O-CA 3.45Å; A101-M147 HydrophobicContact CB-SD 4.24Å; M147-L149 HydrophobicContact CG-CD2 4.1Å
148	V	95.7	Very high	92.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	115.4	173.9	-175.1	0	0	0	0	108	V71 M98 R99 F100 A101 S104 N151 V155	V71-V148 HydrophobicContact CG2-CG1 4.47Å; M98-V148 HydrophobicContact CE-CG2 3.65Å; R99-V148 PolarHBondContact O-N 2.89Å; F100-V148 HydrophobicContact CD1-CB 3.8Å; F100-V148 HydrophobicContact CD1-CG1 3.9Å; F100-V148 HydrophobicContact CD1-CG2 4.03Å; F100-V148 HydrophobicContact CE1-CB 4.14Å; F100-V148 HydrophobicContact CE1-CG1 4.04Å; F100-V148 HydrophobicContact CE1-CG2 3.96Å; F100-V148 HydrophobicContact CG-CB 4.32Å; F100-V148 HydrophobicContact CG-CG2 4.43Å; F100-V148 HydrophobicContact CZ-CG2 4.3Å; A101-V148 VanDerWaalsContact CB-O 3.24Å; A101-V148 WeakPolarHBondContact CB-O 3.5Å; A101-V148 PolarHBondContact N-O 2.89Å; S104-V148 WeakPolarHBondContact CB-O 3.26Å; V148-N151 HydrophobicContact CG1-CB 4.41Å; V148-V155 HydrophobicContact CB-CG1 4.22Å; V148-V155 HydrophobicContact CG1-CG1 3.71Å; V148-V155 HydrophobicContact CG2-CG1 3.43Å; V148-V155 VanDerWaalsContact CG2-CG1 3.43Å
149	L	94.9	Very high	93.2	Very high	54 Å²	54	28.8 Å²	28.8	28%	0.283	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-40.3	-179.7	-61.1	177.5	0	0	0	111.4	Y63 K70 F103 S104 M147	Y63-L149 HydrophobicContact CE2-CD1 4.17Å; K70-L149 HydrophobicContact CB-CB 4.06Å; K70-L149 PolarHBondContact O-N 2.78Å; F103-L149 WeakPolarHBondContact CE2-O 3.34Å; S104-L149 VanDerWaalsContact CA-O 3.28Å; S104-L149 WeakPolarHBondContact CA-O 3.46Å; S104-L149 WeakPolarHBondContact CB-O 3.5Å; M147-L149 HydrophobicContact CG-CD2 4.1Å
150	E	94.4	Very high	93.7	Very high	68 Å²	68	21.6 Å²	21.6	32%	0.318	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	126	-178.8	-171.7	173.2	174.1	0	0	108.8	N68 T69 K70	N68-E150 WeakPolarHBondContact O-CB 3.32Å; N68-E150 WeakPolarHBondContact O-CG 3.4Å; T69-E150 WeakPolarHBondContact CA-O 3.2Å; K70-E150 HydrophobicContact CB-CB 4.12Å; K70-E150 HydrophobicContact CD-CB 4.37Å; K70-E150 HydrophobicContact CG-CB 4.41Å; K70-E150 PolarHBondContact N-O 3.18Å; K70-E150 IonicContact NZ-OE2 3.92Å; K70-E150 PolarHBondContact NZ-OE2 2.88Å; K70-E150 PolarHBondContact O-N 2.85Å
151	N	91.6	Very high	94	Very high	26 Å²	26	20.5 Å²	20.5	14%	0.139	11%	0.105	C	C	.	.			trans	-101.3	104.6	179	179.1	3.2	0	0	0	110	S104 V148 G153 V155	S104-N151 PolarHBondContact O-N 2.75Å; V148-N151 HydrophobicContact CG1-CB 4.41Å; N151-G153 PolarHBondContact OD1-N 2.97Å; N151-V155 HydrophobicContact CB-CG2 4.08Å; N151-V155 WeakPolarHBondContact OD1-CG2 3.33Å
152	S	88.8	Confident	94.2	Very high	24 Å²	24	19 Å²	19	17%	0.168	10%	0.099	C	C	.	.	S	Bend	trans	-116.5	24.8	172.4	-172.6	0	0	0	0	112.1	R46 T69 T195 Y196	R46-S152 PolarHBondContact NH1-O 3.49Å; T69-S152 WeakPolarHBondContact OG1-CA 3.3Å; T69-S152 WeakPolarHBondContact OG1-CB 3.48Å; T69-S152 PolarHBondContact OG1-N 2.99Å; T69-S152 VanDerWaalsContact OG1-N 3.13Å; S152-T195 CarbonylContact O-C 3.57Å; S152-T195 WeakPolarHBondContact O-CA 3.49Å; S152-Y196 PolarHBondContact O-N 3.32Å
153	G	87.8	Confident	94.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	102.3	159.3	178.5	0	0	0	0	0	114.3	R46 T69 N151 V155 E199	R46-G153 PolarHBondContact NH2-O 3.13Å; T69-G153 PolarHBondContact OG1-N 3.38Å; T69-G153 PolarHBondContact OG1-O 3.43Å; N151-G153 PolarHBondContact OD1-N 2.97Å; G153-V155 VanDerWaalsContact C-N 3.26Å; G153-V155 PolarHBondContact O-N 3.01Å; G153-E199 WeakPolarHBondContact CA-OE2 3.12Å
154	S	90.1	Very high	94.4	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.021	9%	0.086	C	C	.	.			trans	57.2	32.3	178.2	-46.4	0	0	0	0	114.5	R46 L156 A157 H158 S182 D193 P194 E199	R46-S154 PolarHBondContact NH2-OG 3.39Å; S154-L156 PolarHBondContact O-N 3.21Å; S154-A157 PolarHBondContact O-N 3.4Å; S154-H158 PolarHBondContact O-N 2.95Å; S154-H158 PolarHBondContact O-ND1 2.92Å; S154-S182 WeakPolarHBondContact CB-OG 3.31Å; S154-S182 PolarHBondContact OG-OG 3.29Å; S154-D193 WeakPolarHBondContact CB-OD1 3.22Å; S154-D193 PolarHBondContact OG-OD1 2.74Å; S154-D193 VanDerWaalsContact OG-OD1 3.12Å; S154-P194 VanDerWaalsContact OG-CD 3.31Å; S154-P194 WeakPolarHBondContact OG-CD 3.24Å; S154-P194 PolarHBondContact OG-O 3.45Å; S154-P194 VanDerWaalsContact OG-O 3.05Å; S154-E199 WeakPolarHBondContact CA-OE1 3.35Å; S154-E199 PolarHBondContact N-OE1 3.2Å; S154-E199 PolarHBondContact N-OE2 2.96Å
155	V	93.2	Very high	94.3	Very high	10 Å²	10	16.3 Å²	16.3	6%	0.061	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-41.3	-168.4	-173.2	0	0	0	0	112.2	T69 V71 M98 F100 V148 N151 G153 A157 H158 A159	T69-V155 HydrophobicContact CG2-CG2 4.37Å; V71-V155 HydrophobicContact CG2-CG1 4.39Å; M98-V155 HydrophobicContact CE-CB 4.35Å; M98-V155 HydrophobicContact CE-CG1 3.47Å; M98-V155 VanDerWaalsContact CE-CG1 3.47Å; F100-V155 HydrophobicContact CE1-CB 4.48Å; F100-V155 HydrophobicContact CE1-CG1 3.99Å; F100-V155 HydrophobicContact CE1-CG2 4.45Å; F100-V155 HydrophobicContact CZ-CG1 4.2Å; V148-V155 HydrophobicContact CB-CG1 4.22Å; V148-V155 HydrophobicContact CG1-CG1 3.71Å; V148-V155 HydrophobicContact CG2-CG1 3.43Å; V148-V155 VanDerWaalsContact CG2-CG1 3.43Å; N151-V155 HydrophobicContact CB-CG2 4.08Å; N151-V155 WeakPolarHBondContact OD1-CG2 3.33Å; G153-V155 VanDerWaalsContact C-N 3.26Å; G153-V155 PolarHBondContact O-N 3.01Å; V155-A157 PolarHBondContact O-N 2.9Å; V155-H158 PolarHBondContact O-N 3.26Å; V155-A159 WeakPolarHBondContact O-CB 3.24Å; V155-A159 PolarHBondContact O-N 3.32Å
156	L	93.6	Very high	94.3	Very high	13 Å²	13	13.6 Å²	13.6	7%	0.068	7%	0.072	C	C	.	.	H	α-helix	trans	-60.5	-44.4	-180	-179	60.6	0	0	0	111.9	F120 M123 S154 H158 A159 V160 T214	F120-L156 HydrophobicContact CD1-CB 4.11Å; F120-L156 HydrophobicContact CD1-CD1 3.97Å; F120-L156 HydrophobicContact CD1-CD2 4.1Å; F120-L156 HydrophobicContact CD1-CG 4.27Å; F120-L156 HydrophobicContact CE1-CB 4.17Å; F120-L156 HydrophobicContact CE1-CD2 4.3Å; M123-L156 HydrophobicContact CB-CD1 4.21Å; M123-L156 HydrophobicContact CB-CD2 4.2Å; M123-L156 HydrophobicContact CE-CD2 4.41Å; M123-L156 HydrophobicContact SD-CD2 3.66Å; S154-L156 PolarHBondContact O-N 3.21Å; L156-H158 PolarHBondContact O-N 3.39Å; L156-A159 PolarHBondContact O-N 3.13Å; L156-V160 HydrophobicContact CD1-CG2 4.42Å; L156-V160 WeakPolarHBondContact O-CG2 3.21Å; L156-V160 PolarHBondContact O-N 2.89Å; L156-T214 HydrophobicContact CB-CG2 4.3Å; L156-T214 HydrophobicContact CD2-CG2 3.98Å; L156-T214 HydrophobicContact CG-CG2 4.1Å
157	A	94.6	Very high	94.3	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.008	7%	0.071	C	C	.	.	H	α-helix	trans	-60.5	-45.8	177.7	0	0	0	0	0	112.3	S154 V155 T161 G180 T214	S154-A157 PolarHBondContact O-N 3.4Å; V155-A157 PolarHBondContact O-N 2.9Å; A157-T161 PolarHBondContact O-N 2.94Å; A157-T161 VanDerWaalsContact O-N 3.15Å; A157-T161 PolarHBondContact O-OG1 2.83Å; A157-G180 WeakPolarHBondContact O-CA 3.49Å; A157-T214 HydrophobicContact CB-CG2 4.11Å
158	H	94.7	Very high	94.3	Very high	7 Å²	7	11.7 Å²	11.7	3%	0.032	7%	0.067	C	C	.	.	H	α-helix	trans	-69.3	-35.4	177.6	-66	93.8	0	0	0	112.1	I64 A66 V71 S154 V155 L156 T161 C162 D193	I64-H158 HydrophobicContact CG2-CB 4.35Å; A66-H158 WeakPolarHBondContact CB-CD2 2.86Å; A66-H158 WeakPolarHBondContact CB-NE2 3.25Å; V71-H158 HydrophobicContact CG2-CB 4.43Å; S154-H158 PolarHBondContact O-N 2.95Å; S154-H158 PolarHBondContact O-ND1 2.92Å; V155-H158 PolarHBondContact O-N 3.26Å; L156-H158 PolarHBondContact O-N 3.39Å; H158-T161 PolarHBondContact O-N 2.88Å; H158-C162 WeakPolarHBondContact O-CB 3.44Å; H158-C162 PolarHBondContact O-N 3.02Å; H158-D193 IonicContact CE1-OD1 3.18Å; H158-D193 PolarHBondContact CE1-OD1 3.19Å
159	A	96.3	Very high	94.2	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-46.1	175.8	0	0	0	0	0	111.9	V71 M98 L124 V146 V155 L156 T161 C162 A163	V71-A159 HydrophobicContact CG1-CB 4.47Å; M98-A159 HydrophobicContact CE-CB 3.97Å; M98-A159 HydrophobicContact SD-CB 3.99Å; L124-A159 HydrophobicContact CD1-CB 3.68Å; V146-A159 HydrophobicContact CG1-CB 3.93Å; V155-A159 WeakPolarHBondContact O-CB 3.24Å; V155-A159 PolarHBondContact O-N 3.32Å; L156-A159 PolarHBondContact O-N 3.13Å; A159-T161 VanDerWaalsContact C-N 3.35Å; A159-T161 PolarHBondContact O-N 3.04Å; A159-C162 PolarHBondContact O-N 3.05Å; A159-A163 VanDerWaalsContact O-CB 3.26Å; A159-A163 WeakPolarHBondContact O-CB 3.08Å; A159-A163 PolarHBondContact O-N 3.45Å
160	V	96.4	Very high	94.2	Very high	2 Å²	2	12 Å²	12	1%	0.012	7%	0.07	C	C	.	.	H	α-helix	trans	-60.4	-46.4	175.9	173	0	0	0	0	110.7	L124 L128 L156 C162 A163 S164 V178 A216	L124-V160 HydrophobicContact CD1-CG2 4.35Å; L124-V160 HydrophobicContact CG-CG2 4.31Å; L128-V160 HydrophobicContact CD2-CG1 4.36Å; L156-V160 HydrophobicContact CD1-CG2 4.42Å; L156-V160 WeakPolarHBondContact O-CG2 3.21Å; L156-V160 PolarHBondContact O-N 2.89Å; V160-C162 PolarHBondContact O-N 3.22Å; V160-A163 PolarHBondContact O-N 2.77Å; V160-S164 PolarHBondContact O-N 2.98Å; V160-V178 HydrophobicContact CG1-CB 3.92Å; V160-V178 HydrophobicContact CG1-CG1 3.36Å; V160-A216 HydrophobicContact CG1-CB 4.11Å
161	T	95.8	Very high	94.1	Very high	3 Å²	3	11.5 Å²	11.5	2%	0.018	8%	0.083	C	C	.	.	H	α-helix	trans	-60.8	-46.3	178.4	-54	0	0	0	0	111.6	I64 A157 H158 A159 A163 S164 M165 L179 G180 I256	I64-T161 HydrophobicContact CD1-CG2 4.14Å; A157-T161 PolarHBondContact O-N 2.94Å; A157-T161 VanDerWaalsContact O-N 3.15Å; A157-T161 PolarHBondContact O-OG1 2.83Å; H158-T161 PolarHBondContact O-N 2.88Å; A159-T161 VanDerWaalsContact C-N 3.35Å; A159-T161 PolarHBondContact O-N 3.04Å; T161-A163 VanDerWaalsContact C-N 3.34Å; T161-A163 PolarHBondContact O-N 2.77Å; T161-S164 PolarHBondContact O-N 2.75Å; T161-M165 WeakPolarHBondContact O-CG 3.48Å; T161-M165 PolarHBondContact O-N 3.3Å; T161-M165 VanDerWaalsContact O-N 3.14Å; T161-L179 HydrophobicContact CG2-CD2 4.03Å; T161-G180 PolarHBondContact OG1-N 3.29Å; T161-I256 HydrophobicContact CG2-CD1 3.31Å; T161-I256 HydrophobicContact CG2-CG1 4.26Å
162	C	96.2	Very high	94.3	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.5	-40.2	177.5	-166	0	0	0	0	112	A62 I64 V71 C73 H158 A159 V160 M165 A166	A62-C162 VanDerWaalsContact C-SG 3.56Å; A62-C162 WeakPolarHBondContact CB-O 3.41Å; A62-C162 PolarHBondContact O-SG 3.29Å; I64-C162 HydrophobicContact CB-CB 4.37Å; I64-C162 HydrophobicContact CG2-CB 3.66Å; V71-C162 HydrophobicContact CG1-CB 4.48Å; C73-C162 HydrophobicContact CB-CB 4.2Å; C73-C162 WeakPolarHBondContact CB-SG 3.19Å; H158-C162 WeakPolarHBondContact O-CB 3.44Å; H158-C162 PolarHBondContact O-N 3.02Å; A159-C162 PolarHBondContact O-N 3.05Å; V160-C162 PolarHBondContact O-N 3.22Å; C162-M165 PolarHBondContact O-N 3.46Å; C162-A166 WeakPolarHBondContact O-CB 3.19Å; C162-A166 PolarHBondContact O-N 2.96Å
163	A	96.7	Very high	94.5	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.9	-43.6	178.4	0	0	0	0	0	112.1	C73 L124 L128 V144 V146 A159 V160 T161 M165 A166 L167	C73-A163 VanDerWaalsContact SG-CA 3.58Å; L124-A163 HydrophobicContact CD2-CB 4.32Å; L128-A163 HydrophobicContact CD1-CB 3.61Å; L128-A163 HydrophobicContact CD2-CB 4.33Å; V144-A163 HydrophobicContact CG1-CB 3.81Å; V146-A163 HydrophobicContact CG2-CB 4.42Å; A159-A163 VanDerWaalsContact O-CB 3.26Å; A159-A163 WeakPolarHBondContact O-CB 3.08Å; A159-A163 PolarHBondContact O-N 3.45Å; V160-A163 PolarHBondContact O-N 2.77Å; T161-A163 VanDerWaalsContact C-N 3.34Å; T161-A163 PolarHBondContact O-N 2.77Å; A163-M165 VanDerWaalsContact C-N 3.28Å; A163-M165 PolarHBondContact O-N 3.03Å; A163-A166 PolarHBondContact O-N 2.68Å; A163-L167 VanDerWaalsContact O-CG 3.32Å; A163-L167 WeakPolarHBondContact O-CG 3.45Å; A163-L167 PolarHBondContact O-N 2.84Å
164	S	96.2	Very high	94.9	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.007	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-41.7	174.6	-178	0	0	0	0	111.9	V160 T161 L167 A168 M174 L177 V178	V160-S164 PolarHBondContact O-N 2.98Å; T161-S164 PolarHBondContact O-N 2.75Å; S164-L167 PolarHBondContact O-N 2.78Å; S164-A168 PolarHBondContact O-N 2.95Å; S164-M174 WeakPolarHBondContact O-CE 3.42Å; S164-L177 WeakPolarHBondContact OG-CA 3.31Å; S164-V178 WeakPolarHBondContact CB-O 3.37Å; S164-V178 PolarHBondContact OG-N 3.06Å
165	M	95.6	Very high	95.1	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-67.6	-37.4	176.9	-68.4	-177.5	68.9	0	0	113.1	V50 C52 A62 T161 C162 A163 A168 D169 I256 A259 L260	V50-M165 HydrophobicContact CB-CE 4.04Å; V50-M165 HydrophobicContact CB-SD 4.39Å; V50-M165 HydrophobicContact CG1-CE 3.24Å; V50-M165 HydrophobicContact CG1-SD 3.4Å; V50-M165 WeakPolarHBondContact CG1-SD 3.41Å; C52-M165 WeakPolarHBondContact SG-CE 3.21Å; A62-M165 HydrophobicContact CB-CB 3.87Å; T161-M165 WeakPolarHBondContact O-CG 3.48Å; T161-M165 PolarHBondContact O-N 3.3Å; T161-M165 VanDerWaalsContact O-N 3.14Å; C162-M165 PolarHBondContact O-N 3.46Å; A163-M165 VanDerWaalsContact C-N 3.28Å; A163-M165 PolarHBondContact O-N 3.03Å; M165-A168 PolarHBondContact O-N 2.95Å; M165-D169 WeakPolarHBondContact O-CB 3.37Å; M165-D169 PolarHBondContact O-N 2.99Å; M165-I256 HydrophobicContact CE-CG2 4Å; M165-I256 HydrophobicContact CG-CG2 3.76Å; M165-I256 HydrophobicContact SD-CB 4.14Å; M165-I256 HydrophobicContact SD-CG1 3.85Å; M165-I256 HydrophobicContact SD-CG2 3.53Å; M165-I256 VanDerWaalsContact SD-CG2 3.53Å; M165-A259 HydrophobicContact CE-CB 3.82Å; M165-L260 HydrophobicContact CE-CG 4.27Å
166	A	96.3	Very high	95.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69	-34.2	176	0	0	0	0	0	112.2	A62 C73 V75 C162 A163 D169 A170	A62-A166 HydrophobicContact CB-CB 3.9Å; C73-A166 HydrophobicContact CB-CB 4Å; V75-A166 HydrophobicContact CG2-CB 3.58Å; C162-A166 WeakPolarHBondContact O-CB 3.19Å; C162-A166 PolarHBondContact O-N 2.96Å; A163-A166 PolarHBondContact O-N 2.68Å; A166-D169 PolarHBondContact O-N 3.19Å; A166-A170 WeakPolarHBondContact O-CB 3.34Å; A166-A170 PolarHBondContact O-N 2.82Å
167	L	96	Very high	95.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.1	-42.2	172.7	-72	168.1	0	0	0	111.3	V75 L128 V132 I142 V144 A163 S164 A170 G171 I172 M174	V75-L167 HydrophobicContact CG1-CD2 3.96Å; V75-L167 HydrophobicContact CG2-CD2 4.06Å; V75-L167 HydrophobicContact CG2-CG 4.2Å; L128-L167 HydrophobicContact CD1-CD1 4.24Å; L128-L167 HydrophobicContact CD2-CD1 4.18Å; V132-L167 HydrophobicContact CG2-CD1 3.81Å; I142-L167 HydrophobicContact CG2-CD2 3.94Å; V144-L167 HydrophobicContact CG2-CD2 3.83Å; V144-L167 HydrophobicContact CG2-CG 4.35Å; A163-L167 VanDerWaalsContact O-CG 3.32Å; A163-L167 WeakPolarHBondContact O-CG 3.45Å; A163-L167 PolarHBondContact O-N 2.84Å; S164-L167 PolarHBondContact O-N 2.78Å; L167-A170 PolarHBondContact O-N 2.73Å; L167-G171 PolarHBondContact O-N 3.34Å; L167-I172 HydrophobicContact CD2-CD1 3.58Å; L167-I172 PolarHBondContact O-N 2.85Å; L167-I172 VanDerWaalsContact O-N 3.15Å; L167-M174 HydrophobicContact CB-CE 4.11Å; L167-M174 HydrophobicContact CB-SD 3.54Å; L167-M174 VanDerWaalsContact CB-SD 3.54Å; L167-M174 HydrophobicContact CD1-SD 4.03Å; L167-M174 HydrophobicContact CG-SD 4.43Å
168	A	95.2	Very high	95.3	Very high	32 Å²	32	22.6 Å²	22.6	26%	0.264	13%	0.127	S	C	.	.	H	α-helix	trans	-62.9	-43.9	174.2	0	0	0	0	0	112	S164 M165 A170 G171 M174 L177 L260	S164-A168 PolarHBondContact O-N 2.95Å; M165-A168 PolarHBondContact O-N 2.95Å; A168-A170 VanDerWaalsContact C-N 3.31Å; A168-A170 PolarHBondContact O-N 3.29Å; A168-G171 PolarHBondContact O-N 3.44Å; A168-M174 HydrophobicContact CB-CE 3.63Å; A168-L177 HydrophobicContact CB-CD2 3.99Å; A168-L260 HydrophobicContact CB-CD1 4.35Å; A168-L260 HydrophobicContact CB-CD2 3.83Å
169	D	94.4	Very high	95.4	Very high	54 Å²	54	22.4 Å²	22.4	29%	0.289	13%	0.126	S	C	.	.	H	α-helix	trans	-63	-36.2	176.7	-169.6	64.1	0	0	0	112	C52 G53 G60 S61 M165 A166 G171	C52-D169 HydrophobicContact CB-CB 4.11Å; G53-D169 WeakPolarHBondContact CA-OD2 3.4Å; G53-D169 PolarHBondContact N-OD2 2.76Å; G60-D169 WeakPolarHBondContact CA-OD2 3.28Å; S61-D169 PolarHBondContact N-OD2 3.12Å; M165-D169 WeakPolarHBondContact O-CB 3.37Å; M165-D169 PolarHBondContact O-N 2.99Å; A166-D169 PolarHBondContact O-N 3.19Å; D169-G171 PolarHBondContact O-N 3.2Å
170	A	93.9	Very high	95.3	Very high	8 Å²	8	22.5 Å²	22.5	7%	0.066	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-9.1	174.6	0	0	0	0	0	113.9	K59 V75 A166 L167 A168 I172	K59-A170 HydrophobicContact CG-CB 4.41Å; V75-A170 HydrophobicContact CB-CB 4.27Å; V75-A170 HydrophobicContact CG1-CB 3.98Å; A166-A170 WeakPolarHBondContact O-CB 3.34Å; A166-A170 PolarHBondContact O-N 2.82Å; L167-A170 PolarHBondContact O-N 2.73Å; A168-A170 VanDerWaalsContact C-N 3.31Å; A168-A170 PolarHBondContact O-N 3.29Å; A170-I172 VanDerWaalsContact C-N 3.31Å; A170-I172 HydrophobicContact CB-CD1 3.94Å; A170-I172 HydrophobicContact CB-CG1 4.08Å
171	G	92.9	Very high	95.1	Very high	57 Å²	57	22.7 Å²	22.7	59%	0.588	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.8	28.1	-174.6	0	0	0	0	0	113.2	L167 A168 D169	L167-G171 PolarHBondContact O-N 3.34Å; A168-G171 PolarHBondContact O-N 3.44Å; D169-G171 PolarHBondContact O-N 3.2Å
172	I	94.8	Very high	95	Very high	9 Å²	9	22.7 Å²	22.7	5%	0.046	13%	0.128	C	C	.	.			trans	-78.9	134.8	174.2	-67.4	164.2	0	0	0	108.4	V75 V132 Y137 I142 L167 A170 M174	V75-I172 HydrophobicContact CG1-CD1 3.61Å; V132-I172 HydrophobicContact CG1-CG2 3.89Å; Y137-I172 HydrophobicContact CE2-CG2 3.98Å; I142-I172 HydrophobicContact CD1-CD1 4.2Å; I142-I172 HydrophobicContact CD1-CG2 3.97Å; I142-I172 HydrophobicContact CG1-CD1 4.36Å; I142-I172 HydrophobicContact CG2-CD1 3.62Å; L167-I172 HydrophobicContact CD2-CD1 3.58Å; L167-I172 PolarHBondContact O-N 2.85Å; L167-I172 VanDerWaalsContact O-N 3.15Å; A170-I172 VanDerWaalsContact C-N 3.31Å; A170-I172 HydrophobicContact CB-CD1 3.94Å; A170-I172 HydrophobicContact CB-CG1 4.08Å; I172-M174 PolarHBondContact O-N 2.87Å
173	E	94.3	Very high	94.7	Very high	89 Å²	89	22.8 Å²	22.8	42%	0.416	13%	0.129	S	C	.	.			trans	-70.8	121.9	-178.5	-64.8	-172.7	-150.4	0	0	111.3	C133 K136 Y137	C133-E173 HydrophobicContact CB-CB 4.2Å; C133-E173 WeakPolarHBondContact CB-O 3.36Å; C133-E173 PolarHBondContact N-O 3.04Å; K136-E173 HydrophobicContact CD-CB 4.39Å; K136-E173 WeakPolarHBondContact CD-OE2 3.24Å; K136-E173 VanDerWaalsContact CE-OE2 3.22Å; K136-E173 WeakPolarHBondContact CE-OE2 3.33Å; K136-E173 IonicContact NZ-OE2 2.79Å; K136-E173 PolarHBondContact NZ-OE2 3.49Å; Y137-E173 HydrophobicContact CE2-CB 4.4Å; Y137-E173 PolarHBondContact OH-N 2.8Å
174	M	94.9	Very high	94.3	Very high	40 Å²	40	24.3 Å²	24.3	20%	0.197	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-128.2	151.4	178.7	-60.5	-172.8	-64	0	0	109.7	A131 V132 S164 L167 A168 I172 L177	A131-M174 CarbonylContact O-C 3.52Å; A131-M174 WeakPolarHBondContact O-CA 3.32Å; A131-M174 WeakPolarHBondContact O-CB 3.47Å; V132-M174 HydrophobicContact CG2-CG 4.2Å; V132-M174 HydrophobicContact CG2-SD 4.4Å; S164-M174 WeakPolarHBondContact O-CE 3.42Å; L167-M174 HydrophobicContact CB-CE 4.11Å; L167-M174 HydrophobicContact CB-SD 3.54Å; L167-M174 VanDerWaalsContact CB-SD 3.54Å; L167-M174 HydrophobicContact CD1-SD 4.03Å; L167-M174 HydrophobicContact CG-SD 4.43Å; A168-M174 HydrophobicContact CB-CE 3.63Å; I172-M174 PolarHBondContact O-N 2.87Å; M174-L177 HydrophobicContact CE-CD2 3.86Å
175	Y	95.1	Very high	93.8	Very high	138 Å²	138	24.8 Å²	24.8	54%	0.541	14%	0.137	S	C	.	.	S	Bend	trans	-71.9	-40.4	172.5	-64.3	-68.9	0	0	0	111.7	A131 C133 H135	A131-Y175 PolarHBondContact O-N 3.38Å; C133-Y175 VanDerWaalsContact SG-CZ 3.52Å; H135-Y175 PolarHBondContact CE1-OH 3.31Å; H135-Y175 VanDerWaalsContact CE1-OH 3.28Å
176	D	95.3	Very high	92.9	Very high	12 Å²	12	26.1 Å²	26.1	6%	0.064	14%	0.144	C	C	.	.	S	Bend	trans	-159	166.7	-178.6	-169.5	17.8	0	0	0	110.2	L218 P219 S220 L221	D176-L218 HydrophobicContact CB-CB 4.31Å; D176-L218 HydrophobicContact CB-CD2 3.88Å; D176-L218 WeakPolarHBondContact OD2-CA 3.5Å; D176-P219 VanDerWaalsContact OD2-CD 3.28Å; D176-P219 WeakPolarHBondContact OD2-CD 3.35Å; D176-P219 VanDerWaalsContact OD2-N 3.09Å; D176-S220 VanDerWaalsContact CG-CB 3.4Å; D176-S220 VanDerWaalsContact CG-OG 3.22Å; D176-S220 WeakPolarHBondContact OD1-CB 3.38Å; D176-S220 PolarHBondContact OD1-OG 3.1Å; D176-S220 WeakPolarHBondContact OD2-CA 3.25Å; D176-S220 WeakPolarHBondContact OD2-CB 3.24Å; D176-S220 PolarHBondContact OD2-N 3.5Å; D176-S220 PolarHBondContact OD2-OG 2.93Å; D176-L221 HydrophobicContact CB-CD1 4.27Å; D176-L221 HydrophobicContact CB-CG 4.38Å; D176-L221 PolarHBondContact OD2-N 3.15Å
177	L	94.9	Very high	92	Very high	22 Å²	22	26.8 Å²	26.8	12%	0.115	15%	0.15	C	C	.	.			trans	-77.4	143.9	172.5	-63.8	171.8	0	0	0	110.1	S164 A168 M174 P219 Y253 I256 L260	S164-L177 WeakPolarHBondContact OG-CA 3.31Å; A168-L177 HydrophobicContact CB-CD2 3.99Å; M174-L177 HydrophobicContact CE-CD2 3.86Å; L177-P219 WeakPolarHBondContact O-CD 3.42Å; L177-Y253 HydrophobicContact CD1-CE2 4.33Å; L177-I256 HydrophobicContact CD1-CG2 4.1Å; L177-L260 HydrophobicContact CD1-CD1 3.53Å; L177-L260 HydrophobicContact CD2-CD1 3.94Å; L177-L260 HydrophobicContact CG-CD1 4.39Å
178	V	96	Very high	90.8	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.194	C	C	.	.			trans	-99.8	122.5	175.2	-165.6	0	0	0	0	109.1	L128 A131 V160 S164 A216 L218 S225	L128-V178 HydrophobicContact CD2-CB 4.18Å; L128-V178 HydrophobicContact CD2-CG2 3.97Å; A131-V178 HydrophobicContact CB-CG2 3.27Å; V160-V178 HydrophobicContact CG1-CB 3.92Å; V160-V178 HydrophobicContact CG1-CG1 3.36Å; S164-V178 WeakPolarHBondContact CB-O 3.37Å; S164-V178 PolarHBondContact OG-N 3.06Å; V178-A216 HydrophobicContact CG1-CB 3.91Å; V178-L218 HydrophobicContact CG2-CD2 3.81Å; V178-S225 WeakPolarHBondContact CG1-OG 3.06Å
179	L	95.6	Very high	89.9	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132	174.2	-58.5	-169.6	0	0	0	110	T161 A216 F217 P219 C249 L252 Y253 I256	T161-L179 HydrophobicContact CG2-CD2 4.03Å; L179-A216 CarbonylContact O-C 3.58Å; L179-A216 WeakPolarHBondContact O-CA 2.95Å; L179-F217 PolarHBondContact N-O 2.85Å; L179-F217 PolarHBondContact O-N 2.72Å; L179-P219 HydrophobicContact CD1-CG 4.07Å; L179-P219 HydrophobicContact CG-CG 4.28Å; L179-C249 HydrophobicContact CB-CB 3.95Å; L179-C249 HydrophobicContact CD1-CB 4.14Å; L179-C249 WeakPolarHBondContact CD1-O 3.41Å; L179-L252 HydrophobicContact CD1-CB 4.48Å; L179-Y253 HydrophobicContact CD1-CD2 3.94Å; L179-Y253 HydrophobicContact CD1-CG 4.33Å; L179-I256 HydrophobicContact CD2-CD1 3.17Å; L179-I256 HydrophobicContact CD2-CG1 4.48Å; L179-I256 HydrophobicContact CG-CD1 4.46Å
180	G	94.3	Very high	89.3	Confident	3 Å²	3	31.2 Å²	31.2	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	133.8	172.5	0	0	0	0	0	111	A157 T161 V215	A157-G180 WeakPolarHBondContact O-CA 3.49Å; T161-G180 PolarHBondContact OG1-N 3.29Å; G180-V215 CarbonylContact C-O 3.58Å; G180-V215 WeakPolarHBondContact CA-O 3.46Å
181	C	93.5	Very high	88.8	Confident	5 Å²	5	31.1 Å²	31.1	3%	0.034	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	141.6	164.8	-173.3	0	0	0	0	108.9	V215 C245 C249	C181-V215 PolarHBondContact N-O 3.48Å; C181-V215 PolarHBondContact O-N 3.02Å; C181-C245 HydrophobicContact CB-CB 4.18Å; C181-C249 WeakPolarHBondContact CB-SG 3.27Å
182	S	92.5	Very high	88.6	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	156.5	174.4	73.1	0	0	0	0	111.3	S154 D193 P194 L213	S154-S182 WeakPolarHBondContact CB-OG 3.31Å; S154-S182 PolarHBondContact OG-OG 3.29Å; S182-D193 PolarHBondContact O-N 3.47Å; S182-P194 WeakPolarHBondContact OG-CD 3.3Å; S182-L213 CarbonylContact C-O 3.58Å; S182-L213 WeakPolarHBondContact CA-O 3.45Å
183	L	90.8	Very high	88.3	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142.6	-175.4	176.5	152.5	0	0	0	109.1	Y190 V191 V192 G212 L213 T244 C245	L183-Y190 HydrophobicContact CD1-CD2 4.17Å; L183-Y190 HydrophobicContact CD1-CG 4.42Å; L183-V191 CarbonylContact C-O 3.59Å; L183-V191 VanDerWaalsContact CA-O 3.31Å; L183-V191 WeakPolarHBondContact CA-O 3.38Å; L183-V192 HydrophobicContact CD1-CG2 4.24Å; L183-G212 CarbonylContact O-C 3.55Å; L183-G212 WeakPolarHBondContact O-CA 3.45Å; L183-L213 HydrophobicContact CB-CB 4.39Å; L183-L213 HydrophobicContact CD2-CB 4.43Å; L183-L213 PolarHBondContact N-O 3.01Å; L183-L213 PolarHBondContact O-N 2.99Å; L183-T244 WeakPolarHBondContact CD1-OG1 3.45Å; L183-C245 VanDerWaalsContact CB-SG 3.5Å
184	R	88.3	Confident	87.9	Confident	32 Å²	32	24.1 Å²	24.1	12%	0.121	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.1	173.4	-175.3	69.8	173.6	134.4	-13.5	109.4	V191 P194 R210 G211	R184-V191 PolarHBondContact N-O 3.25Å; R184-V191 PolarHBondContact O-N 2.91Å; R184-P194 HydrophobicContact CB-CB 3.92Å; R184-P194 HydrophobicContact CB-CG 4.02Å; R184-R210 PolarHBondContact NH1-O 3.2Å; R184-G211 WeakPolarHBondContact CD-O 2.98Å; R184-G211 PolarHBondContact NH1-O 2.73Å
185	Q	84.1	Confident	87.5	Confident	10 Å²	10	23 Å²	23	5%	0.047	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.3	167	-178.2	177.3	1.3	0	0	109.6	G187 G211 M233 T237	Q185-G187 WeakPolarHBondContact CG-O 3.36Å; Q185-G187 PolarHBondContact NE2-O 3.36Å; Q185-G211 PolarHBondContact N-O 3.39Å; Q185-M233 HydrophobicContact CB-CE 4.01Å; Q185-T237 HydrophobicContact CG-CG2 4.39Å
186	D	78.4	Confident	87.1	Confident	30 Å²	30	19 Å²	19	16%	0.16	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	95.3	168.8	-167.3	32.6	0	0	0	108.4	G188 S189 R210	D186-G188 PolarHBondContact O-N 2.79Å; D186-S189 PolarHBondContact N-O 3.2Å; D186-S189 PolarHBondContact O-N 3.37Å; D186-S189 VanDerWaalsContact O-N 3.14Å; D186-S189 PolarHBondContact O-OG 3.39Å; D186-S189 VanDerWaalsContact O-OG 3.05Å; D186-R210 IonicContact OD1-CZ 3.73Å; D186-R210 IonicContact OD1-NH1 3.91Å; D186-R210 IonicContact OD1-NH2 2.84Å; D186-R210 PolarHBondContact OD1-NH2 2.74Å
187	G	76.6	Confident	86.4	Confident	13 Å²	13	21.9 Å²	21.9	13%	0.134	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-115.6	-177.8	0	0	0	0	0	112.5	Q185	Q185-G187 WeakPolarHBondContact CG-O 3.36Å; Q185-G187 PolarHBondContact NE2-O 3.36Å
188	G	70.1	Confident	85.7	Confident	88 Å²	88	21.5 Å²	21.5	91%	0.907	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.9	179.2	0	0	0	0	0	114.9	D186	D186-G188 PolarHBondContact O-N 2.79Å
189	S	77.9	Confident	85	Confident	24 Å²	24	24.9 Å²	24.9	17%	0.168	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	156	-176.8	61.5	0	0	0	0	111.8	D186	D186-S189 PolarHBondContact N-O 3.2Å; D186-S189 PolarHBondContact O-N 3.37Å; D186-S189 VanDerWaalsContact O-N 3.14Å; D186-S189 PolarHBondContact O-OG 3.39Å; D186-S189 VanDerWaalsContact O-OG 3.05Å
190	Y	80.8	Confident	84.1	Confident	67 Å²	67	29.8 Å²	29.8	26%	0.263	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144	173.3	53.2	-90.9	0	0	0	111.2	L183 T244	L183-Y190 HydrophobicContact CD1-CD2 4.17Å; L183-Y190 HydrophobicContact CD1-CG 4.42Å; Y190-T244 HydrophobicContact CD2-CG2 4.34Å; Y190-T244 HydrophobicContact CE2-CG2 3.69Å
191	V	84.7	Confident	82.8	Confident	6 Å²	6	31.4 Å²	31.4	4%	0.036	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	108.7	-176.4	178.7	0	0	0	0	106.8	R34 L183 R184	R34-V191 VanDerWaalsContact CZ-CG1 3.45Å; L183-V191 CarbonylContact C-O 3.59Å; L183-V191 VanDerWaalsContact CA-O 3.31Å; L183-V191 WeakPolarHBondContact CA-O 3.38Å; R184-V191 PolarHBondContact N-O 3.25Å; R184-V191 PolarHBondContact O-N 2.91Å
192	V	87.8	Confident	81	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	137.2	171.5	-177.8	0	0	0	0	108.8	R34 V43 L183	R34-V192 PolarHBondContact NH1-O 2.99Å; V43-V192 HydrophobicContact CG1-CG1 4.47Å; L183-V192 HydrophobicContact CD1-CG2 4.24Å
193	D	87.9	Confident	79.1	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.027	23%	0.233	C	C	.	.	S	Bend	trans	56.2	65.1	177.1	-167.2	31.5	0	0	0	113.5	R38 R46 S154 H158 S182	R38-D193 PolarHBondContact NH1-O 3.44Å; R46-D193 VanDerWaalsContact CB-OD2 3.3Å; R46-D193 WeakPolarHBondContact CB-OD2 3.39Å; R46-D193 WeakPolarHBondContact CD-OD2 3.31Å; R46-D193 WeakPolarHBondContact CG-OD2 3.4Å; R46-D193 IonicContact CZ-OD1 3.34Å; R46-D193 IonicContact CZ-OD2 2.75Å; R46-D193 PolarHBondContact N-OD2 3.35Å; R46-D193 VanDerWaalsContact N-OD2 3.07Å; R46-D193 IonicContact NE-OD1 3.61Å; R46-D193 PolarHBondContact NE-OD1 3.17Å; R46-D193 IonicContact NE-OD2 3.63Å; R46-D193 PolarHBondContact NE-OD2 3.23Å; R46-D193 IonicContact NH2-OD1 3.33Å; R46-D193 PolarHBondContact NH2-OD1 2.91Å; R46-D193 IonicContact NH2-OD2 3.74Å; S154-D193 WeakPolarHBondContact CB-OD1 3.22Å; S154-D193 PolarHBondContact OG-OD1 2.74Å; S154-D193 VanDerWaalsContact OG-OD1 3.12Å; H158-D193 IonicContact CE1-OD1 3.18Å; H158-D193 PolarHBondContact CE1-OD1 3.19Å; S182-D193 PolarHBondContact O-N 3.47Å
194	P	87.1	Confident	76.8	Confident	2 Å²	2	50 Å²	50	1%	0.013	27%	0.271	C	S	.	.			trans	-66.6	148.3	-176.4	30.2	-38.9	0	0	0	113.2	R46 S154 S182 R184 E198 E199	R46-P194 PolarHBondContact NH2-O 3.22Å; S154-P194 VanDerWaalsContact OG-CD 3.31Å; S154-P194 WeakPolarHBondContact OG-CD 3.24Å; S154-P194 PolarHBondContact OG-O 3.45Å; S154-P194 VanDerWaalsContact OG-O 3.05Å; S182-P194 WeakPolarHBondContact OG-CD 3.3Å; R184-P194 HydrophobicContact CB-CB 3.92Å; R184-P194 HydrophobicContact CB-CG 4.02Å; P194-E198 WeakPolarHBondContact CA-OE2 3.3Å; P194-E198 HydrophobicContact CB-CB 3.97Å; P194-E199 HydrophobicContact CB-CG 3.94Å; P194-E199 HydrophobicContact CG-CG 3.76Å
195	T	86.9	Confident	74.5	Confident	17 Å²	17	52 Å²	52	10%	0.104	30%	0.301	C	S	.	.			trans	-78.9	163.2	170.4	58.1	0	0	0	0	111.6	S152 L197 E198 E199	S152-T195 CarbonylContact O-C 3.57Å; S152-T195 WeakPolarHBondContact O-CA 3.49Å; T195-L197 PolarHBondContact O-N 3.39Å; T195-L197 VanDerWaalsContact O-N 3.15Å; T195-E198 PolarHBondContact N-OE2 3.43Å; T195-E198 WeakPolarHBondContact O-CA 3.49Å; T195-E198 PolarHBondContact O-N 2.84Å; T195-E198 WeakPolarHBondContact OG1-CG 3.19Å; T195-E198 PolarHBondContact OG1-N 2.86Å; T195-E198 PolarHBondContact OG1-OE2 3.38Å; T195-E198 VanDerWaalsContact OG1-OE2 3.08Å; T195-E199 PolarHBondContact O-N 3Å
196	Y	85.3	Confident	72.8	Confident	55 Å²	55	59.8 Å²	59.8	22%	0.216	33%	0.33	C	S	.	.	H	α-helix	trans	-53.5	-36.7	176.9	-180	-95.1	0	0	0	112.7	P106 S152 N200	P106-Y196 HydrophobicContact CG-CD1 4.35Å; P106-Y196 HydrophobicContact CG-CE1 3.67Å; S152-Y196 PolarHBondContact O-N 3.32Å; Y196-N200 HydrophobicContact CE1-CB 4.35Å; Y196-N200 WeakPolarHBondContact O-CB 3.21Å; Y196-N200 PolarHBondContact O-N 3.43Å
197	L	81.6	Confident	71.5	Confident	71 Å²	71	70.8 Å²	70.8	37%	0.372	37%	0.369	S	S	.	.	H	α-helix	trans	-68.9	-39	175.9	-63.9	177.4	0	0	0	111.7	T195 S201	T195-L197 PolarHBondContact O-N 3.39Å; T195-L197 VanDerWaalsContact O-N 3.15Å; L197-S201 WeakPolarHBondContact O-CA 3.34Å; L197-S201 WeakPolarHBondContact O-CB 3.44Å; L197-S201 PolarHBondContact O-N 3.22Å; L197-S201 PolarHBondContact O-OG 3.21Å
198	E	80.4	Confident	70.9	Confident	15 Å²	15	73.1 Å²	73.1	7%	0.07	38%	0.377	C	S	.	.	H	α-helix	trans	-70.9	-32.3	177.8	-69.8	166.9	154.3	0	0	112.1	L28 P194 T195 S201	L28-E198 HydrophobicContact CD1-CG 4.1Å; P194-E198 WeakPolarHBondContact CA-OE2 3.3Å; P194-E198 HydrophobicContact CB-CB 3.97Å; T195-E198 PolarHBondContact N-OE2 3.43Å; T195-E198 WeakPolarHBondContact O-CA 3.49Å; T195-E198 PolarHBondContact O-N 2.84Å; T195-E198 WeakPolarHBondContact OG1-CG 3.19Å; T195-E198 PolarHBondContact OG1-N 2.86Å; T195-E198 PolarHBondContact OG1-OE2 3.38Å; T195-E198 VanDerWaalsContact OG1-OE2 3.08Å; E198-S201 PolarHBondContact O-OG 3.22Å
199	E	80.5	Confident	70.6	Confident	70 Å²	70	73.5 Å²	73.5	33%	0.327	35%	0.353	S	S	.	.	H	α-helix	trans	-71.5	-47.3	173.1	-70	-176.7	164.4	0	0	111.7	G153 S154 P194 T195	G153-E199 WeakPolarHBondContact CA-OE2 3.12Å; S154-E199 WeakPolarHBondContact CA-OE1 3.35Å; S154-E199 PolarHBondContact N-OE1 3.2Å; S154-E199 PolarHBondContact N-OE2 2.96Å; P194-E199 HydrophobicContact CB-CG 3.94Å; P194-E199 HydrophobicContact CG-CG 3.76Å; T195-E199 PolarHBondContact O-N 3Å
200	N	76.6	Confident	70.5	Confident	106 Å²	106	73.6 Å²	73.6	57%	0.567	35%	0.35	S	S	*	.	H	α-helix	trans	-91.7	-6.9	-171.9	-156.9	41.6	0	0	0	114.1	Y196 W202	Y196-N200 HydrophobicContact CE1-CB 4.35Å; Y196-N200 WeakPolarHBondContact O-CB 3.21Å; Y196-N200 PolarHBondContact O-N 3.43Å; N200-W202 VanDerWaalsContact C-N 3.26Å; N200-W202 PolarHBondContact O-N 3.45Å
201	S	67.4	Low	70.6	Confident	37 Å²	37	70.4 Å²	70.4	26%	0.259	34%	0.338	S	S	.	.			trans	-72	82.7	176.3	52.3	0	0	0	0	110.9	L197 E198 R203 R210	L197-S201 WeakPolarHBondContact O-CA 3.34Å; L197-S201 WeakPolarHBondContact O-CB 3.44Å; L197-S201 PolarHBondContact O-N 3.22Å; L197-S201 PolarHBondContact O-OG 3.21Å; E198-S201 PolarHBondContact O-OG 3.22Å; S201-R203 PolarHBondContact O-N 2.88Å; S201-R210 PolarHBondContact O-NH1 3.25Å
202	W	55.6	Low	70.8	Confident	199 Å²	199	71 Å²	71	75%	0.754	35%	0.345	S	S	*	.			trans	-73.7	93	164	-165.4	-90.5	0	0	0	108.7	N200 S204	N200-W202 VanDerWaalsContact C-N 3.26Å; N200-W202 PolarHBondContact O-N 3.45Å; W202-S204 PolarHBondContact O-N 3.47Å
203	R	52.3	Low	71	Confident	86 Å²	86	71 Å²	71	33%	0.325	35%	0.345	S	S	.	.			trans	-64.8	102.4	170.5	-73.5	-176.2	134.4	172	5.5	108.7	L28 S201 G205	L28-R203 PolarHBondContact O-NH2 3.35Å; L28-R203 VanDerWaalsContact O-NH2 3.15Å; S201-R203 PolarHBondContact O-N 2.88Å; R203-G205 VanDerWaalsContact C-N 3.31Å; R203-G205 PolarHBondContact O-N 3.28Å
204	S	41.9	Very low	71.3	Confident	117 Å²	117	72.1 Å²	72.1	82%	0.818	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	90.3	162.6	-74.7	0	0	0	0	109	W202	W202-S204 PolarHBondContact O-N 3.47Å
205	G	41.8	Very low	71.7	Confident	73 Å²	73	72 Å²	72	75%	0.753	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	163	-8.7	168.4	0	0	0	0	0	120.1	R203	R203-G205 VanDerWaalsContact C-N 3.31Å; R203-G205 PolarHBondContact O-N 3.28Å
206	R	47	Very low	72.1	Confident	173 Å²	173	71.3 Å²	71.3	65%	0.653	35%	0.347	S	S	*	.			trans	-135.1	132	177.9	-94.2	177.9	171.6	-158	5	112.6	E208	R206-E208 HydrophobicContact CB-CB 4.45Å; R206-E208 HydrophobicContact CB-CG 4.14Å; R206-E208 WeakPolarHBondContact CD-OE1 3.46Å; R206-E208 IonicContact CZ-OE1 3.38Å; R206-E208 IonicContact NE-OE1 3.44Å; R206-E208 IonicContact NH1-OE1 3.37Å; R206-E208 PolarHBondContact NH1-OE1 2.97Å; R206-E208 PolarHBondContact O-N 2.88Å
207	R	51.9	Low	72.7	Confident	262 Å²	262	68.8 Å²	68.8	99%	0.989	34%	0.337	S	S	*	.			trans	-64.4	46.6	166.7	-79.5	177.6	161.9	-178.4	-4.5	111.8
208	E	63.3	Low	73.3	Confident	62 Å²	62	65.4 Å²	65.4	29%	0.29	32%	0.32	S	S	.	.			trans	-97.3	130.8	176.4	-79.6	170.3	-178.6	0	0	108.2	R206 R210	R206-E208 HydrophobicContact CB-CB 4.45Å; R206-E208 HydrophobicContact CB-CG 4.14Å; R206-E208 WeakPolarHBondContact CD-OE1 3.46Å; R206-E208 IonicContact CZ-OE1 3.38Å; R206-E208 IonicContact NE-OE1 3.44Å; R206-E208 IonicContact NH1-OE1 3.37Å; R206-E208 PolarHBondContact NH1-OE1 2.97Å; R206-E208 PolarHBondContact O-N 2.88Å; E208-R210 WeakPolarHBondContact O-CG 3.43Å; E208-R210 PolarHBondContact O-N 3.14Å
209	K	63.5	Low	74	Confident	95 Å²	95	65.1 Å²	65.1	41%	0.413	32%	0.319	S	S	.	.			trans	-58.4	128.8	176.1	-67.7	-177.2	178.1	-178.6	0	109.1	E232	K209-E232 HydrophobicContact CG-CG 4.37Å
210	R	75.9	Confident	74.6	Confident	26 Å²	26	65.4 Å²	65.4	10%	0.098	33%	0.329	C	S	.	.			trans	-137.3	104	-175.6	-75.4	170.7	-177.3	-108.4	-25.8	107.6	R184 D186 S201 E208 E232	R184-R210 PolarHBondContact NH1-O 3.2Å; D186-R210 IonicContact OD1-CZ 3.73Å; D186-R210 IonicContact OD1-NH1 3.91Å; D186-R210 IonicContact OD1-NH2 2.84Å; D186-R210 PolarHBondContact OD1-NH2 2.74Å; S201-R210 PolarHBondContact O-NH1 3.25Å; E208-R210 WeakPolarHBondContact O-CG 3.43Å; E208-R210 PolarHBondContact O-N 3.14Å; R210-E232 CarbonylContact C-O 3.32Å; R210-E232 VanDerWaalsContact C-O 3.32Å; R210-E232 PolarHBondContact N-O 2.67Å; R210-E232 VanDerWaalsContact N-O 3.16Å; R210-E232 PolarHBondContact O-N 2.9Å; R210-E232 VanDerWaalsContact O-N 3.08Å
211	G	83.3	Confident	75.4	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	152.1	167.6	0	0	0	0	0	113.3	R184 Q185 D230 E232 M233	R184-G211 WeakPolarHBondContact CD-O 2.98Å; R184-G211 PolarHBondContact NH1-O 2.73Å; Q185-G211 PolarHBondContact N-O 3.39Å; G211-D230 CarbonylContact C-O 3.58Å; G211-D230 WeakPolarHBondContact CA-O 3.45Å; G211-E232 PolarHBondContact N-O 3.48Å; G211-M233 VanDerWaalsContact CA-CG 3.46Å
212	G	88.6	Confident	76.7	Confident	18 Å²	18	68 Å²	68	19%	0.186	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	141.8	168.8	0	0	0	0	0	108.4	L183 S229 D230	L183-G212 CarbonylContact O-C 3.55Å; L183-G212 WeakPolarHBondContact O-CA 3.45Å; G212-S229 CarbonylContact O-C 3.55Å; G212-S229 WeakPolarHBondContact O-CA 3.05Å; G212-D230 PolarHBondContact N-O 2.87Å; G212-D230 PolarHBondContact O-N 2.67Å
213	L	92	Very high	78.5	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.4	179.2	-175.7	68	0	0	0	108.1	S182 L183 V215 L227 Q228 L238 I242	S182-L213 CarbonylContact C-O 3.58Å; S182-L213 WeakPolarHBondContact CA-O 3.45Å; L183-L213 HydrophobicContact CB-CB 4.39Å; L183-L213 HydrophobicContact CD2-CB 4.43Å; L183-L213 PolarHBondContact N-O 3.01Å; L183-L213 PolarHBondContact O-N 2.99Å; L213-V215 HydrophobicContact CD2-CG2 4.06Å; L213-V215 HydrophobicContact CG-CG2 4.05Å; L213-L227 HydrophobicContact CD1-CD1 3.52Å; L213-L227 HydrophobicContact CD1-CG 4.19Å; L213-L227 HydrophobicContact CG-CD1 4.29Å; L213-Q228 CarbonylContact C-O 3.36Å; L213-Q228 WeakPolarHBondContact CA-O 3.43Å; L213-L238 HydrophobicContact CD1-CD1 3.55Å; L213-L238 HydrophobicContact CD2-CD1 4.26Å; L213-L238 HydrophobicContact CG-CD1 4.44Å; L213-I242 HydrophobicContact CD2-CG1 3.75Å
214	T	93.9	Very high	80.6	Confident	29 Å²	29	62.3 Å²	62.3	18%	0.178	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125	168.8	-57.7	0	0	0	0	108.6	L156 A157 Q228	L156-T214 HydrophobicContact CB-CG2 4.3Å; L156-T214 HydrophobicContact CD2-CG2 3.98Å; L156-T214 HydrophobicContact CG-CG2 4.1Å; A157-T214 HydrophobicContact CB-CG2 4.11Å; T214-Q228 PolarHBondContact N-O 2.67Å; T214-Q228 PolarHBondContact O-N 2.9Å
215	V	95.3	Very high	83.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.6	-179.7	-177.1	0	0	0	0	108.2	G180 C181 L213 F217 V224 L227 I242 C245	G180-V215 CarbonylContact C-O 3.58Å; G180-V215 WeakPolarHBondContact CA-O 3.46Å; C181-V215 PolarHBondContact N-O 3.48Å; C181-V215 PolarHBondContact O-N 3.02Å; L213-V215 HydrophobicContact CD2-CG2 4.06Å; L213-V215 HydrophobicContact CG-CG2 4.05Å; V215-F217 HydrophobicContact CG1-CB 4.4Å; V215-V224 HydrophobicContact CG1-CG1 4.12Å; V215-V224 HydrophobicContact CG1-CG2 4.35Å; V215-L227 HydrophobicContact CB-CD1 4.45Å; V215-L227 HydrophobicContact CG2-CD1 3.62Å; V215-I242 HydrophobicContact CG2-CG1 4.46Å; V215-C245 HydrophobicContact CB-CB 3.92Å; V215-C245 HydrophobicContact CG2-CB 3.6Å
216	A	96.4	Very high	85.5	Confident	3 Å²	3	55 Å²	55	3%	0.025	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.2	165	0	0	0	0	0	108.9	V160 V178 L179 V224 S225 G226	V160-A216 HydrophobicContact CG1-CB 4.11Å; V178-A216 HydrophobicContact CG1-CB 3.91Å; L179-A216 CarbonylContact O-C 3.58Å; L179-A216 WeakPolarHBondContact O-CA 2.95Å; A216-V224 WeakPolarHBondContact O-CG1 3.49Å; A216-S225 WeakPolarHBondContact CB-OG 3.38Å; A216-S225 PolarHBondContact O-N 2.9Å; A216-S225 PolarHBondContact O-OG 3.45Å; A216-G226 PolarHBondContact N-O 3.49Å; A216-G226 PolarHBondContact O-N 3.43Å
217	F	96.4	Very high	87.8	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.2	-166.2	-180	-112.7	0	0	0	111.9	L179 V215 P219 N222 Q223 V224 I246 C249 Y250	L179-F217 PolarHBondContact N-O 2.85Å; L179-F217 PolarHBondContact O-N 2.72Å; V215-F217 HydrophobicContact CG1-CB 4.4Å; F217-P219 HydrophobicContact CD1-CB 4.15Å; F217-P219 HydrophobicContact CE1-CB 3.87Å; F217-P219 WeakPolarHBondContact O-CD 3.35Å; F217-N222 WeakPolarHBondContact CE2-OD1 3.36Å; F217-N222 HydrophobicContact CZ-CB 4.37Å; F217-N222 WeakPolarHBondContact CZ-OD1 3.5Å; F217-Q223 WeakPolarHBondContact CD2-O 3.34Å; F217-V224 HydrophobicContact CD2-CG2 4.24Å; F217-I246 HydrophobicContact CD2-CG1 4.1Å; F217-I246 HydrophobicContact CE1-CG2 3.95Å; F217-I246 HydrophobicContact CE2-CD1 4.46Å; F217-I246 HydrophobicContact CE2-CG1 4.17Å; F217-I246 HydrophobicContact CE2-CG2 4.14Å; F217-I246 HydrophobicContact CG-CG1 4.45Å; F217-I246 HydrophobicContact CZ-CG2 3.74Å; F217-C249 HydrophobicContact CB-CB 4.38Å; F217-C249 HydrophobicContact CD1-CB 3.79Å; F217-Y250 HydrophobicContact CE1-CD2 4.45Å; F217-Y250 HydrophobicContact CE1-CE1 4.21Å; F217-Y250 AromaticContact CE1-CE2 3.91Å; F217-Y250 HydrophobicContact CE1-CE2 3.91Å; F217-Y250 AromaticContact CE1-CZ 3.77Å; F217-Y250 HydrophobicContact CZ-CE2 4.05Å; F217-Y250 AromaticContact CZ-CZ 3.87Å
218	L	96	Very high	89.7	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	100	174.9	-62.6	158.7	0	0	0	108	A131 D176 V178 L221 N222 Q223	A131-L218 HydrophobicContact CB-CD2 3.75Å; D176-L218 HydrophobicContact CB-CB 4.31Å; D176-L218 HydrophobicContact CB-CD2 3.88Å; D176-L218 WeakPolarHBondContact OD2-CA 3.5Å; V178-L218 HydrophobicContact CG2-CD2 3.81Å; L218-L221 HydrophobicContact CB-CB 4.26Å; L218-L221 HydrophobicContact CD1-CD1 4.48Å; L218-L221 PolarHBondContact O-N 2.93Å; L218-N222 WeakPolarHBondContact O-CA 3.37Å; L218-N222 PolarHBondContact O-N 2.63Å; L218-Q223 WeakPolarHBondContact CB-O 3.5Å; L218-Q223 HydrophobicContact CD1-CB 4.24Å; L218-Q223 PolarHBondContact N-O 3.08Å; L218-Q223 PolarHBondContact O-N 2.85Å
219	P	93.9	Very high	91	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.058	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.8	-169.2	28.1	-33.6	0	0	0	115	D176 L177 L179 F217 Y250 Y253	D176-P219 VanDerWaalsContact OD2-CD 3.28Å; D176-P219 WeakPolarHBondContact OD2-CD 3.35Å; D176-P219 VanDerWaalsContact OD2-N 3.09Å; L177-P219 WeakPolarHBondContact O-CD 3.42Å; L179-P219 HydrophobicContact CD1-CG 4.07Å; L179-P219 HydrophobicContact CG-CG 4.28Å; F217-P219 HydrophobicContact CD1-CB 4.15Å; F217-P219 HydrophobicContact CE1-CB 3.87Å; F217-P219 WeakPolarHBondContact O-CD 3.35Å; P219-Y250 HydrophobicContact CB-CD1 4.34Å; P219-Y250 HydrophobicContact CB-CE1 4.09Å; P219-Y253 HydrophobicContact CB-CD2 4.08Å; P219-Y253 HydrophobicContact CB-CE2 4.32Å; P219-Y253 HydrophobicContact CB-CG 4.36Å; P219-Y253 HydrophobicContact CG-CD2 3.32Å; P219-Y253 HydrophobicContact CG-CE2 3.39Å; P219-Y253 HydrophobicContact CG-CG 4.07Å
220	S	93.2	Very high	92.2	Very high	75 Å²	75	43.8 Å²	43.8	52%	0.524	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-35.6	177.9	-46.2	0	0	0	0	111.5	D176 Y253	D176-S220 VanDerWaalsContact CG-CB 3.4Å; D176-S220 VanDerWaalsContact CG-OG 3.22Å; D176-S220 WeakPolarHBondContact OD1-CB 3.38Å; D176-S220 PolarHBondContact OD1-OG 3.1Å; D176-S220 WeakPolarHBondContact OD2-CA 3.25Å; D176-S220 WeakPolarHBondContact OD2-CB 3.24Å; D176-S220 PolarHBondContact OD2-N 3.5Å; D176-S220 PolarHBondContact OD2-OG 2.93Å; S220-Y253 PolarHBondContact OG-OH 2.96Å
221	L	93.2	Very high	92.7	Very high	94 Å²	94	45.4 Å²	45.4	49%	0.492	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-9.5	178.9	-65.7	174.4	0	0	0	113.4	D176 L218 Q223	D176-L221 HydrophobicContact CB-CD1 4.27Å; D176-L221 HydrophobicContact CB-CG 4.38Å; D176-L221 PolarHBondContact OD2-N 3.15Å; L218-L221 HydrophobicContact CB-CB 4.26Å; L218-L221 HydrophobicContact CD1-CD1 4.48Å; L218-L221 PolarHBondContact O-N 2.93Å; L221-Q223 HydrophobicContact CB-CB 4.27Å; L221-Q223 PolarHBondContact O-N 3.17Å
222	N	94.7	Very high	92.8	Very high	105 Å²	105	51.2 Å²	51.2	56%	0.561	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	44.3	-172.3	-166.8	34.6	0	0	0	112.6	F217 L218 Y250	F217-N222 WeakPolarHBondContact CE2-OD1 3.36Å; F217-N222 HydrophobicContact CZ-CB 4.37Å; F217-N222 WeakPolarHBondContact CZ-OD1 3.5Å; L218-N222 WeakPolarHBondContact O-CA 3.37Å; L218-N222 PolarHBondContact O-N 2.63Å; N222-Y250 PolarHBondContact OD1-OH 3.35Å
223	Q	94.6	Very high	92.6	Very high	106 Å²	106	52.2 Å²	52.2	50%	0.495	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.3	-175.7	-174.1	175.1	1.4	0	0	110.9	F217 L218 L221	F217-Q223 WeakPolarHBondContact CD2-O 3.34Å; L218-Q223 WeakPolarHBondContact CB-O 3.5Å; L218-Q223 HydrophobicContact CD1-CB 4.24Å; L218-Q223 PolarHBondContact N-O 3.08Å; L218-Q223 PolarHBondContact O-N 2.85Å; L221-Q223 HydrophobicContact CB-CB 4.27Å; L221-Q223 PolarHBondContact O-N 3.17Å
224	V	95.2	Very high	92.4	Very high	59 Å²	59	53.6 Å²	53.6	36%	0.358	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.9	172.3	178.3	0	0	0	0	108.5	V215 A216 F217 G226	V215-V224 HydrophobicContact CG1-CG1 4.12Å; V215-V224 HydrophobicContact CG1-CG2 4.35Å; A216-V224 WeakPolarHBondContact O-CG1 3.49Å; F217-V224 HydrophobicContact CD2-CG2 4.24Å; V224-G226 WeakPolarHBondContact CG1-O 3.37Å
225	S	93.9	Very high	92.1	Very high	22 Å²	22	59.9 Å²	59.9	15%	0.154	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-35.9	178	60.8	0	0	0	0	112.6	S127 P130 V178 A216	S127-S225 WeakPolarHBondContact O-CB 3.11Å; S127-S225 PolarHBondContact O-OG 2.92Å; P130-S225 VanDerWaalsContact CG-CB 3.48Å; V178-S225 WeakPolarHBondContact CG1-OG 3.06Å; A216-S225 WeakPolarHBondContact CB-OG 3.38Å; A216-S225 PolarHBondContact O-N 2.9Å; A216-S225 PolarHBondContact O-OG 3.45Å
226	G	93.7	Very high	91.8	Very high	15 Å²	15	68 Å²	68	16%	0.155	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	146.7	-179.4	0	0	0	0	0	111.4	A216 V224	A216-G226 PolarHBondContact N-O 3.49Å; A216-G226 PolarHBondContact O-N 3.43Å; V224-G226 WeakPolarHBondContact CG1-O 3.37Å
227	L	94.1	Very high	91.4	Very high	81 Å²	81	69.9 Å²	69.9	42%	0.424	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	121.7	178.8	-176	72.9	0	0	0	108.8	L213 V215 I242	L213-L227 HydrophobicContact CD1-CD1 3.52Å; L213-L227 HydrophobicContact CD1-CG 4.19Å; L213-L227 HydrophobicContact CG-CD1 4.29Å; V215-L227 HydrophobicContact CB-CD1 4.45Å; V215-L227 HydrophobicContact CG2-CD1 3.62Å; L227-I242 HydrophobicContact CD1-CD1 4.2Å; L227-I242 HydrophobicContact CD1-CG1 4.07Å; L227-I242 HydrophobicContact CD2-CD1 4.01Å
228	Q	92.6	Very high	91.1	Very high	84 Å²	84	72 Å²	72	39%	0.393	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.5	170.7	-178	66.6	5.9	0	0	109.3	M123 L213 T214	M123-Q228 HydrophobicContact SD-CB 3.93Å; M123-Q228 HydrophobicContact SD-CG 3.51Å; M123-Q228 VanDerWaalsContact SD-CG 3.51Å; L213-Q228 CarbonylContact C-O 3.36Å; L213-Q228 WeakPolarHBondContact CA-O 3.43Å; T214-Q228 PolarHBondContact N-O 2.67Å; T214-Q228 PolarHBondContact O-N 2.9Å
229	S	91.4	Very high	90.9	Very high	70 Å²	70	74.7 Å²	74.7	49%	0.49	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.3	170.6	60.8	0	0	0	0	109.7	G212	G212-S229 CarbonylContact O-C 3.55Å; G212-S229 WeakPolarHBondContact O-CA 3.05Å
230	D	88.5	Confident	90.7	Very high	121 Å²	121	76.3 Å²	76.3	65%	0.647	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	144.9	172.9	-174.5	18	0	0	0	109.6	G211 G212	G211-D230 CarbonylContact C-O 3.58Å; G211-D230 WeakPolarHBondContact CA-O 3.45Å; G212-D230 PolarHBondContact N-O 2.87Å; G212-D230 PolarHBondContact O-N 2.67Å
231	G	86	Confident	90.5	Very high	60 Å²	60	72.8 Å²	72.8	62%	0.619	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	79.3	-160.6	178.6	0	0	0	0	0	115.8
232	E	84.7	Confident	90.5	Very high	122 Å²	122	70.2 Å²	70.2	57%	0.57	39%	0.394	S	S	*	.			trans	-106.8	116.2	-171	-168.5	-173.6	161.5	0	0	110.9	K209 R210 G211	K209-E232 HydrophobicContact CG-CG 4.37Å; R210-E232 CarbonylContact C-O 3.32Å; R210-E232 VanDerWaalsContact C-O 3.32Å; R210-E232 PolarHBondContact N-O 2.67Å; R210-E232 VanDerWaalsContact N-O 3.16Å; R210-E232 PolarHBondContact O-N 2.9Å; R210-E232 VanDerWaalsContact O-N 3.08Å; G211-E232 PolarHBondContact N-O 3.48Å
233	M	84	Confident	90.4	Very high	38 Å²	38	73.1 Å²	73.1	19%	0.187	40%	0.397	C	S	.	.			trans	-132.9	149.2	175.6	-57.3	-173	68.8	0	0	110.7	Q185 G211 T237 L238	Q185-M233 HydrophobicContact CB-CE 4.01Å; G211-M233 VanDerWaalsContact CA-CG 3.46Å; M233-T237 HydrophobicContact CE-CG2 4.09Å; M233-L238 HydrophobicContact SD-CD1 4.2Å
234	A	88	Confident	90.2	Very high	30 Å²	30	68.7 Å²	68.7	25%	0.248	38%	0.377	C	S	.	.			trans	-79.2	151.8	167	0	0	0	0	0	110.3	E236 T237 L238	A234-E236 VanDerWaalsContact C-N 3.32Å; A234-E236 PolarHBondContact O-N 3.46Å; A234-T237 PolarHBondContact O-N 2.8Å; A234-T237 VanDerWaalsContact O-N 3.14Å; A234-L238 WeakPolarHBondContact O-CB 3.31Å; A234-L238 PolarHBondContact O-N 2.85Å
235	E	89.4	Confident	90.1	Very high	161 Å²	161	65.9 Å²	65.9	75%	0.752	36%	0.36	S	S	*	.	H	α-helix	trans	-57.2	-42.8	-179.4	-175.8	-178.2	171.1	0	0	112.8	T237 L238 T239	E235-T237 VanDerWaalsContact C-N 3.34Å; E235-T237 PolarHBondContact O-N 2.94Å; E235-L238 PolarHBondContact O-N 2.78Å; E235-T239 PolarHBondContact O-N 2.75Å; E235-T239 PolarHBondContact O-OG1 3.23Å
236	E	89	Confident	90	Very high	171 Å²	171	66.3 Å²	66.3	80%	0.799	36%	0.361	S	S	*	.	H	α-helix	trans	-60.8	-44.9	177.4	-63.4	177.7	179.8	0	0	111.3	A234 T239 A240	A234-E236 VanDerWaalsContact C-N 3.32Å; A234-E236 PolarHBondContact O-N 3.46Å; E236-T239 PolarHBondContact O-N 2.99Å; E236-A240 WeakPolarHBondContact O-CB 3.4Å; E236-A240 PolarHBondContact O-N 3.05Å
237	T	86.5	Confident	90	Very high	43 Å²	43	70.7 Å²	70.7	26%	0.264	38%	0.377	S	S	.	.	H	α-helix	trans	-69.4	-36.3	178.6	-45	0	0	0	0	111.9	Q185 M233 A234 E235 G241	Q185-T237 HydrophobicContact CG-CG2 4.39Å; M233-T237 HydrophobicContact CE-CG2 4.09Å; A234-T237 PolarHBondContact O-N 2.8Å; A234-T237 VanDerWaalsContact O-N 3.14Å; E235-T237 VanDerWaalsContact C-N 3.34Å; E235-T237 PolarHBondContact O-N 2.94Å; T237-G241 PolarHBondContact O-N 2.93Å
238	L	89.7	Confident	89.8	Confident	46 Å²	46	66.8 Å²	66.8	24%	0.241	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-46.6	175.5	-178	65.5	0	0	0	110.8	L213 M233 A234 E235 A240 G241 I242	L213-L238 HydrophobicContact CD1-CD1 3.55Å; L213-L238 HydrophobicContact CD2-CD1 4.26Å; L213-L238 HydrophobicContact CG-CD1 4.44Å; M233-L238 HydrophobicContact SD-CD1 4.2Å; A234-L238 WeakPolarHBondContact O-CB 3.31Å; A234-L238 PolarHBondContact O-N 2.85Å; E235-L238 PolarHBondContact O-N 2.78Å; L238-A240 PolarHBondContact O-N 2.79Å; L238-G241 PolarHBondContact O-N 3.28Å; L238-I242 HydrophobicContact CG-CD1 4.29Å; L238-I242 WeakPolarHBondContact O-CG1 3.46Å; L238-I242 PolarHBondContact O-N 2.79Å
239	T	91.9	Very high	89.8	Confident	57 Å²	57	62.8 Å²	62.8	35%	0.35	34%	0.338	S	S	.	.	H	α-helix	trans	-63.4	-43.3	178.9	-55.5	0	0	0	0	111.6	E235 E236 G241 I242 R243	E235-T239 PolarHBondContact O-N 2.75Å; E235-T239 PolarHBondContact O-OG1 3.23Å; E236-T239 PolarHBondContact O-N 2.99Å; T239-G241 VanDerWaalsContact C-N 3.34Å; T239-I242 PolarHBondContact O-N 2.86Å; T239-R243 WeakPolarHBondContact O-CG 3.46Å; T239-R243 PolarHBondContact O-N 3.44Å
240	A	90.1	Very high	89.9	Confident	42 Å²	42	64.4 Å²	64.4	35%	0.347	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-43.9	173	0	0	0	0	0	111.3	E236 L238 I242 R243 T244	E236-A240 WeakPolarHBondContact O-CB 3.4Å; E236-A240 PolarHBondContact O-N 3.05Å; L238-A240 PolarHBondContact O-N 2.79Å; A240-I242 PolarHBondContact O-N 3.01Å; A240-R243 PolarHBondContact O-N 3.17Å; A240-T244 WeakPolarHBondContact O-CG2 3.49Å; A240-T244 PolarHBondContact O-N 2.81Å; A240-T244 PolarHBondContact O-OG1 3.42Å
241	G	89.6	Confident	90	Very high	2 Å²	2	64 Å²	64	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-57.5	-47.2	176.9	0	0	0	0	0	112.6	T237 L238 T239 R243 T244 C245	T237-G241 PolarHBondContact O-N 2.93Å; L238-G241 PolarHBondContact O-N 3.28Å; T239-G241 VanDerWaalsContact C-N 3.34Å; G241-R243 VanDerWaalsContact C-N 3.34Å; G241-R243 PolarHBondContact O-N 2.95Å; G241-T244 WeakPolarHBondContact CA-OG1 3.36Å; G241-T244 PolarHBondContact O-N 3.49Å; G241-T244 PolarHBondContact O-OG1 3.11Å; G241-C245 PolarHBondContact O-N 2.97Å; G241-C245 PolarHBondContact O-SG 3.38Å; G241-C245 VanDerWaalsContact O-SG 3.39Å
242	I	92.6	Very high	90.2	Very high	39 Å²	39	61.9 Å²	61.9	20%	0.2	30%	0.301	C	S	.	.	H	α-helix	trans	-58.8	-45.5	177.1	-67	168.2	0	0	0	110.9	L213 V215 L227 L238 T239 A240 T244 C245 I246	L213-I242 HydrophobicContact CD2-CG1 3.75Å; V215-I242 HydrophobicContact CG2-CG1 4.46Å; L227-I242 HydrophobicContact CD1-CD1 4.2Å; L227-I242 HydrophobicContact CD1-CG1 4.07Å; L227-I242 HydrophobicContact CD2-CD1 4.01Å; L238-I242 HydrophobicContact CG-CD1 4.29Å; L238-I242 WeakPolarHBondContact O-CG1 3.46Å; L238-I242 PolarHBondContact O-N 2.79Å; T239-I242 PolarHBondContact O-N 2.86Å; A240-I242 PolarHBondContact O-N 3.01Å; I242-T244 PolarHBondContact O-N 2.93Å; I242-C245 WeakPolarHBondContact O-CB 3.44Å; I242-C245 PolarHBondContact O-N 3.19Å; I242-I246 HydrophobicContact CG2-CD1 3.88Å; I242-I246 HydrophobicContact CG2-CG1 4.49Å; I242-I246 VanDerWaalsContact O-CG1 3.31Å; I242-I246 WeakPolarHBondContact O-CG1 3.49Å; I242-I246 PolarHBondContact O-N 3.37Å
243	R	92.7	Very high	90.6	Very high	167 Å²	167	58.7 Å²	58.7	63%	0.63	28%	0.284	S	S	*	.	H	α-helix	trans	-60.4	-44.5	177.9	-68.5	173.7	-176.8	173.8	2.3	111.8	T239 A240 G241 C245 I246 E247	T239-R243 WeakPolarHBondContact O-CG 3.46Å; T239-R243 PolarHBondContact O-N 3.44Å; A240-R243 PolarHBondContact O-N 3.17Å; G241-R243 VanDerWaalsContact C-N 3.34Å; G241-R243 PolarHBondContact O-N 2.95Å; R243-C245 VanDerWaalsContact C-N 3.35Å; R243-C245 PolarHBondContact O-N 3.29Å; R243-I246 WeakPolarHBondContact O-CB 3.36Å; R243-I246 PolarHBondContact O-N 2.8Å; R243-E247 PolarHBondContact O-N 3.18Å
244	T	91.4	Very high	91.1	Very high	12 Å²	12	59.6 Å²	59.6	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-34.1	177.8	57.4	0	0	0	0	113	L183 Y190 A240 G241 I242 E247 G248	L183-T244 WeakPolarHBondContact CD1-OG1 3.45Å; Y190-T244 HydrophobicContact CD2-CG2 4.34Å; Y190-T244 HydrophobicContact CE2-CG2 3.69Å; A240-T244 WeakPolarHBondContact O-CG2 3.49Å; A240-T244 PolarHBondContact O-N 2.81Å; A240-T244 PolarHBondContact O-OG1 3.42Å; G241-T244 WeakPolarHBondContact CA-OG1 3.36Å; G241-T244 PolarHBondContact O-N 3.49Å; G241-T244 PolarHBondContact O-OG1 3.11Å; I242-T244 PolarHBondContact O-N 2.93Å; T244-E247 PolarHBondContact O-N 3.31Å; T244-G248 PolarHBondContact O-N 3.45Å
245	C	91.4	Very high	91.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-40.8	171.9	-73	0	0	0	0	111.8	C181 L183 V215 G241 I242 R243 G248 C249	C181-C245 HydrophobicContact CB-CB 4.18Å; L183-C245 VanDerWaalsContact CB-SG 3.5Å; V215-C245 HydrophobicContact CB-CB 3.92Å; V215-C245 HydrophobicContact CG2-CB 3.6Å; G241-C245 PolarHBondContact O-N 2.97Å; G241-C245 PolarHBondContact O-SG 3.38Å; G241-C245 VanDerWaalsContact O-SG 3.39Å; I242-C245 WeakPolarHBondContact O-CB 3.44Å; I242-C245 PolarHBondContact O-N 3.19Å; R243-C245 VanDerWaalsContact C-N 3.35Å; R243-C245 PolarHBondContact O-N 3.29Å; C245-G248 WeakPolarHBondContact O-CA 3.38Å; C245-G248 PolarHBondContact O-N 2.71Å; C245-G248 VanDerWaalsContact O-N 3.13Å; C245-C249 PolarHBondContact O-N 3.08Å; C245-C249 PolarHBondContact O-SG 2.79Å; C245-C249 VanDerWaalsContact O-SG 3.4Å
246	I	93.6	Very high	91.5	Very high	32 Å²	32	53.4 Å²	53.4	16%	0.164	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-45.3	176	-70.1	165.5	0	0	0	110.3	F217 I242 R243 G248 C249 Y250	F217-I246 HydrophobicContact CD2-CG1 4.1Å; F217-I246 HydrophobicContact CE1-CG2 3.95Å; F217-I246 HydrophobicContact CE2-CD1 4.46Å; F217-I246 HydrophobicContact CE2-CG1 4.17Å; F217-I246 HydrophobicContact CE2-CG2 4.14Å; F217-I246 HydrophobicContact CG-CG1 4.45Å; F217-I246 HydrophobicContact CZ-CG2 3.74Å; I242-I246 HydrophobicContact CG2-CD1 3.88Å; I242-I246 HydrophobicContact CG2-CG1 4.49Å; I242-I246 VanDerWaalsContact O-CG1 3.31Å; I242-I246 WeakPolarHBondContact O-CG1 3.49Å; I242-I246 PolarHBondContact O-N 3.37Å; R243-I246 WeakPolarHBondContact O-CB 3.36Å; R243-I246 PolarHBondContact O-N 2.8Å; I246-G248 VanDerWaalsContact C-N 3.27Å; I246-G248 PolarHBondContact O-N 2.82Å; I246-C249 WeakPolarHBondContact O-CB 3.28Å; I246-C249 PolarHBondContact O-N 2.88Å; I246-Y250 HydrophobicContact CG2-CD2 3.84Å; I246-Y250 HydrophobicContact CG2-CE2 3.46Å; I246-Y250 VanDerWaalsContact CG2-CE2 3.46Å; I246-Y250 WeakPolarHBondContact O-CD2 3.36Å; I246-Y250 PolarHBondContact O-N 3.19Å
247	E	92.3	Very high	91.7	Very high	106 Å²	106	49.6 Å²	49.6	50%	0.495	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-38.5	173.1	-70.1	177.1	-169.7	0	0	112.2	V43 R243 T244 Y250 K251	V43-E247 HydrophobicContact CG1-CB 4.39Å; V43-E247 HydrophobicContact CG2-CB 4.16Å; R243-E247 PolarHBondContact O-N 3.18Å; T244-E247 PolarHBondContact O-N 3.31Å; E247-Y250 PolarHBondContact O-N 3.15Å; E247-K251 PolarHBondContact O-N 2.93Å
248	G	90.8	Very high	92.1	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-44.7	173.8	0	0	0	0	0	112.9	T244 C245 I246 Y250 K251 L252	T244-G248 PolarHBondContact O-N 3.45Å; C245-G248 WeakPolarHBondContact O-CA 3.38Å; C245-G248 PolarHBondContact O-N 2.71Å; C245-G248 VanDerWaalsContact O-N 3.13Å; I246-G248 VanDerWaalsContact C-N 3.27Å; I246-G248 PolarHBondContact O-N 2.82Å; G248-Y250 VanDerWaalsContact C-N 3.35Å; G248-Y250 PolarHBondContact O-N 2.93Å; G248-K251 PolarHBondContact O-N 2.94Å; G248-L252 PolarHBondContact O-N 3.3Å; G248-L252 VanDerWaalsContact O-N 3.17Å
249	C	92.4	Very high	92.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-42.4	175.2	-69.2	0	0	0	0	111.8	L179 C181 F217 C245 I246 K251 L252 Y253	L179-C249 HydrophobicContact CB-CB 3.95Å; L179-C249 HydrophobicContact CD1-CB 4.14Å; L179-C249 WeakPolarHBondContact CD1-O 3.41Å; C181-C249 WeakPolarHBondContact CB-SG 3.27Å; F217-C249 HydrophobicContact CB-CB 4.38Å; F217-C249 HydrophobicContact CD1-CB 3.79Å; C245-C249 PolarHBondContact O-N 3.08Å; C245-C249 PolarHBondContact O-SG 2.79Å; C245-C249 VanDerWaalsContact O-SG 3.4Å; I246-C249 WeakPolarHBondContact O-CB 3.28Å; I246-C249 PolarHBondContact O-N 2.88Å; C249-K251 VanDerWaalsContact C-N 3.26Å; C249-K251 PolarHBondContact O-N 3.02Å; C249-L252 PolarHBondContact O-N 3.21Å; C249-L252 VanDerWaalsContact O-N 3.1Å; C249-Y253 PolarHBondContact O-N 2.74Å
250	Y	92.8	Very high	92.3	Very high	104 Å²	104	51 Å²	51	41%	0.408	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-34.3	176.7	-79	-62	0	0	0	113	F217 P219 N222 I246 E247 G248 P254	F217-Y250 HydrophobicContact CE1-CD2 4.45Å; F217-Y250 HydrophobicContact CE1-CE1 4.21Å; F217-Y250 AromaticContact CE1-CE2 3.91Å; F217-Y250 HydrophobicContact CE1-CE2 3.91Å; F217-Y250 AromaticContact CE1-CZ 3.77Å; F217-Y250 HydrophobicContact CZ-CE2 4.05Å; F217-Y250 AromaticContact CZ-CZ 3.87Å; P219-Y250 HydrophobicContact CB-CD1 4.34Å; P219-Y250 HydrophobicContact CB-CE1 4.09Å; N222-Y250 PolarHBondContact OD1-OH 3.35Å; I246-Y250 HydrophobicContact CG2-CD2 3.84Å; I246-Y250 HydrophobicContact CG2-CE2 3.46Å; I246-Y250 VanDerWaalsContact CG2-CE2 3.46Å; I246-Y250 WeakPolarHBondContact O-CD2 3.36Å; I246-Y250 PolarHBondContact O-N 3.19Å; E247-Y250 PolarHBondContact O-N 3.15Å; G248-Y250 VanDerWaalsContact C-N 3.35Å; G248-Y250 PolarHBondContact O-N 2.93Å; Y250-P254 VanDerWaalsContact O-CD 3.28Å; Y250-P254 WeakPolarHBondContact O-CD 3.38Å
251	K	90.8	Very high	92.5	Very high	111 Å²	111	52.6 Å²	52.6	48%	0.483	25%	0.248	S	C	.	.	H	α-helix	trans	-69.9	-33.6	174.7	-67.6	-176.3	-174.2	-168.9	0	113	V43 E247 G248 C249 P254	V43-K251 HydrophobicContact CB-CD 4.42Å; V43-K251 HydrophobicContact CG1-CD 3.95Å; V43-K251 PolarHBondContact O-NZ 3.14Å; E247-K251 PolarHBondContact O-N 2.93Å; G248-K251 PolarHBondContact O-N 2.94Å; C249-K251 VanDerWaalsContact C-N 3.26Å; C249-K251 PolarHBondContact O-N 3.02Å; K251-P254 WeakPolarHBondContact O-CD 3.41Å; K251-P254 WeakPolarHBondContact O-CG 2.94Å
252	L	91.2	Very high	92.6	Very high	16 Å²	16	58.2 Å²	58.2	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-75.9	-31.8	178.3	-78.8	173.4	0	0	0	113.4	V45 V48 L179 G248 C249 V255 I256	V45-L252 HydrophobicContact CG1-CD1 4.09Å; V45-L252 HydrophobicContact CG1-CD2 3.71Å; V45-L252 HydrophobicContact CG1-CG 3.98Å; V45-L252 HydrophobicContact CG2-CG 4.5Å; V48-L252 HydrophobicContact CB-CD2 4.37Å; V48-L252 HydrophobicContact CG2-CD2 3.61Å; L179-L252 HydrophobicContact CD1-CB 4.48Å; G248-L252 PolarHBondContact O-N 3.3Å; G248-L252 VanDerWaalsContact O-N 3.17Å; C249-L252 PolarHBondContact O-N 3.21Å; C249-L252 VanDerWaalsContact O-N 3.1Å; L252-V255 PolarHBondContact O-N 3.28Å; L252-V255 VanDerWaalsContact O-N 3.16Å; L252-I256 HydrophobicContact CB-CD1 4.34Å; L252-I256 PolarHBondContact O-N 2.88Å
253	Y	93	Very high	92.5	Very high	56 Å²	56	57.1 Å²	57.1	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-49.1	-50	-176.8	-171.2	-114.4	0	0	0	115.6	L177 L179 P219 S220 C249 V255 I256 Q257	L177-Y253 HydrophobicContact CD1-CE2 4.33Å; L179-Y253 HydrophobicContact CD1-CD2 3.94Å; L179-Y253 HydrophobicContact CD1-CG 4.33Å; P219-Y253 HydrophobicContact CB-CD2 4.08Å; P219-Y253 HydrophobicContact CB-CE2 4.32Å; P219-Y253 HydrophobicContact CB-CG 4.36Å; P219-Y253 HydrophobicContact CG-CD2 3.32Å; P219-Y253 HydrophobicContact CG-CE2 3.39Å; P219-Y253 HydrophobicContact CG-CG 4.07Å; S220-Y253 PolarHBondContact OG-OH 2.96Å; C249-Y253 PolarHBondContact O-N 2.74Å; Y253-V255 VanDerWaalsContact C-N 3.32Å; Y253-V255 PolarHBondContact O-N 2.83Å; Y253-I256 PolarHBondContact O-N 3.46Å; Y253-Q257 PolarHBondContact O-N 2.87Å
254	P	93.5	Very high	92.4	Very high	57 Å²	57	53.9 Å²	53.9	37%	0.37	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-34.6	-178.5	23.6	-34.9	0	0	0	113.3	Y250 K251 I256 Q257 Q258	Y250-P254 VanDerWaalsContact O-CD 3.28Å; Y250-P254 WeakPolarHBondContact O-CD 3.38Å; K251-P254 WeakPolarHBondContact O-CD 3.41Å; K251-P254 WeakPolarHBondContact O-CG 2.94Å; P254-I256 VanDerWaalsContact C-N 3.32Å; P254-I256 PolarHBondContact O-N 3.14Å; P254-Q257 PolarHBondContact O-N 3.36Å; P254-Q258 WeakPolarHBondContact O-CB 3.48Å; P254-Q258 VanDerWaalsContact O-CG 3.25Å; P254-Q258 WeakPolarHBondContact O-CG 3.48Å; P254-Q258 PolarHBondContact O-N 3.29Å
255	V	92.6	Very high	92.3	Very high	57 Å²	57	62.7 Å²	62.7	35%	0.345	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-42.9	178.5	179.4	0	0	0	0	110.1	L252 Y253 Q258 A259	L252-V255 PolarHBondContact O-N 3.28Å; L252-V255 VanDerWaalsContact O-N 3.16Å; Y253-V255 VanDerWaalsContact C-N 3.32Å; Y253-V255 PolarHBondContact O-N 2.83Å; V255-Q258 PolarHBondContact O-N 2.86Å; V255-A259 WeakPolarHBondContact O-CB 3.21Å; V255-A259 PolarHBondContact O-N 2.94Å
256	I	93.6	Very high	92.1	Very high	3 Å²	3	69.7 Å²	69.7	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-69.5	-43.2	-179.4	-70.2	163.8	0	0	0	111.1	T161 M165 L177 L179 L252 Y253 P254 Q258 A259 L260	T161-I256 HydrophobicContact CG2-CD1 3.31Å; T161-I256 HydrophobicContact CG2-CG1 4.26Å; M165-I256 HydrophobicContact CE-CG2 4Å; M165-I256 HydrophobicContact CG-CG2 3.76Å; M165-I256 HydrophobicContact SD-CB 4.14Å; M165-I256 HydrophobicContact SD-CG1 3.85Å; M165-I256 HydrophobicContact SD-CG2 3.53Å; M165-I256 VanDerWaalsContact SD-CG2 3.53Å; L177-I256 HydrophobicContact CD1-CG2 4.1Å; L179-I256 HydrophobicContact CD2-CD1 3.17Å; L179-I256 HydrophobicContact CD2-CG1 4.48Å; L179-I256 HydrophobicContact CG-CD1 4.46Å; L252-I256 HydrophobicContact CB-CD1 4.34Å; L252-I256 PolarHBondContact O-N 2.88Å; Y253-I256 PolarHBondContact O-N 3.46Å; P254-I256 VanDerWaalsContact C-N 3.32Å; P254-I256 PolarHBondContact O-N 3.14Å; I256-Q258 VanDerWaalsContact C-N 3.33Å; I256-Q258 PolarHBondContact O-N 3.35Å; I256-A259 WeakPolarHBondContact O-CB 3.4Å; I256-A259 PolarHBondContact O-N 3.41Å; I256-L260 HydrophobicContact CG2-CD1 4.28Å; I256-L260 PolarHBondContact O-N 3.3Å
257	Q	93.3	Very high	91.5	Very high	91 Å²	91	72.3 Å²	72.3	43%	0.425	35%	0.352	S	S	.	.	H	α-helix	trans	-60.5	-44	176	-168.2	-177.8	12.2	0	0	111.3	Y253 P254 A259 L260 I261	Y253-Q257 PolarHBondContact O-N 2.87Å; P254-Q257 PolarHBondContact O-N 3.36Å; Q257-A259 VanDerWaalsContact C-N 3.34Å; Q257-A259 PolarHBondContact O-N 2.86Å; Q257-L260 PolarHBondContact O-N 3.31Å; Q257-I261 HydrophobicContact CG-CD1 4.09Å; Q257-I261 VanDerWaalsContact O-CG1 3.27Å; Q257-I261 WeakPolarHBondContact O-CG1 3.48Å; Q257-I261 PolarHBondContact O-N 3.44Å
258	Q	94.3	Very high	91.1	Very high	135 Å²	135	69.7 Å²	69.7	63%	0.631	35%	0.348	S	S	*	.	H	α-helix	trans	-62.5	-40.2	175.5	-73.7	177	7.3	0	0	112.3	P254 V255 I256 I261 K262	P254-Q258 WeakPolarHBondContact O-CB 3.48Å; P254-Q258 VanDerWaalsContact O-CG 3.25Å; P254-Q258 WeakPolarHBondContact O-CG 3.48Å; P254-Q258 PolarHBondContact O-N 3.29Å; V255-Q258 PolarHBondContact O-N 2.86Å; I256-Q258 VanDerWaalsContact C-N 3.33Å; I256-Q258 PolarHBondContact O-N 3.35Å; Q258-I261 PolarHBondContact O-N 3.26Å; Q258-K262 VanDerWaalsContact O-CB 3.31Å; Q258-K262 WeakPolarHBondContact O-CB 3.03Å; Q258-K262 PolarHBondContact O-N 3.29Å
259	A	93.3	Very high	90.4	Very high	14 Å²	14	75 Å²	75	12%	0.116	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-42.6	176.9	0	0	0	0	0	112.1	V50 M165 V255 I256 Q257 K262 A263	V50-A259 HydrophobicContact CB-CB 4.12Å; M165-A259 HydrophobicContact CE-CB 3.82Å; V255-A259 WeakPolarHBondContact O-CB 3.21Å; V255-A259 PolarHBondContact O-N 2.94Å; I256-A259 WeakPolarHBondContact O-CB 3.4Å; I256-A259 PolarHBondContact O-N 3.41Å; Q257-A259 VanDerWaalsContact C-N 3.34Å; Q257-A259 PolarHBondContact O-N 2.86Å; A259-K262 PolarHBondContact O-N 3.18Å; A259-A263 PolarHBondContact O-N 3.07Å
260	L	92.4	Very high	89.6	Confident	27 Å²	27	80.4 Å²	80.4	14%	0.141	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-47.5	175.1	-74.9	167.8	0	0	0	111.9	M165 A168 L177 I256 Q257 K262 A263 V264	M165-L260 HydrophobicContact CE-CG 4.27Å; A168-L260 HydrophobicContact CB-CD1 4.35Å; A168-L260 HydrophobicContact CB-CD2 3.83Å; L177-L260 HydrophobicContact CD1-CD1 3.53Å; L177-L260 HydrophobicContact CD2-CD1 3.94Å; L177-L260 HydrophobicContact CG-CD1 4.39Å; I256-L260 HydrophobicContact CG2-CD1 4.28Å; I256-L260 PolarHBondContact O-N 3.3Å; Q257-L260 PolarHBondContact O-N 3.31Å; L260-K262 PolarHBondContact O-N 3.06Å; L260-A263 WeakPolarHBondContact O-CB 3.38Å; L260-A263 PolarHBondContact O-N 3.43Å; L260-V264 WeakPolarHBondContact O-CG2 3.48Å; L260-V264 PolarHBondContact O-N 3.05Å
261	I	94.1	Very high	88.8	Confident	76 Å²	76	81.1 Å²	81.1	39%	0.39	44%	0.436	S	S	.	.	H	α-helix	trans	-57	-41.8	176.3	-69.2	165.7	0	0	0	110.5	Q257 Q258 V264 R265	Q257-I261 HydrophobicContact CG-CD1 4.09Å; Q257-I261 VanDerWaalsContact O-CG1 3.27Å; Q257-I261 WeakPolarHBondContact O-CG1 3.48Å; Q257-I261 PolarHBondContact O-N 3.44Å; Q258-I261 PolarHBondContact O-N 3.26Å; I261-V264 PolarHBondContact O-N 2.95Å; I261-R265 HydrophobicContact CG2-CG 4.44Å; I261-R265 WeakPolarHBondContact O-CB 3.38Å; I261-R265 VanDerWaalsContact O-CG 3.3Å; I261-R265 WeakPolarHBondContact O-CG 3.31Å; I261-R265 PolarHBondContact O-N 3.02Å
262	K	92.4	Very high	87.7	Confident	120 Å²	120	80.5 Å²	80.5	52%	0.522	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-37	178	-171.4	175	-175.6	175.5	0	112.3	Q258 A259 L260 R266	Q258-K262 VanDerWaalsContact O-CB 3.31Å; Q258-K262 WeakPolarHBondContact O-CB 3.03Å; Q258-K262 PolarHBondContact O-N 3.29Å; A259-K262 PolarHBondContact O-N 3.18Å; L260-K262 PolarHBondContact O-N 3.06Å; K262-R266 VanDerWaalsContact O-CG 3.29Å; K262-R266 WeakPolarHBondContact O-CG 3.33Å; K262-R266 PolarHBondContact O-N 2.81Å
263	A	90.1	Very high	86.5	Confident	15 Å²	15	89.3 Å²	89.3	12%	0.124	49%	0.492	C	S	.	.	H	α-helix	trans	-65.8	-47.9	175.1	0	0	0	0	0	111.3	C52 A259 L260 R265 R266 A267	C52-A263 HydrophobicContact CB-CB 3.74Å; A259-A263 PolarHBondContact O-N 3.07Å; L260-A263 WeakPolarHBondContact O-CB 3.38Å; L260-A263 PolarHBondContact O-N 3.43Å; A263-R265 VanDerWaalsContact C-N 3.35Å; A263-R265 PolarHBondContact O-N 3.21Å; A263-R266 WeakPolarHBondContact O-CB 3.48Å; A263-R266 PolarHBondContact O-N 2.84Å; A263-R266 VanDerWaalsContact O-N 3.08Å; A263-A267 PolarHBondContact O-N 2.77Å
264	V	90.3	Very high	84.7	Confident	100 Å²	100	95.6 Å²	95.6	61%	0.606	54%	0.544	S	S	*	.	H	α-helix	trans	-59.7	-44.4	176.9	175.2	0	0	0	0	111.2	L260 I261 R266 A267 A268	L260-V264 WeakPolarHBondContact O-CG2 3.48Å; L260-V264 PolarHBondContact O-N 3.05Å; I261-V264 PolarHBondContact O-N 2.95Å; V264-R266 PolarHBondContact O-N 3.36Å; V264-A267 PolarHBondContact O-N 3.08Å; V264-A267 VanDerWaalsContact O-N 3.17Å; V264-A268 PolarHBondContact O-N 3.16Å
265	R	90.6	Very high	84.3	Confident	196 Å²	196	97.6 Å²	97.6	74%	0.74	55%	0.553	S	S	*	*	H	α-helix	trans	-62	-29.5	176.6	-75.9	178.3	-178.4	-179.1	1.9	113.8	I261 A263	I261-R265 HydrophobicContact CG2-CG 4.44Å; I261-R265 WeakPolarHBondContact O-CB 3.38Å; I261-R265 VanDerWaalsContact O-CG 3.3Å; I261-R265 WeakPolarHBondContact O-CG 3.31Å; I261-R265 PolarHBondContact O-N 3.02Å; A263-R265 VanDerWaalsContact C-N 3.35Å; A263-R265 PolarHBondContact O-N 3.21Å
266	R	86.3	Confident	83.8	Confident	147 Å²	147	99.7 Å²	99.7	56%	0.555	56%	0.564	S	S	*	*	H	α-helix	trans	-78	-33.4	175.9	-75.1	169.6	172.1	-179.1	-5.4	112.4	K262 A263 V264	K262-R266 VanDerWaalsContact O-CG 3.29Å; K262-R266 WeakPolarHBondContact O-CG 3.33Å; K262-R266 PolarHBondContact O-N 2.81Å; A263-R266 WeakPolarHBondContact O-CB 3.48Å; A263-R266 PolarHBondContact O-N 2.84Å; A263-R266 VanDerWaalsContact O-N 3.08Å; V264-R266 PolarHBondContact O-N 3.36Å
267	A	82.2	Confident	83.3	Confident	87 Å²	87	105.1 Å²	105.1	72%	0.719	59%	0.594	S	S	*	*	H	α-helix	trans	-77.4	-24.8	176.3	0	0	0	0	0	112.3	A263 V264	A263-A267 PolarHBondContact O-N 2.77Å; V264-A267 PolarHBondContact O-N 3.08Å; V264-A267 VanDerWaalsContact O-N 3.17Å
268	A	83.4	Confident	82.7	Confident	51 Å²	51	105.9 Å²	105.9	42%	0.421	60%	0.604	S	S	.	*	S	Bend	trans	-63.1	135	176.9	0	0	0	0	0	111	V264	V264-A268 PolarHBondContact O-N 3.16Å
269	P	75.3	Confident	82	Confident	111 Å²	111	104.1 Å²	104.1	72%	0.721	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-61.3	151.3	173.1	26.1	-32.6	0	0	0	110.2
270	P	75.8	Confident	81.2	Confident	114 Å²	114	110.1 Å²	110.1	74%	0.74	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-56.2	142.7	173.5	24.8	-32.8	0	0	0	109.4	A272	P270-A272 PolarHBondContact O-N 3.05Å
271	P	75.7	Confident	80.4	Confident	120 Å²	120	116 Å²	116	78%	0.779	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-56.4	132.4	176	24.5	-32.2	0	0	0	108.6	E273	P271-E273 PolarHBondContact O-N 2.92Å; P271-E273 VanDerWaalsContact O-N 3.16Å
272	A	67.6	Low	79.4	Confident	98 Å²	98	119.1 Å²	119.1	81%	0.81	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-58.3	121	175.5	0	0	0	0	0	108.3	P270 S274	P270-A272 PolarHBondContact O-N 3.05Å; A272-S274 PolarHBondContact O-N 2.8Å; A272-S274 VanDerWaalsContact O-N 3.1Å
273	E	67.2	Low	78.3	Confident	201 Å²	201	119 Å²	119	94%	0.939	71%	0.706	S	S	*	*			trans	-59.2	114	173.3	-68.2	-179.4	163.9	0	0	108	P271	P271-E273 PolarHBondContact O-N 2.92Å; P271-E273 VanDerWaalsContact O-N 3.16Å
274	S	54.7	Low	77.2	Confident	188 Å²	188	128.5 Å²	128.5	100%	1.315	76%	0.759	S	S	*	*			trans	-86.5	0	174.5	61.4	0	0	0	0	111	A272	A272-S274 PolarHBondContact O-N 2.8Å; A272-S274 VanDerWaalsContact O-N 3.1Å

Retrieved 274 of 274 residues in 281.2 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).