A0A096N1E9_PAPAN Loading...

Methyltransferase like 24

AlphaFold DB , UniProt , Accession A0A096N1E9, Species PAPAN (Papio anubis, Olive baboon), Gene METTL24, Length 366 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	39.8	Very low	250 Å²	250	178.8 Å²	178.8	100%	1.232	89%	0.89	S	S	*	*				0	115.4	0	-68.8	-170.5	-148.6	0	0	108.5
2	A	39.8	Very low	40.5	Very low	100 Å²	100	167.4 Å²	167.4	83%	0.826	85%	0.852	S	S	*	*			trans	-75.7	151.4	179.1	0	0	0	0	0	111
3	R	35.7	Very low	40.9	Very low	251 Å²	251	162.5 Å²	162.5	95%	0.947	84%	0.835	S	S	*	*			trans	-131.6	105.3	163.7	-142.6	175.2	-173.3	-176.9	1.7	108.7
4	E	34.2	Very low	41.4	Very low	189 Å²	189	160.1 Å²	160.1	88%	0.883	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-66.1	146.8	-179.6	-68.7	175.5	140.3	0	0	112.1
5	R	41.1	Very low	41.9	Very low	238 Å²	238	162.7 Å²	162.7	90%	0.898	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-92.7	144.2	168.5	-71.9	179.6	175.3	179.7	-1.3	109.5
6	P	39.7	Very low	42.4	Very low	120 Å²	120	165.4 Å²	165.4	78%	0.779	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-80.5	157.2	178.9	33.9	-33	0	0	0	112
7	P	41.5	Very low	43.1	Very low	124 Å²	124	161.2 Å²	161.2	81%	0.805	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-82.1	140.7	-174.4	32.3	-32.7	0	0	0	112.6	R9	P7-R9 PolarHBondContact O-N 2.93Å
8	R	40.2	Very low	43.7	Very low	254 Å²	254	159.1 Å²	159.1	96%	0.958	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.8	117.9	168.2	-86	177.6	157.5	179.9	-5.7	110.1
9	R	40	Very low	44.2	Very low	252 Å²	252	157.1 Å²	157.1	95%	0.951	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-72.9	123.6	166.9	-88.3	-177.9	175.7	-170.6	-1.2	110.3	P7	P7-R9 PolarHBondContact O-N 2.93Å
10	G	38.7	Very low	44.9	Very low	65 Å²	65	150.9 Å²	150.9	67%	0.67	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-75.8	130.5	-179.8	0	0	0	0	0	113.8	G12	G10-G12 PolarHBondContact O-N 3.19Å; G10-G12 VanDerWaalsContact O-N 3.13Å
11	C	47.9	Very low	45.6	Very low	124 Å²	124	146.1 Å²	146.1	84%	0.838	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	52.1	171.5	-164.6	0	0	0	0	111
12	G	47.9	Very low	46.6	Very low	42 Å²	42	137.1 Å²	137.1	43%	0.433	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.9	-25.7	-176	0	0	0	0	0	114.6	G10	G10-G12 PolarHBondContact O-N 3.19Å; G10-G12 VanDerWaalsContact O-N 3.13Å
13	T	46.5	Very low	47.8	Very low	104 Å²	104	138.2 Å²	138.2	64%	0.638	71%	0.706	S	S	*	*	H	α-helix	trans	-86.5	-34.2	-173.8	32	0	0	0	0	113.2	R15 R16 C17	T13-R15 VanDerWaalsContact C-N 3.35Å; T13-R15 PolarHBondContact O-N 3.28Å; T13-R16 PolarHBondContact O-N 2.96Å; T13-C17 PolarHBondContact O-N 3.37Å; T13-C17 VanDerWaalsContact O-N 3.16Å; T13-C17 PolarHBondContact O-SG 3.42Å; T13-C17 VanDerWaalsContact O-SG 3.42Å
14	L	47.5	Very low	49.1	Very low	128 Å²	128	132 Å²	132	67%	0.67	69%	0.691	S	S	*	*	H	α-helix	trans	-64.2	-35.6	177.4	-90.6	148.1	0	0	0	113.2	L18	L14-L18 WeakPolarHBondContact O-CG 3.31Å; L14-L18 PolarHBondContact O-N 3.42Å
15	R	49.4	Very low	50.4	Low	200 Å²	200	128.6 Å²	128.6	76%	0.755	68%	0.678	S	S	*	*	H	α-helix	trans	-73.6	-30.8	-179.9	-153.3	174.5	-175	-171.4	0.5	112.5	T13 L19	T13-R15 VanDerWaalsContact C-N 3.35Å; T13-R15 PolarHBondContact O-N 3.28Å; R15-L19 WeakPolarHBondContact O-CD1 3.33Å; R15-L19 WeakPolarHBondContact O-CG 3.44Å; R15-L19 PolarHBondContact O-N 3.27Å
16	R	50.2	Low	51.4	Low	206 Å²	206	118.9 Å²	118.9	78%	0.777	65%	0.652	S	S	*	*	H	α-helix	trans	-76.1	-35.4	175.9	-72.9	-176	173.6	-179.3	-1.9	112.4	T13 G20	T13-R16 PolarHBondContact O-N 2.96Å; R16-G20 PolarHBondContact O-N 3.01Å
17	C	52.9	Low	52.6	Low	93 Å²	93	118.4 Å²	118.4	63%	0.628	64%	0.643	S	S	*	*	H	α-helix	trans	-68.2	-36.8	174.8	-66.7	0	0	0	0	112.8	T13 G20 A21	T13-C17 PolarHBondContact O-N 3.37Å; T13-C17 VanDerWaalsContact O-N 3.16Å; T13-C17 PolarHBondContact O-SG 3.42Å; T13-C17 VanDerWaalsContact O-SG 3.42Å; C17-G20 PolarHBondContact O-N 3.32Å; C17-A21 PolarHBondContact O-N 3.08Å
18	L	54.2	Low	53.3	Low	124 Å²	124	121.9 Å²	121.9	65%	0.649	64%	0.64	S	S	*	*	H	α-helix	trans	-70	-36.7	177	-70.9	169.2	0	0	0	112.7	L14 A22	L14-L18 WeakPolarHBondContact O-CG 3.31Å; L14-L18 PolarHBondContact O-N 3.42Å; L18-A22 PolarHBondContact O-N 3.43Å; L18-A22 VanDerWaalsContact O-N 3.16Å
19	L	54.6	Low	54	Low	120 Å²	120	115 Å²	115	63%	0.628	62%	0.621	S	S	*	*	H	α-helix	trans	-67.5	-38.2	173.1	-78.4	162.6	0	0	0	112	R15 L23	R15-L19 WeakPolarHBondContact O-CD1 3.33Å; R15-L19 WeakPolarHBondContact O-CG 3.44Å; R15-L19 PolarHBondContact O-N 3.27Å; L19-L23 PolarHBondContact O-N 3.1Å; L19-L23 VanDerWaalsContact O-N 3.15Å
20	G	57.7	Low	54.6	Low	34 Å²	34	106.5 Å²	106.5	35%	0.351	60%	0.599	S	S	.	*	H	α-helix	trans	-65	-39.6	175.3	0	0	0	0	0	113.4	R16 C17 L24	R16-G20 PolarHBondContact O-N 3.01Å; C17-G20 PolarHBondContact O-N 3.32Å; G20-L24 WeakPolarHBondContact O-CG 3.39Å; G20-L24 PolarHBondContact O-N 3.12Å
21	A	58.8	Low	55.3	Low	50 Å²	50	106 Å²	106	41%	0.413	59%	0.589	S	S	.	*	H	α-helix	trans	-68.5	-39.4	177.4	0	0	0	0	0	112.6	C17 L24 L25	C17-A21 PolarHBondContact O-N 3.08Å; A21-L24 PolarHBondContact O-N 3.35Å; A21-L25 PolarHBondContact O-N 3.44Å; A21-L25 VanDerWaalsContact O-N 3.07Å
22	A	60.7	Low	55.4	Low	62 Å²	62	104.8 Å²	104.8	51%	0.512	58%	0.575	S	S	.	*	H	α-helix	trans	-66.1	-37.3	176.6	0	0	0	0	0	112.5	L18 L25 G26	L18-A22 PolarHBondContact O-N 3.43Å; L18-A22 VanDerWaalsContact O-N 3.16Å; A22-L25 PolarHBondContact O-N 3.05Å; A22-G26 PolarHBondContact O-N 3.31Å
23	L	65.2	Low	55.4	Low	123 Å²	123	109.1 Å²	109.1	64%	0.644	59%	0.587	S	S	*	*	H	α-helix	trans	-67.4	-39.2	176.7	-136.8	93.2	0	0	0	112.1	L19 G26 L27	L19-L23 PolarHBondContact O-N 3.1Å; L19-L23 VanDerWaalsContact O-N 3.15Å; L23-G26 PolarHBondContact O-N 3.18Å; L23-L27 WeakPolarHBondContact O-CG 3.45Å; L23-L27 PolarHBondContact O-N 2.98Å
24	L	62.5	Low	55.4	Low	121 Å²	121	114.4 Å²	114.4	63%	0.634	60%	0.595	S	S	*	*	H	α-helix	trans	-69.6	-35	177.6	-75.3	166.2	0	0	0	112.7	G20 A21 R28	G20-L24 WeakPolarHBondContact O-CG 3.39Å; G20-L24 PolarHBondContact O-N 3.12Å; A21-L24 PolarHBondContact O-N 3.35Å; L24-R28 PolarHBondContact O-N 3.11Å; L24-R28 VanDerWaalsContact O-N 3.13Å
25	L	61.9	Low	55.1	Low	117 Å²	117	118.4 Å²	118.4	61%	0.613	60%	0.601	S	S	*	*	H	α-helix	trans	-67.6	-41.2	171.9	-92.3	145.9	0	0	0	111.9	A21 A22 R28 L29	A21-L25 PolarHBondContact O-N 3.44Å; A21-L25 VanDerWaalsContact O-N 3.07Å; A22-L25 PolarHBondContact O-N 3.05Å; L25-R28 PolarHBondContact O-N 2.99Å; L25-L29 WeakPolarHBondContact O-CD1 3.49Å; L25-L29 WeakPolarHBondContact O-CG 3.36Å; L25-L29 PolarHBondContact O-N 3.16Å; L25-L29 VanDerWaalsContact O-N 3.09Å
26	G	61.2	Low	54.8	Low	34 Å²	34	115.1 Å²	115.1	35%	0.351	60%	0.603	S	S	.	*	H	α-helix	trans	-63.7	-40.5	174.9	0	0	0	0	0	113.2	A22 L23 L29 C30	A22-G26 PolarHBondContact O-N 3.31Å; L23-G26 PolarHBondContact O-N 3.18Å; G26-L29 PolarHBondContact O-N 2.73Å; G26-C30 PolarHBondContact O-N 2.63Å; G26-C30 VanDerWaalsContact O-N 3.07Å; G26-C30 PolarHBondContact O-SG 2.81Å
27	L	64.3	Low	54.2	Low	110 Å²	110	108.7 Å²	108.7	58%	0.576	60%	0.601	S	S	*	*	H	α-helix	trans	-70.3	-34.2	178	-72.8	168.7	0	0	0	113	L23 A31	L23-L27 WeakPolarHBondContact O-CG 3.45Å; L23-L27 PolarHBondContact O-N 2.98Å; L27-A31 PolarHBondContact O-N 2.68Å; L27-A31 VanDerWaalsContact O-N 3.13Å
28	R	57.3	Low	53.6	Low	197 Å²	197	109.3 Å²	109.3	74%	0.743	61%	0.607	S	S	*	*	H	α-helix	trans	-67.4	-42.9	172.4	-87.2	-165	176.1	-143.5	2.4	112.5	L24 L25 C30 A31 D32	L24-R28 PolarHBondContact O-N 3.11Å; L24-R28 VanDerWaalsContact O-N 3.13Å; L25-R28 PolarHBondContact O-N 2.99Å; R28-C30 VanDerWaalsContact C-N 3.33Å; R28-C30 PolarHBondContact O-N 2.96Å; R28-A31 PolarHBondContact O-N 3.38Å; R28-D32 PolarHBondContact O-N 3.26Å
29	L	54.2	Low	52.4	Low	108 Å²	108	107.2 Å²	107.2	57%	0.565	62%	0.615	S	S	*	*	H	α-helix	trans	-63.1	-37.8	176.8	-78.4	159.3	0	0	0	112.3	L25 G26 L33	L25-L29 WeakPolarHBondContact O-CD1 3.49Å; L25-L29 WeakPolarHBondContact O-CG 3.36Å; L25-L29 PolarHBondContact O-N 3.16Å; L25-L29 VanDerWaalsContact O-N 3.09Å; G26-L29 PolarHBondContact O-N 2.73Å; L29-L33 WeakPolarHBondContact O-CG 3.41Å; L29-L33 PolarHBondContact O-N 3.29Å; L29-L33 VanDerWaalsContact O-N 3.13Å
30	C	54	Low	51.4	Low	74 Å²	74	107.3 Å²	107.3	50%	0.5	63%	0.625	S	S	.	*	H	α-helix	trans	-69.4	-30.8	174.4	-76.4	0	0	0	0	113.5	G26 R28 R34	G26-C30 PolarHBondContact O-N 2.63Å; G26-C30 VanDerWaalsContact O-N 3.07Å; G26-C30 PolarHBondContact O-SG 2.81Å; R28-C30 VanDerWaalsContact C-N 3.33Å; R28-C30 PolarHBondContact O-N 2.96Å; C30-R34 WeakPolarHBondContact O-CG 3.38Å; C30-R34 PolarHBondContact O-N 2.82Å
31	A	52.8	Low	50.6	Low	55 Å²	55	112 Å²	112	46%	0.455	65%	0.65	S	S	.	*	H	α-helix	trans	-74.9	-37.4	176.4	0	0	0	0	0	112.3	L27 R28 R34 R35	L27-A31 PolarHBondContact O-N 2.68Å; L27-A31 VanDerWaalsContact O-N 3.13Å; R28-A31 PolarHBondContact O-N 3.38Å; A31-R34 PolarHBondContact O-N 2.93Å; A31-R35 PolarHBondContact O-N 3Å
32	D	49.9	Very low	49.4	Very low	99 Å²	99	114.5 Å²	114.5	53%	0.529	67%	0.671	S	S	.	*	H	α-helix	trans	-71.1	-35	176.9	-75.2	-27.8	0	0	0	112.1	R28 R34 R35	R28-D32 PolarHBondContact O-N 3.26Å; D32-R34 VanDerWaalsContact C-N 3.3Å; D32-R34 PolarHBondContact O-N 3.16Å; D32-R35 PolarHBondContact O-N 3.35Å
33	L	48.4	Very low	48	Very low	132 Å²	132	123 Å²	123	69%	0.691	69%	0.689	S	S	*	*	H	α-helix	trans	-68.5	-26.7	173.7	-73.7	167.8	0	0	0	113.2	L29	L29-L33 WeakPolarHBondContact O-CG 3.41Å; L29-L33 PolarHBondContact O-N 3.29Å; L29-L33 VanDerWaalsContact O-N 3.13Å
34	R	45.5	Very low	46.6	Very low	215 Å²	215	122.8 Å²	122.8	81%	0.811	70%	0.698	S	S	*	*	H	α-helix	trans	-79.1	-18.8	174.6	-74.5	-178.4	-176.4	-148.7	1.4	113.6	C30 A31 D32	C30-R34 WeakPolarHBondContact O-CG 3.38Å; C30-R34 PolarHBondContact O-N 2.82Å; A31-R34 PolarHBondContact O-N 2.93Å; D32-R34 VanDerWaalsContact C-N 3.3Å; D32-R34 PolarHBondContact O-N 3.16Å
35	R	41.1	Very low	45	Very low	213 Å²	213	122.1 Å²	122.1	80%	0.804	71%	0.71	S	S	*	*	H	α-helix	trans	-79.9	-17.1	176.1	-97.6	-177.7	178.4	-176.9	-0.9	114.3	A31 D32	A31-R35 PolarHBondContact O-N 3Å; D32-R35 PolarHBondContact O-N 3.35Å
36	V	42.5	Very low	43.6	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	72%	0.722	S	S	*	*	S	Bend	trans	-87.5	-8.3	-179.8	179.9	0	0	0	0	112.2
37	G	39.5	Very low	42.8	Very low	71 Å²	71	128.8 Å²	128.8	73%	0.732	74%	0.744	S	S	*	*	S	Bend	trans	-108.1	27.9	-171.1	0	0	0	0	0	116.8
38	S	38.8	Very low	41.2	Very low	107 Å²	107	127 Å²	127	75%	0.748	75%	0.752	S	S	*	*			trans	-136.9	92.8	172.6	65.5	0	0	0	0	112.1
39	G	30.4	Very low	40.2	Very low	80 Å²	80	123.8 Å²	123.8	83%	0.825	76%	0.756	S	S	*	*			trans	-136	106.2	166.5	0	0	0	0	0	109.9
40	S	33.3	Very low	39.3	Very low	121 Å²	121	123.1 Å²	123.1	85%	0.846	77%	0.767	S	S	*	*			trans	-79.1	160.4	170.9	-71.4	0	0	0	0	111.1
41	P	40.7	Very low	38	Very low	133 Å²	133	131.2 Å²	131.2	86%	0.864	79%	0.787	S	S	*	*			trans	-86.5	143.2	-157.6	34.2	-32.7	0	0	0	112.8
42	A	32.8	Very low	36.9	Very low	103 Å²	103	139.7 Å²	139.7	85%	0.851	81%	0.807	S	S	*	*			trans	-117.4	140.5	172.6	0	0	0	0	0	111.8
43	R	31	Very low	36.6	Very low	241 Å²	241	140.3 Å²	140.3	91%	0.909	82%	0.817	S	S	*	*			trans	-67.6	155.5	-171.8	-78.6	166.2	149.9	179.1	-7.8	114.6
44	S	35.5	Very low	36	Very low	118 Å²	118	139.9 Å²	139.9	83%	0.825	82%	0.822	S	S	*	*			trans	-33.6	140	165.5	40.1	0	0	0	0	119.5
45	A	30.1	Very low	35.3	Very low	106 Å²	106	133 Å²	133	88%	0.876	82%	0.817	S	S	*	*			trans	-153.6	145.9	144.5	0	0	0	0	0	111.1
46	L	33.1	Very low	35.3	Very low	167 Å²	167	128.2 Å²	128.2	87%	0.874	81%	0.814	S	S	*	*			trans	-110.1	177.2	-173.5	-101.3	171.1	0	0	0	110.6
47	P	44.3	Very low	34.7	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	82%	0.821	S	S	*	*				-110.7	169.5	-110.7	29.9	-7.5	0	0	0	115.5
48	G	30.1	Very low	34.3	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	83%	0.825	S	S	*	*			trans	-143.7	159.4	173.6	0	0	0	0	0	112.7
49	P	36.4	Very low	33.9	Very low	130 Å²	130	138.8 Å²	138.8	84%	0.844	83%	0.827	S	S	*	*				-98.6	166	-129.4	35.7	-35.7	0	0	0	117
50	A	34.4	Very low	34.1	Very low	94 Å²	94	140.3 Å²	140.3	78%	0.777	82%	0.823	S	S	*	*			trans	-61.4	145.8	-174.5	0	0	0	0	0	115.9
51	W	27.1	Very low	34.1	Very low	244 Å²	244	139 Å²	139	92%	0.924	82%	0.82	S	S	*	*			trans	-136.5	130.9	156.5	-83	85.3	0	0	0	110.9
52	R	30.9	Very low	33.9	Very low	233 Å²	233	139 Å²	139	88%	0.879	82%	0.82	S	S	*	*			trans	-142.5	167.5	170.1	-100	-166.8	-173.8	-161.7	3.9	105.2
53	P	43.1	Very low	33.7	Very low	113 Å²	113	137.6 Å²	137.6	73%	0.734	82%	0.815	S	S	*	*			cis	-126.5	-147.6	-21.1	42.5	-21.9	0	0	0	108.2
54	P	35.3	Very low	33.7	Very low	123 Å²	123	132 Å²	132	80%	0.799	81%	0.813	S	S	*	*			cis	-135.7	164	37.5	35.1	-12.6	0	0	0	116.1
55	G	31.1	Very low	33.8	Very low	69 Å²	69	132.5 Å²	132.5	71%	0.711	81%	0.813	S	S	*	*			trans	-127.4	-171.3	149.7	0	0	0	0	0	108.1
56	P	40.9	Very low	33.8	Very low	113 Å²	113	139.4 Å²	139.4	73%	0.734	82%	0.817	S	S	*	*			cis	-120.4	161	-18.1	37.6	-23	0	0	0	112.1
57	H	30.7	Very low	33.7	Very low	204 Å²	204	135.3 Å²	135.3	94%	0.944	82%	0.815	S	S	*	*			trans	-128.1	132	162.8	-73.8	-58.4	0	0	0	110.6
58	L	30.7	Very low	33.1	Very low	155 Å²	155	134.3 Å²	134.3	81%	0.812	82%	0.817	S	S	*	*			trans	-117.2	136.9	-173.4	-108.9	163.8	0	0	0	110
59	Q	29.9	Very low	33.2	Very low	171 Å²	171	136.3 Å²	136.3	80%	0.799	82%	0.819	S	S	*	*			trans	81.9	155.9	157.2	-58.8	-149.5	23	0	0	120.1
60	P	34.6	Very low	33.2	Very low	112 Å²	112	141.7 Å²	141.7	73%	0.727	82%	0.823	S	S	*	*			cis	-128.2	174.4	4.2	28.5	-6	0	0	0	116.3
61	A	33.3	Very low	33.1	Very low	95 Å²	95	148.2 Å²	148.2	79%	0.785	83%	0.827	S	S	*	*			trans	-71.9	151.4	172.9	0	0	0	0	0	112.9
62	P	36	Very low	33.3	Very low	132 Å²	132	145.1 Å²	145.1	86%	0.857	82%	0.823	S	S	*	*				-154	161.8	105.4	36.2	-17.5	0	0	0	116.5
63	G	28.7	Very low	33.3	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	81%	0.812	S	S	*	*			trans	124.3	97.7	145.2	0	0	0	0	0	117.7
64	S	31	Very low	32.7	Very low	125 Å²	125	139 Å²	139	87%	0.874	81%	0.809	S	S	*	*			trans	-69.4	142.8	167.6	-48.8	0	0	0	0	112.9
65	P	37.9	Very low	32.3	Very low	127 Å²	127	143.3 Å²	143.3	83%	0.825	81%	0.812	S	S	*	*			trans	-105.4	137.8	152.1	-0.6	21.1	0	0	0	112
66	R	31	Very low	32.4	Very low	251 Å²	251	146 Å²	146	95%	0.947	81%	0.814	S	S	*	*			trans	-63.5	141.4	178.7	-69	170.7	168.2	-174.1	-4.5	112.9
67	G	29.5	Very low	31.9	Very low	81 Å²	81	152.3 Å²	152.3	84%	0.835	82%	0.823	S	S	*	*				72.9	100.1	124.6	0	0	0	0	0	119.1
68	A	32	Very low	32	Very low	103 Å²	103	147.7 Å²	147.7	85%	0.851	81%	0.814	S	S	*	*			trans	-140.7	97.7	144.8	0	0	0	0	0	109	R70	A68-R70 PolarHBondContact O-N 2.91Å
69	S	32.7	Very low	32.1	Very low	114 Å²	114	143.7 Å²	143.7	80%	0.797	81%	0.81	S	S	*	*			trans	-66.2	108.8	175.8	176.7	0	0	0	0	110	R71	S69-R71 PolarHBondContact O-N 3.02Å
70	R	36.3	Very low	32.2	Very low	243 Å²	243	147.7 Å²	147.7	92%	0.917	82%	0.818	S	S	*	*			trans	-79.2	103.6	164.3	-98.1	-177.8	173.6	175.9	-1.3	108.1	A68 Q72	A68-R70 PolarHBondContact O-N 2.91Å; R70-Q72 PolarHBondContact O-N 2.89Å; R70-Q72 VanDerWaalsContact O-N 3.08Å
71	R	32.1	Very low	32.1	Very low	231 Å²	231	154.1 Å²	154.1	87%	0.872	83%	0.827	S	S	*	*			trans	-58	107.7	167.9	-80.7	179.5	172.7	-175.6	-2.3	109.5	S69 V73	S69-R71 PolarHBondContact O-N 3.02Å; R71-V73 PolarHBondContact O-N 2.75Å
72	Q	31.3	Very low	32.3	Very low	179 Å²	179	153.8 Å²	153.8	84%	0.836	82%	0.824	S	S	*	*			trans	-80.2	108	165.1	-166.6	171	5.8	0	0	107.3	R70 T74	R70-Q72 PolarHBondContact O-N 2.89Å; R70-Q72 VanDerWaalsContact O-N 3.08Å; Q72-T74 PolarHBondContact O-N 3.24Å
73	V	31.6	Very low	32.4	Very low	107 Å²	107	153.1 Å²	153.1	65%	0.648	82%	0.82	S	S	*	*			trans	-86.8	99	176.1	179	0	0	0	0	108	R71 Y75	R71-V73 PolarHBondContact O-N 2.75Å; V73-Y75 HydrophobicContact CG1-CD2 3.92Å; V73-Y75 HydrophobicContact CG1-CE2 3.74Å
74	T	29.1	Very low	32.8	Very low	110 Å²	110	156 Å²	156	68%	0.675	83%	0.826	S	S	*	*			trans	-86.1	107	173.2	-36.6	0	0	0	0	108.5	Q72 V76	Q72-T74 PolarHBondContact O-N 3.24Å; T74-V76 HydrophobicContact CG2-CG2 4.38Å; T74-V76 PolarHBondContact O-N 2.03Å; T74-V76 VanDerWaalsContact O-N 3.13Å
75	Y	28.7	Very low	33	Very low	215 Å²	215	153.7 Å²	153.7	84%	0.843	82%	0.821	S	S	*	*			trans	-76.4	97.3	169.5	-88.7	-88.4	0	0	0	109.4	V73	V73-Y75 HydrophobicContact CG1-CD2 3.92Å; V73-Y75 HydrophobicContact CG1-CE2 3.74Å
76	V	32.4	Very low	32.8	Very low	125 Å²	125	155.9 Å²	155.9	76%	0.758	83%	0.826	S	S	*	*			trans	-84.9	107.9	165.6	-179.4	0	0	0	0	107.4	T74 S78	T74-V76 HydrophobicContact CG2-CG2 4.38Å; T74-V76 PolarHBondContact O-N 2.03Å; T74-V76 VanDerWaalsContact O-N 3.13Å; V76-S78 PolarHBondContact O-N 2.02Å
77	R	30.6	Very low	32.9	Very low	245 Å²	245	147.4 Å²	147.4	93%	0.925	82%	0.817	S	S	*	*			trans	-76.4	110.4	172.7	-152.1	177.7	-170.3	-177.7	2.9	107.9	G79	R77-G79 PolarHBondContact O-N 3.06Å
78	S	32.3	Very low	32.9	Very low	108 Å²	108	147.4 Å²	147.4	76%	0.755	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-65	124.3	177.5	53.5	0	0	0	0	110.8	V76	V76-S78 PolarHBondContact O-N 2.02Å
79	G	32.2	Very low	33	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-68.4	130.6	166.8	0	0	0	0	0	110	R77 R81	R77-G79 PolarHBondContact O-N 3.06Å; G79-R81 PolarHBondContact O-N 3.05Å
80	R	32.7	Very low	33	Very low	256 Å²	256	147 Å²	147	97%	0.966	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-59	122.3	172.1	-77.2	-179.6	173.4	-168	-2.7	109.6
81	R	32.2	Very low	33	Very low	246 Å²	246	142 Å²	142	93%	0.928	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-72.7	128.8	163.2	-82.5	-179.9	-176.8	173	0.5	109	G79	G79-R81 PolarHBondContact O-N 3.05Å
82	A	38.2	Very low	33.6	Very low	88 Å²	88	136.6 Å²	136.6	73%	0.727	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.1	149	160.8	0	0	0	0	0	109.6
83	P	38.3	Very low	33.6	Very low	119 Å²	119	137.2 Å²	137.2	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.1	154.7	-178.9	31.4	-33.6	0	0	0	112
84	P	37.7	Very low	34.4	Very low	133 Å²	133	138.1 Å²	138.1	86%	0.864	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.7	128.5	178.2	30.7	-30.1	0	0	0	110.8
85	G	34.8	Very low	34.6	Very low	76 Å²	76	136.1 Å²	136.1	78%	0.784	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-95.8	153.4	167.2	0	0	0	0	0	111
86	D	32.8	Very low	34.7	Very low	173 Å²	173	132.1 Å²	132.1	93%	0.925	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-65.7	160.3	-159.3	-140.1	-14.3	0	0	0	116.4
87	G	32.9	Very low	35.1	Very low	73 Å²	73	132.6 Å²	132.6	75%	0.753	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-76.3	152.2	178.9	0	0	0	0	0	114.1
88	G	30.3	Very low	35.4	Very low	82 Å²	82	125.2 Å²	125.2	85%	0.845	83%	0.825	S	S	*	*			trans	-174.6	114.2	171.1	0	0	0	0	0	112.3
89	S	34.8	Very low	35.9	Very low	130 Å²	130	126 Å²	126	91%	0.909	83%	0.827	S	S	*	*			trans	-69.9	141.1	-179.2	54.9	0	0	0	0	114.1
90	G	31.6	Very low	36.4	Very low	78 Å²	78	134.4 Å²	134.4	80%	0.804	84%	0.837	S	S	*	*			trans	-178	118.4	162.3	0	0	0	0	0	112
91	T	35.4	Very low	36.6	Very low	138 Å²	138	125.7 Å²	125.7	85%	0.847	83%	0.827	S	S	*	*			trans	-102.2	178.7	171	51.8	0	0	0	0	109.3
92	P	45.5	Very low	37.1	Very low	117 Å²	117	125.2 Å²	125.2	76%	0.76	83%	0.825	S	S	*	*				-124.6	149.1	-74.6	35	-19.1	0	0	0	111.5
93	E	32.4	Very low	37.5	Very low	193 Å²	193	126.9 Å²	126.9	90%	0.902	83%	0.828	S	S	*	*			trans	-131.5	145.9	165.1	-81.1	-131.8	143	0	0	112.6
94	P	48.4	Very low	37.8	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	83%	0.834	S	S	*	*			trans	-92.8	123.8	-165.5	35	-28.3	0	0	0	111.2
95	G	31.4	Very low	38.3	Very low	68 Å²	68	138 Å²	138	70%	0.701	84%	0.838	S	S	*	*			trans	-148.9	102.7	-177.8	0	0	0	0	0	113.5
96	C	32.1	Very low	39.4	Very low	132 Å²	132	144 Å²	144	89%	0.892	84%	0.842	S	S	*	*			trans	57.1	120.1	145.1	-61.2	0	0	0	0	119.6	A98	C96-A98 PolarHBondContact O-N 2.79Å; C96-A98 VanDerWaalsContact O-N 3.11Å
97	C	40.5	Very low	40.7	Very low	134 Å²	134	138.6 Å²	138.6	91%	0.905	83%	0.828	S	S	*	*			trans	-47.4	114.1	167.6	-58.1	0	0	0	0	112.1
98	A	37.7	Very low	42.3	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	82%	0.82	S	S	*	*			trans	-69.9	136.7	167.5	0	0	0	0	0	110	C96	C96-A98 PolarHBondContact O-N 2.79Å; C96-A98 VanDerWaalsContact O-N 3.11Å
99	P	42.4	Very low	44.8	Very low	124 Å²	124	139.2 Å²	139.2	81%	0.805	79%	0.793	S	S	*	*			trans	-66.7	142.9	-179.6	27.1	-32.8	0	0	0	110.6	G101	P99-G101 PolarHBondContact O-N 3.26Å
100	R	42.2	Very low	47.1	Very low	247 Å²	247	143.1 Å²	143.1	93%	0.932	79%	0.788	S	S	*	*			trans	-37.2	121	177.7	-70.8	179.1	174.8	-158.3	-1.6	111.1	R102	R100-R102 PolarHBondContact O-N 3.3Å
101	G	36.7	Very low	49.9	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-48.2	131.5	178.3	0	0	0	0	0	111.4	P99	P99-G101 PolarHBondContact O-N 3.26Å
102	R	42.7	Very low	52.7	Low	236 Å²	236	138.8 Å²	138.8	89%	0.891	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-47.5	140.7	167.8	-70	178.8	176.1	-163.8	-2.1	108.8	R100 R104	R100-R102 PolarHBondContact O-N 3.3Å; R102-R104 PolarHBondContact O-N 2.92Å
103	P	46.6	Very low	55	Low	123 Å²	123	137.5 Å²	137.5	80%	0.799	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-51.9	124	175.1	-20.8	30	0	0	0	108.5	R105	P103-R105 PolarHBondContact O-N 3.31Å
104	R	45.7	Very low	58.1	Low	237 Å²	237	132.1 Å²	132.1	89%	0.894	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-46.3	116.7	170.5	-88.4	176.7	160.9	164.4	-5.3	107.1	R102 K106	R102-R104 PolarHBondContact O-N 2.92Å; R104-K106 PolarHBondContact O-N 3.01Å
105	R	46.9	Very low	60.5	Low	249 Å²	249	128.2 Å²	128.2	94%	0.94	67%	0.672	S	S	*	*			trans	-52.3	109.6	167.7	-76.9	-176.2	171.6	-175.8	-3.7	105.9	P103 G107	P103-R105 PolarHBondContact O-N 3.31Å; R105-G107 PolarHBondContact O-N 3.45Å
106	K	57.7	Low	63.6	Low	202 Å²	202	129.3 Å²	129.3	88%	0.878	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-55.4	137.1	172.7	-71	-178.8	178.9	179.7	0	106.2	R104	R104-K106 PolarHBondContact O-N 3.01Å
107	G	60.3	Low	66.8	Low	60 Å²	60	126.4 Å²	126.4	62%	0.619	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-54.2	159	176.1	0	0	0	0	0	110.8	R105 R109	R105-G107 PolarHBondContact O-N 3.45Å; G107-R109 PolarHBondContact O-N 3.38Å
108	P	66.4	Low	69.5	Low	90 Å²	90	121.9 Å²	121.9	58%	0.584	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-52.3	131	-179.4	19.1	-30.3	0	0	0	110.5	W110	P108-W110 HydrophobicContact CB-CZ2 4.06Å; P108-W110 HydrophobicContact CG-CH2 4.31Å; P108-W110 HydrophobicContact CG-CZ2 3.51Å; P108-W110 PolarHBondContact O-NE1 3.38Å
109	R	82.4	Confident	72.4	Confident	78 Å²	78	118.3 Å²	118.3	29%	0.294	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-76.5	125.4	176	-174	-178.4	-175.4	-171.6	1.3	107.5	G107 H111 D113 L283 E323	G107-R109 PolarHBondContact O-N 3.38Å; R109-H111 VanDerWaalsContact CG-O 3.23Å; R109-H111 WeakPolarHBondContact CG-O 2.98Å; R109-H111 PolarHBondContact NE-O 2.87Å; R109-D113 IonicContact CZ-OD2 2.65Å; R109-D113 IonicContact NE-OD2 3.54Å; R109-D113 PolarHBondContact NE-OD2 3.36Å; R109-D113 VanDerWaalsContact NH2-CB 3.32Å; R109-D113 VanDerWaalsContact NH2-CG 3.29Å; R109-D113 IonicContact NH2-OD2 3.12Å; R109-D113 PolarHBondContact NH2-OD2 2.88Å; R109-L283 HydrophobicContact CB-CD2 4.34Å; R109-L283 HydrophobicContact CG-CD2 4Å; R109-E323 IonicContact CZ-OE1 3.82Å; R109-E323 IonicContact CZ-OE2 2.74Å; R109-E323 IonicContact NH1-OE1 3.68Å; R109-E323 PolarHBondContact NH1-OE1 3.05Å; R109-E323 VanDerWaalsContact NH1-OE1 3.08Å; R109-E323 IonicContact NH1-OE2 2.68Å; R109-E323 PolarHBondContact NH1-OE2 2.94Å; R109-E323 IonicContact NH2-OE1 3.09Å; R109-E323 PolarHBondContact NH2-OE1 3.07Å; R109-E323 IonicContact NH2-OE2 3.08Å
110	W	83.8	Confident	74.9	Confident	212 Å²	212	118.6 Å²	118.6	80%	0.803	58%	0.583	S	S	*	*			trans	-103.8	-2.8	-174.7	-58	99.5	0	0	0	113.8	P108	P108-W110 HydrophobicContact CB-CZ2 4.06Å; P108-W110 HydrophobicContact CG-CH2 4.31Å; P108-W110 HydrophobicContact CG-CZ2 3.51Å; P108-W110 PolarHBondContact O-NE1 3.38Å
111	H	90.1	Very high	77.5	Confident	115 Å²	115	110.2 Å²	110.2	53%	0.532	57%	0.567	S	S	.	*	S	Bend	trans	-154.7	157.8	179.9	64.5	-82.4	0	0	0	111.6	R109 D113	R109-H111 VanDerWaalsContact CG-O 3.23Å; R109-H111 WeakPolarHBondContact CG-O 2.98Å; R109-H111 PolarHBondContact NE-O 2.87Å; H111-D113 IonicContact CD2-OD1 3.07Å; H111-D113 IonicContact NE2-OD1 2.66Å
112	I	94.1	Very high	80.4	Confident	10 Å²	10	111.2 Å²	111.2	5%	0.051	55%	0.553	C	S	.	*			trans	-81.8	132.5	173.2	-56.6	-66.3	0	0	0	109.5	L114 E279 I282 L283 L320 E323	I112-L114 PolarHBondContact O-N 2.92Å; I112-E279 HydrophobicContact CD1-CG 4.26Å; I112-E279 HydrophobicContact CG1-CG 3.81Å; I112-I282 HydrophobicContact CD1-CB 4.16Å; I112-I282 HydrophobicContact CD1-CD1 4.37Å; I112-I282 HydrophobicContact CD1-CG2 3.68Å; I112-L283 HydrophobicContact CD1-CD2 3.86Å; I112-L283 HydrophobicContact CD1-CG 4.09Å; I112-L283 HydrophobicContact CG1-CD2 4.49Å; I112-L320 HydrophobicContact CD1-CD2 3.99Å; I112-L320 HydrophobicContact CG1-CD2 3.75Å; I112-L320 HydrophobicContact CG2-CD2 4.36Å; I112-E323 HydrophobicContact CD1-CG 4.38Å; I112-E323 HydrophobicContact CG2-CG 4.07Å
113	D	94.6	Very high	83	Confident	90 Å²	90	101.5 Å²	101.5	48%	0.481	52%	0.521	S	S	.	.			trans	-78.1	109.8	171.4	-62.9	-56	0	0	0	108.4	R109 H111 Q115	R109-D113 IonicContact CZ-OD2 2.65Å; R109-D113 IonicContact NE-OD2 3.54Å; R109-D113 PolarHBondContact NE-OD2 3.36Å; R109-D113 VanDerWaalsContact NH2-CB 3.32Å; R109-D113 VanDerWaalsContact NH2-CG 3.29Å; R109-D113 IonicContact NH2-OD2 3.12Å; R109-D113 PolarHBondContact NH2-OD2 2.88Å; H111-D113 IonicContact CD2-OD1 3.07Å; H111-D113 IonicContact NE2-OD1 2.66Å; D113-Q115 PolarHBondContact O-N 3.24Å
114	L	97.4	Very high	85.4	Confident	80 Å²	80	97.1 Å²	97.1	42%	0.419	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-65.5	133.5	-177.9	-58.2	-177.8	0	0	0	110.6	I112 F316 S319	I112-L114 PolarHBondContact O-N 2.92Å; L114-F316 HydrophobicContact CD2-CB 4.34Å; L114-F316 HydrophobicContact CD2-CD2 3.88Å; L114-S319 WeakPolarHBondContact CA-OG 2.9Å
115	Q	98.3	Very high	87.9	Confident	43 Å²	43	90 Å²	90	20%	0.201	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-53.9	153	169.3	-68.3	-65.2	-57.2	0	0	110.3	D113 R315 Y318 S319 K322	D113-Q115 PolarHBondContact O-N 3.24Å; Q115-R315 PolarHBondContact O-NE 3.24Å; Q115-R315 PolarHBondContact O-NH2 3.33Å; Q115-Y318 HydrophobicContact CB-CD1 3.96Å; Q115-Y318 HydrophobicContact CB-CE1 4.05Å; Q115-Y318 HydrophobicContact CG-CD1 3.91Å; Q115-Y318 HydrophobicContact CG-CE1 3.9Å; Q115-S319 PolarHBondContact N-OG 3.11Å; Q115-K322 HydrophobicContact CG-CB 3.94Å; Q115-K322 HydrophobicContact CG-CG 3.73Å
116	P	98.1	Very high	90.4	Very high	91 Å²	91	81.1 Å²	81.1	59%	0.591	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-54	155.9	171.8	-24.7	34.4	0	0	0	112	R130	P116-R130 PolarHBondContact O-NH1 3.31Å; P116-R130 PolarHBondContact O-NH2 3.17Å; P116-R130 VanDerWaalsContact O-NH2 3.11Å
117	W	98.4	Very high	92.3	Very high	70 Å²	70	71.5 Å²	71.5	27%	0.265	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-54.9	144.3	170.4	-67.8	111.2	0	0	0	110.7	G119 Q122 E127 R315	W117-G119 PolarHBondContact O-N 2.95Å; W117-Q122 HydrophobicContact CB-CG 4.05Å; W117-Q122 HydrophobicContact CD2-CB 3.83Å; W117-Q122 HydrophobicContact CD2-CG 3.72Å; W117-Q122 VanDerWaalsContact CE2-OE1 3.22Å; W117-Q122 HydrophobicContact CE3-CB 3.86Å; W117-Q122 HydrophobicContact CE3-CG 4.27Å; W117-Q122 HydrophobicContact CG-CB 4.22Å; W117-Q122 HydrophobicContact CG-CG 3.62Å; W117-Q122 HydrophobicContact CZ3-CB 4.26Å; W117-Q122 VanDerWaalsContact NE1-CD 3.34Å; W117-Q122 VanDerWaalsContact NE1-OE1 3.14Å; W117-E127 WeakPolarHBondContact CA-OE1 3.28Å; W117-E127 HydrophobicContact CE3-CG 4.28Å; W117-E127 HydrophobicContact CZ3-CG 4.45Å; W117-R315 HydrophobicContact CE3-CB 4.49Å; W117-R315 VanDerWaalsContact CE3-CD 3.41Å; W117-R315 HydrophobicContact CE3-CG 4.48Å; W117-R315 VanDerWaalsContact CZ2-NH1 3.31Å; W117-R315 HydrophobicContact CZ3-CB 4.25Å; W117-R315 VanDerWaalsContact NE1-NH1 3.14Å
118	A	97.8	Very high	94.1	Very high	39 Å²	39	68.6 Å²	68.6	32%	0.322	37%	0.368	S	S	.	.	S	Bend	trans	-61.6	-32.3	-178.8	0	0	0	0	0	112.6	E126 E127 R130	A118-E126 HydrophobicContact CB-CB 3.84Å; A118-E126 WeakPolarHBondContact CB-O 3.07Å; A118-E127 HydrophobicContact CB-CG 4.21Å; A118-E127 WeakPolarHBondContact CB-OE1 3.48Å; A118-E127 PolarHBondContact N-OE1 3.34Å; A118-R130 HydrophobicContact CB-CB 4.27Å
119	G	96.9	Very high	95.6	Very high	17 Å²	17	72.1 Å²	72.1	18%	0.175	37%	0.37	C	S	.	.	S	Bend	trans	-157.2	177.3	175	0	0	0	0	0	112.6	W117 A121 Q122 E126	W117-G119 PolarHBondContact O-N 2.95Å; G119-A121 PolarHBondContact O-N 3.07Å; G119-Q122 PolarHBondContact O-N 3.09Å; G119-E126 VanDerWaalsContact C-OE2 3.3Å; G119-E126 WeakPolarHBondContact CA-OE2 3Å; G119-E126 PolarHBondContact N-OE2 2.87Å
120	P	96.4	Very high	96.4	Very high	129 Å²	129	71 Å²	71	84%	0.838	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-24	-174.7	28.7	-34.9	0	0	0	112.7	Q122	P120-Q122 VanDerWaalsContact C-N 3.27Å; P120-Q122 PolarHBondContact O-N 3.45Å
121	A	96.1	Very high	97.1	Very high	71 Å²	71	60.9 Å²	60.9	59%	0.587	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-17.4	178.9	0	0	0	0	0	112.6	G119 S123	G119-A121 PolarHBondContact O-N 3.07Å; A121-S123 PolarHBondContact O-N 2.78Å; A121-S123 VanDerWaalsContact O-N 3.15Å
122	Q	97.1	Very high	97.5	Very high	94 Å²	94	56 Å²	56	44%	0.439	31%	0.305	S	S	.	.			trans	52.9	33.4	-176.6	-50.5	-178.3	19.3	0	0	111.7	W117 G119 P120 E126 S311	W117-Q122 HydrophobicContact CB-CG 4.05Å; W117-Q122 HydrophobicContact CD2-CB 3.83Å; W117-Q122 HydrophobicContact CD2-CG 3.72Å; W117-Q122 VanDerWaalsContact CE2-OE1 3.22Å; W117-Q122 HydrophobicContact CE3-CB 3.86Å; W117-Q122 HydrophobicContact CE3-CG 4.27Å; W117-Q122 HydrophobicContact CG-CB 4.22Å; W117-Q122 HydrophobicContact CG-CG 3.62Å; W117-Q122 HydrophobicContact CZ3-CB 4.26Å; W117-Q122 VanDerWaalsContact NE1-CD 3.34Å; W117-Q122 VanDerWaalsContact NE1-OE1 3.14Å; G119-Q122 PolarHBondContact O-N 3.09Å; P120-Q122 VanDerWaalsContact C-N 3.27Å; P120-Q122 PolarHBondContact O-N 3.45Å; Q122-E126 PolarHBondContact N-OE2 2.88Å; Q122-S311 VanDerWaalsContact O-CB 3.3Å; Q122-S311 WeakPolarHBondContact O-CB 3.19Å; Q122-S311 PolarHBondContact O-OG 3.29Å
123	S	97.7	Very high	97.7	Very high	32 Å²	32	64.8 Å²	64.8	22%	0.224	34%	0.337	C	S	.	.			trans	-84.5	159.3	-170.1	75.3	0	0	0	0	111.7	A121 D125 E126 E127	A121-S123 PolarHBondContact O-N 2.78Å; A121-S123 VanDerWaalsContact O-N 3.15Å; S123-D125 VanDerWaalsContact C-N 3.28Å; S123-D125 PolarHBondContact O-N 2.7Å; S123-E126 WeakPolarHBondContact OG-CG 3.37Å; S123-E126 PolarHBondContact OG-N 3.01Å; S123-E127 PolarHBondContact O-N 3.31Å
124	L	97.9	Very high	97.8	Very high	30 Å²	30	61.4 Å²	61.4	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-40	173	177.7	57.5	0	0	0	111	E127 A128 D310 V314 F344 L345 K347 I349 F350	L124-E127 PolarHBondContact O-N 2.8Å; L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 2.83Å; L124-D310 HydrophobicContact CD1-CB 3.78Å; L124-D310 HydrophobicContact CD2-CB 3.94Å; L124-D310 HydrophobicContact CG-CB 4.35Å; L124-V314 HydrophobicContact CD1-CG2 3.86Å; L124-F344 HydrophobicContact CD1-CE1 4.12Å; L124-L345 HydrophobicContact CD1-CD1 4.26Å; L124-K347 HydrophobicContact CD2-CD 4.44Å; L124-I349 HydrophobicContact CD2-CD1 4.05Å; L124-F350 HydrophobicContact CG-CE2 4.38Å; L124-F350 HydrophobicContact CG-CZ 4.45Å
125	D	97.9	Very high	97.9	Very high	88 Å²	88	57.6 Å²	57.6	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-50.1	-179.1	-59.4	-50.5	0	0	0	111.2	S123 E127 A128 W129 F350	S123-D125 VanDerWaalsContact C-N 3.28Å; S123-D125 PolarHBondContact O-N 2.7Å; D125-E127 VanDerWaalsContact C-N 3.35Å; D125-E127 PolarHBondContact O-N 3.24Å; D125-A128 PolarHBondContact O-N 2.86Å; D125-W129 WeakPolarHBondContact O-CB 3.44Å; D125-W129 PolarHBondContact O-N 3.08Å; D125-F350 HydrophobicContact CB-CE1 4.39Å; D125-F350 HydrophobicContact CB-CZ 4.48Å; D125-F350 WeakPolarHBondContact OD1-CE1 3.43Å; D125-F350 WeakPolarHBondContact OD1-CZ 3.49Å
126	E	98.1	Very high	97.8	Very high	62 Å²	62	58.9 Å²	58.9	29%	0.29	31%	0.312	S	S	.	.	H	α-helix	trans	-60.4	-44.3	-179.7	-69.9	178	147	0	0	111.7	A118 G119 Q122 S123 R130	A118-E126 HydrophobicContact CB-CB 3.84Å; A118-E126 WeakPolarHBondContact CB-O 3.07Å; G119-E126 VanDerWaalsContact C-OE2 3.3Å; G119-E126 WeakPolarHBondContact CA-OE2 3Å; G119-E126 PolarHBondContact N-OE2 2.87Å; Q122-E126 PolarHBondContact N-OE2 2.88Å; S123-E126 WeakPolarHBondContact OG-CG 3.37Å; S123-E126 PolarHBondContact OG-N 3.01Å; E126-R130 WeakPolarHBondContact O-CB 3.25Å; E126-R130 PolarHBondContact O-N 3.39Å; E126-R130 VanDerWaalsContact O-N 3.15Å
127	E	98.6	Very high	97.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-44.8	178.3	-71.6	-64.8	162.8	0	0	112.2	W117 A118 S123 L124 D125 R130 F131 V314 R315	W117-E127 WeakPolarHBondContact CA-OE1 3.28Å; W117-E127 HydrophobicContact CE3-CG 4.28Å; W117-E127 HydrophobicContact CZ3-CG 4.45Å; A118-E127 HydrophobicContact CB-CG 4.21Å; A118-E127 WeakPolarHBondContact CB-OE1 3.48Å; A118-E127 PolarHBondContact N-OE1 3.34Å; S123-E127 PolarHBondContact O-N 3.31Å; L124-E127 PolarHBondContact O-N 2.8Å; D125-E127 VanDerWaalsContact C-N 3.35Å; D125-E127 PolarHBondContact O-N 3.24Å; E127-R130 VanDerWaalsContact CD-NH2 3.28Å; E127-R130 PolarHBondContact O-N 3.49Å; E127-R130 IonicContact OE1-CZ 2.71Å; E127-R130 IonicContact OE1-NH2 3.28Å; E127-R130 PolarHBondContact OE1-NH2 3.43Å; E127-R130 VanDerWaalsContact OE1-NH2 3.12Å; E127-R130 IonicContact OE2-CZ 3.91Å; E127-R130 IonicContact OE2-NE 3.49Å; E127-R130 IonicContact OE2-NH2 3.67Å; E127-R130 PolarHBondContact OE2-NH2 3.46Å; E127-F131 VanDerWaalsContact O-CB 3.29Å; E127-F131 WeakPolarHBondContact O-CB 3.31Å; E127-F131 PolarHBondContact O-N 3.05Å; E127-V314 HydrophobicContact CB-CB 4Å; E127-V314 HydrophobicContact CB-CG1 3.91Å; E127-V314 WeakPolarHBondContact O-CG1 3.33Å; E127-R315 HydrophobicContact CG-CB 4.4Å; E127-R315 WeakPolarHBondContact OE2-CA 3.24Å
128	A	98.3	Very high	97.7	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-45.3	179.5	0	0	0	0	0	111.6	L124 D125 R130 F131 L132 F344 F350	L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 2.83Å; D125-A128 PolarHBondContact O-N 2.86Å; A128-R130 PolarHBondContact O-N 2.97Å; A128-F131 PolarHBondContact O-N 2.86Å; A128-L132 VanDerWaalsContact O-CB 3.26Å; A128-L132 WeakPolarHBondContact O-CB 3.4Å; A128-L132 VanDerWaalsContact O-CG 3.24Å; A128-L132 WeakPolarHBondContact O-CG 3.33Å; A128-L132 PolarHBondContact O-N 2.76Å; A128-F344 HydrophobicContact CB-CE1 3.89Å; A128-F344 HydrophobicContact CB-CZ 4.01Å; A128-F350 HydrophobicContact CB-CD2 3.72Å; A128-F350 HydrophobicContact CB-CE1 4.32Å; A128-F350 HydrophobicContact CB-CE2 3.32Å; A128-F350 HydrophobicContact CB-CG 4.37Å; A128-F350 HydrophobicContact CB-CZ 3.68Å
129	W	98.1	Very high	97.7	Very high	164 Å²	164	58.8 Å²	58.8	62%	0.621	32%	0.315	S	S	*	.	H	α-helix	trans	-60.4	-45	176.1	-81	114.3	0	0	0	111.9	D125 R133	D125-W129 WeakPolarHBondContact O-CB 3.44Å; D125-W129 PolarHBondContact O-N 3.08Å; W129-R133 WeakPolarHBondContact O-CB 3.47Å; W129-R133 PolarHBondContact O-N 3.44Å
130	R	98.3	Very high	97.8	Very high	53 Å²	53	59.7 Å²	59.7	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-60.5	-47.2	176.6	-179.7	174.8	70.9	170.8	1.4	111.6	P116 A118 E126 E127 A128 Y134 Y318	P116-R130 PolarHBondContact O-NH1 3.31Å; P116-R130 PolarHBondContact O-NH2 3.17Å; P116-R130 VanDerWaalsContact O-NH2 3.11Å; A118-R130 HydrophobicContact CB-CB 4.27Å; E126-R130 WeakPolarHBondContact O-CB 3.25Å; E126-R130 PolarHBondContact O-N 3.39Å; E126-R130 VanDerWaalsContact O-N 3.15Å; E127-R130 VanDerWaalsContact CD-NH2 3.28Å; E127-R130 PolarHBondContact O-N 3.49Å; E127-R130 IonicContact OE1-CZ 2.71Å; E127-R130 IonicContact OE1-NH2 3.28Å; E127-R130 PolarHBondContact OE1-NH2 3.43Å; E127-R130 VanDerWaalsContact OE1-NH2 3.12Å; E127-R130 IonicContact OE2-CZ 3.91Å; E127-R130 IonicContact OE2-NE 3.49Å; E127-R130 IonicContact OE2-NH2 3.67Å; E127-R130 PolarHBondContact OE2-NH2 3.46Å; A128-R130 PolarHBondContact O-N 2.97Å; R130-Y134 WeakPolarHBondContact O-CB 3.47Å; R130-Y134 PolarHBondContact O-N 2.95Å; R130-Y134 VanDerWaalsContact O-N 3.08Å; R130-Y318 HydrophobicContact CG-CD2 4.16Å; R130-Y318 HydrophobicContact CG-CE1 4.38Å; R130-Y318 HydrophobicContact CG-CE2 3.75Å; R130-Y318 VanDerWaalsContact CZ-CD1 3.5Å
131	F	98.6	Very high	97.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-49.3	-179.6	174.1	-96	0	0	0	112.7	E127 A128 R133 Y134 I135 W275 I297 L299 V314 W317 L321 F344	E127-F131 VanDerWaalsContact O-CB 3.29Å; E127-F131 WeakPolarHBondContact O-CB 3.31Å; E127-F131 PolarHBondContact O-N 3.05Å; A128-F131 PolarHBondContact O-N 2.86Å; F131-R133 VanDerWaalsContact C-N 3.32Å; F131-R133 PolarHBondContact O-N 2.86Å; F131-Y134 VanDerWaalsContact O-CB 3.26Å; F131-Y134 WeakPolarHBondContact O-CB 3.45Å; F131-Y134 PolarHBondContact O-N 2.83Å; F131-Y134 VanDerWaalsContact O-N 3.12Å; F131-I135 HydrophobicContact CD1-CD1 4.47Å; F131-I135 HydrophobicContact CE1-CD1 3.83Å; F131-I135 HydrophobicContact CE1-CG1 4.45Å; F131-I135 HydrophobicContact CE1-CG2 4.27Å; F131-I135 HydrophobicContact CE2-CG2 4.01Å; F131-I135 HydrophobicContact CZ-CD1 4.29Å; F131-I135 HydrophobicContact CZ-CG2 3.87Å; F131-I135 PolarHBondContact O-N 3.07Å; F131-W275 AromaticContact CE2-CH2 3.86Å; F131-W275 HydrophobicContact CE2-CH2 3.86Å; F131-W275 AromaticContact CZ-CH2 3.74Å; F131-W275 HydrophobicContact CZ-CH2 3.74Å; F131-W275 HydrophobicContact CZ-CZ2 4.16Å; F131-I297 HydrophobicContact CZ-CD1 4.07Å; F131-L299 HydrophobicContact CE1-CD1 3.9Å; F131-L299 HydrophobicContact CE1-CD2 3.75Å; F131-L299 HydrophobicContact CZ-CD2 3.87Å; F131-V314 HydrophobicContact CB-CG1 3.57Å; F131-V314 HydrophobicContact CD1-CG1 4.43Å; F131-V314 HydrophobicContact CG-CG1 3.97Å; F131-W317 HydrophobicContact CD2-CB 4.14Å; F131-W317 HydrophobicContact CE1-CE3 4.33Å; F131-W317 HydrophobicContact CE2-CB 3.72Å; F131-W317 HydrophobicContact CZ-CB 4.36Å; F131-W317 HydrophobicContact CZ-CE3 4.28Å; F131-L321 HydrophobicContact CD2-CD1 4.3Å; F131-L321 HydrophobicContact CE2-CD1 3.7Å; F131-F344 HydrophobicContact CD1-CE2 4.17Å; F131-F344 HydrophobicContact CD1-CZ 4.42Å; F131-F344 HydrophobicContact CE1-CE2 4.33Å
132	L	98.3	Very high	97.7	Very high	14 Å²	14	54.4 Å²	54.4	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-39.6	-179.7	-70.2	172.4	0	0	0	111.5	A128 Y134 I135 S136 L299 F344 F350 A352	A128-L132 VanDerWaalsContact O-CB 3.26Å; A128-L132 WeakPolarHBondContact O-CB 3.4Å; A128-L132 VanDerWaalsContact O-CG 3.24Å; A128-L132 WeakPolarHBondContact O-CG 3.33Å; A128-L132 PolarHBondContact O-N 2.76Å; L132-Y134 VanDerWaalsContact C-N 3.33Å; L132-Y134 PolarHBondContact O-N 3.41Å; L132-I135 HydrophobicContact CD2-CD1 4.09Å; L132-I135 WeakPolarHBondContact O-CG1 3.27Å; L132-I135 PolarHBondContact O-N 2.86Å; L132-S136 WeakPolarHBondContact O-CB 3.03Å; L132-S136 PolarHBondContact O-N 2.94Å; L132-S136 PolarHBondContact O-OG 3.17Å; L132-L299 HydrophobicContact CD2-CD1 4.38Å; L132-F344 HydrophobicContact CD2-CD2 4.34Å; L132-F344 HydrophobicContact CD2-CE2 4.09Å; L132-F344 HydrophobicContact CG-CE2 4.36Å; L132-F350 HydrophobicContact CD1-CB 3.53Å; L132-F350 HydrophobicContact CD1-CD2 4.29Å; L132-F350 HydrophobicContact CD1-CG 4.08Å; L132-A352 HydrophobicContact CD1-CB 4.02Å; L132-A352 HydrophobicContact CD2-CB 3.86Å
133	R	98.2	Very high	97.5	Very high	193 Å²	193	56 Å²	56	73%	0.728	29%	0.292	S	S	*	.	H	α-helix	trans	-60.6	-44	172.7	-177.8	175.5	-178.5	175.2	1.5	111.3	W129 F131 S136 T137	W129-R133 WeakPolarHBondContact O-CB 3.47Å; W129-R133 PolarHBondContact O-N 3.44Å; F131-R133 VanDerWaalsContact C-N 3.32Å; F131-R133 PolarHBondContact O-N 2.86Å; R133-S136 PolarHBondContact O-N 3.02Å; R133-T137 VanDerWaalsContact O-CB 3.29Å; R133-T137 WeakPolarHBondContact O-CB 3.38Å; R133-T137 PolarHBondContact O-N 2.71Å; R133-T137 VanDerWaalsContact O-N 3.15Å; R133-T137 PolarHBondContact O-OG1 3.49Å
134	Y	98.2	Very high	97.2	Very high	19 Å²	19	60.2 Å²	60.2	8%	0.075	31%	0.308	C	S	.	.	H	α-helix	trans	-56.8	-56.6	176.6	-179.4	-76.6	0	0	0	111.3	R130 F131 L132 S136 T137 Q139 Y318 L321 K322 E325	R130-Y134 WeakPolarHBondContact O-CB 3.47Å; R130-Y134 PolarHBondContact O-N 2.95Å; R130-Y134 VanDerWaalsContact O-N 3.08Å; F131-Y134 VanDerWaalsContact O-CB 3.26Å; F131-Y134 WeakPolarHBondContact O-CB 3.45Å; F131-Y134 PolarHBondContact O-N 2.83Å; F131-Y134 VanDerWaalsContact O-N 3.12Å; L132-Y134 VanDerWaalsContact C-N 3.33Å; L132-Y134 PolarHBondContact O-N 3.41Å; Y134-S136 PolarHBondContact O-N 2.76Å; Y134-T137 PolarHBondContact O-N 3.28Å; Y134-Q139 VanDerWaalsContact CE2-NE2 3.3Å; Y134-Q139 VanDerWaalsContact CZ-NE2 3.27Å; Y134-Q139 PolarHBondContact OH-NE2 2.91Å; Y134-Y318 HydrophobicContact CD2-CD2 4.36Å; Y134-Y318 AromaticContact CD2-CE2 3.74Å; Y134-Y318 HydrophobicContact CD2-CE2 3.74Å; Y134-Y318 HydrophobicContact CE2-CE2 4.5Å; Y134-Y318 HydrophobicContact CG-CD2 4.48Å; Y134-Y318 HydrophobicContact CG-CE2 4.21Å; Y134-L321 HydrophobicContact CD1-CB 4.26Å; Y134-L321 HydrophobicContact CD1-CD1 3.59Å; Y134-L321 HydrophobicContact CE1-CB 3.64Å; Y134-L321 HydrophobicContact CE1-CD1 3.59Å; Y134-L321 HydrophobicContact CE1-CG 4.19Å; Y134-L321 HydrophobicContact CE2-CB 4.42Å; Y134-L321 PolarHBondContact OH-O 3.4Å; Y134-L321 VanDerWaalsContact OH-O 3.08Å; Y134-K322 HydrophobicContact CD2-CD 4.48Å; Y134-K322 HydrophobicContact CE2-CD 3.9Å; Y134-E325 WeakPolarHBondContact CE2-OE1 3.21Å; Y134-E325 WeakPolarHBondContact OH-CG 3.48Å; Y134-E325 PolarHBondContact OH-OE1 2.76Å
135	I	97.9	Very high	96.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-70.7	-18.1	-173.5	64.7	166.2	0	0	0	112.4	F131 L132 I297 L299 L321 S334 Y356 L358	F131-I135 HydrophobicContact CD1-CD1 4.47Å; F131-I135 HydrophobicContact CE1-CD1 3.83Å; F131-I135 HydrophobicContact CE1-CG1 4.45Å; F131-I135 HydrophobicContact CE1-CG2 4.27Å; F131-I135 HydrophobicContact CE2-CG2 4.01Å; F131-I135 HydrophobicContact CZ-CD1 4.29Å; F131-I135 HydrophobicContact CZ-CG2 3.87Å; F131-I135 PolarHBondContact O-N 3.07Å; L132-I135 HydrophobicContact CD2-CD1 4.09Å; L132-I135 WeakPolarHBondContact O-CG1 3.27Å; L132-I135 PolarHBondContact O-N 2.86Å; I135-I297 HydrophobicContact CD1-CD1 4.14Å; I135-I297 HydrophobicContact CG2-CD1 4.37Å; I135-L299 HydrophobicContact CD1-CD1 4.17Å; I135-L321 HydrophobicContact CG2-CD1 3.55Å; I135-S334 WeakPolarHBondContact O-CB 3.44Å; I135-S334 PolarHBondContact O-OG 3.34Å; I135-Y356 HydrophobicContact CD1-CD1 4Å; I135-Y356 HydrophobicContact CD1-CD2 3.96Å; I135-Y356 HydrophobicContact CD1-CE1 4.14Å; I135-Y356 HydrophobicContact CD1-CE2 4.09Å; I135-Y356 HydrophobicContact CD1-CG 3.92Å; I135-L358 HydrophobicContact CB-CD1 3.96Å; I135-L358 HydrophobicContact CB-CD2 4.06Å; I135-L358 HydrophobicContact CG2-CD1 3.72Å
136	S	96.9	Very high	95.9	Very high	71 Å²	71	59.6 Å²	59.6	50%	0.497	30%	0.303	S	S	.	.	H	α-helix	trans	-95.3	-3.2	178.6	-55.2	0	0	0	0	113.2	L132 R133 Y134	L132-S136 WeakPolarHBondContact O-CB 3.03Å; L132-S136 PolarHBondContact O-N 2.94Å; L132-S136 PolarHBondContact O-OG 3.17Å; R133-S136 PolarHBondContact O-N 3.02Å; Y134-S136 PolarHBondContact O-N 2.76Å
137	T	97.5	Very high	94.5	Very high	75 Å²	75	58.9 Å²	58.9	46%	0.46	30%	0.303	S	S	.	.	S	Bend	trans	-114.9	110.5	-178	-53	0	0	0	0	110.4	R133 Y134 Q139	R133-T137 VanDerWaalsContact O-CB 3.29Å; R133-T137 WeakPolarHBondContact O-CB 3.38Å; R133-T137 PolarHBondContact O-N 2.71Å; R133-T137 VanDerWaalsContact O-N 3.15Å; R133-T137 PolarHBondContact O-OG1 3.49Å; Y134-T137 PolarHBondContact O-N 3.28Å; T137-Q139 PolarHBondContact O-N 2.87Å
138	A	97.4	Very high	92.6	Very high	58 Å²	58	59.7 Å²	59.7	48%	0.479	31%	0.308	S	S	.	.			trans	-60.4	131.9	171.2	0	0	0	0	0	110.5
139	Q	98.1	Very high	90.1	Very high	65 Å²	65	63.8 Å²	63.8	30%	0.304	34%	0.336	S	S	.	.	S	Bend	trans	-93.1	-22.5	-178.7	-60.7	176.4	-31.3	0	0	112.1	Y134 T137 E325 R330 L331	Y134-Q139 VanDerWaalsContact CE2-NE2 3.3Å; Y134-Q139 VanDerWaalsContact CZ-NE2 3.27Å; Y134-Q139 PolarHBondContact OH-NE2 2.91Å; T137-Q139 PolarHBondContact O-N 2.87Å; Q139-E325 PolarHBondContact NE2-OE1 3.2Å; Q139-R330 HydrophobicContact CB-CB 4.35Å; Q139-L331 WeakPolarHBondContact CA-O 3.12Å; Q139-L331 WeakPolarHBondContact CB-O 3.45Å; Q139-L331 HydrophobicContact CG-CB 4.09Å; Q139-L331 PolarHBondContact N-O 3.37Å
140	I	97.6	Very high	87.2	Confident	36 Å²	36	63.6 Å²	63.6	19%	0.185	35%	0.347	C	S	.	.	S	Bend	trans	-141.8	141.1	176.2	-167.2	162.6	0	0	0	109.2	F169 R330 L331 F332 V361 T363	I140-F169 HydrophobicContact CD1-CE1 4.35Å; I140-F169 HydrophobicContact CD1-CZ 3.75Å; I140-R330 HydrophobicContact CB-CB 4.02Å; I140-R330 HydrophobicContact CG2-CB 3.59Å; I140-L331 PolarHBondContact N-O 2.87Å; I140-F332 HydrophobicContact CG2-CB 3.7Å; I140-F332 WeakPolarHBondContact O-CA 3.26Å; I140-F332 WeakPolarHBondContact O-CB 3.23Å; I140-V361 HydrophobicContact CG2-CG1 3.97Å; I140-T363 HydrophobicContact CD1-CG2 3.99Å
141	A	96.5	Very high	84.2	Confident	63 Å²	63	64.1 Å²	64.1	52%	0.521	36%	0.362	S	S	.	.			trans	-74.8	142.5	172.1	0	0	0	0	0	110.1	R168	A141-R168 PolarHBondContact O-NH2 2.93Å
142	C	95.2	Very high	81.1	Confident	25 Å²	25	70.7 Å²	70.7	17%	0.169	40%	0.403	C	S	.	.			trans	-118.8	116.7	164.7	-177.3	0	0	0	0	108	H144 C164 F332	C142-H144 PolarHBondContact SG-O 3.3Å; C142-C164 HydrophobicContact CB-CB 3.94Å; C142-C164 WeakPolarHBondContact CB-SG 3.49Å; C142-C164 WeakPolarHBondContact SG-CA 3.37Å; C142-C164 WeakPolarHBondContact SG-CB 3.3Å; C142-C164 CovalentContact SG-SG 2.03Å; C142-C164 PolarHBondContact SG-SG 2.9Å; C142-F332 HydrophobicContact CB-CB 4.2Å; C142-F332 HydrophobicContact CB-CD2 3.67Å; C142-F332 HydrophobicContact CB-CE2 4.38Å; C142-F332 HydrophobicContact CB-CG 4.15Å
143	N	92.9	Very high	78.2	Confident	129 Å²	129	77 Å²	77	69%	0.69	44%	0.436	S	S	*	.	S	Bend	trans	-81.7	-34.8	-174.4	-65	-28.7	0	0	0	111.6	D166	N143-D166 WeakPolarHBondContact CB-OD1 2.99Å; N143-D166 PolarHBondContact N-OD1 3.02Å; N143-D166 PolarHBondContact N-OD2 3.4Å
144	H	90.6	Very high	75.3	Confident	120 Å²	120	73.8 Å²	73.8	56%	0.556	44%	0.444	S	S	*	.	S	Bend	trans	-110.3	94.1	176.6	-54.3	95.1	0	0	0	108.9	C142 L165 D166	C142-H144 PolarHBondContact SG-O 3.3Å; H144-L165 HydrophobicContact CB-CB 4.12Å; H144-L165 WeakPolarHBondContact O-CA 3.33Å; H144-L165 WeakPolarHBondContact O-CB 3.45Å; H144-L165 PolarHBondContact O-N 2.77Å; H144-D166 IonicContact CG-OD1 3.82Å; H144-D166 PolarHBondContact N-OD1 2.96Å; H144-D166 IonicContact ND1-OD1 3.18Å; H144-D166 PolarHBondContact ND1-OD1 3.03Å
145	M	87.4	Confident	72.6	Confident	75 Å²	75	76.3 Å²	76.3	37%	0.369	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.6	176.4	-170.7	168.4	56.1	0	0	109.2	T147 V163 F332 H333	M145-T147 HydrophobicContact CE-CG2 3.55Å; M145-T147 HydrophobicContact CG-CG2 3.79Å; M145-T147 HydrophobicContact SD-CG2 3.98Å; M145-V163 WeakPolarHBondContact CA-O 3.35Å; M145-F332 HydrophobicContact CG-CE2 4.31Å; M145-F332 HydrophobicContact SD-CD2 4.4Å; M145-F332 HydrophobicContact SD-CE2 4.02Å; M145-H333 HydrophobicContact SD-CB 3.95Å
146	N	82	Confident	70.1	Confident	29 Å²	29	82.5 Å²	82.5	16%	0.155	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	111.9	166.9	-178.9	6	0	0	0	108.3	D148 S162 V163 L165	N146-D148 PolarHBondContact OD1-N 3.1Å; N146-S162 WeakPolarHBondContact O-CA 3.5Å; N146-V163 HydrophobicContact CB-CG2 3.77Å; N146-V163 PolarHBondContact N-O 3.28Å; N146-V163 PolarHBondContact O-N 3.25Å; N146-V163 VanDerWaalsContact O-N 3.08Å; N146-L165 HydrophobicContact CB-CD1 3.6Å; N146-L165 HydrophobicContact CB-CG 4.18Å
147	T	67.9	Low	67.9	Low	47 Å²	47	83.4 Å²	83.4	29%	0.288	51%	0.507	S	S	.	.			trans	-104.7	46.2	177.2	59.6	0	0	0	0	110.1	M145 S149 S162	M145-T147 HydrophobicContact CE-CG2 3.55Å; M145-T147 HydrophobicContact CG-CG2 3.79Å; M145-T147 HydrophobicContact SD-CG2 3.98Å; T147-S149 WeakPolarHBondContact O-CB 3.16Å; T147-S149 PolarHBondContact O-N 3.21Å; T147-S149 PolarHBondContact O-OG 2.91Å; T147-S162 WeakPolarHBondContact CG2-OG 3.14Å
148	D	58.9	Low	66.4	Low	18 Å²	18	86.3 Å²	86.3	10%	0.096	52%	0.515	C	S	.	.	S	Bend	trans	49.4	23	170.9	-147	24.8	0	0	0	116.4	N146 H193 F194 S197	N146-D148 PolarHBondContact OD1-N 3.1Å; D148-H193 PolarHBondContact O-CE1 3.26Å; D148-H193 IonicContact OD1-CE1 2.73Å; D148-H193 IonicContact OD1-ND1 3.08Å; D148-H193 PolarHBondContact OD1-ND1 2.82Å; D148-H193 IonicContact OD2-CE1 3.72Å; D148-H193 IonicContact OD2-CG 2.73Å; D148-H193 IonicContact OD2-ND1 3.87Å; D148-H193 PolarHBondContact OD2-ND1 3.39Å; D148-F194 HydrophobicContact CB-CD2 4.31Å; D148-F194 WeakPolarHBondContact OD2-CA 3.3Å; D148-F194 VanDerWaalsContact OD2-CB 3.29Å; D148-F194 WeakPolarHBondContact OD2-CB 3.29Å; D148-F194 PolarHBondContact OD2-N 3.28Å; D148-S197 VanDerWaalsContact OD1-CB 3.3Å; D148-S197 WeakPolarHBondContact OD1-CB 3.45Å; D148-S197 PolarHBondContact OD1-OG 2.93Å
149	S	44.7	Very low	65.3	Low	85 Å²	85	85 Å²	85	59%	0.594	50%	0.498	S	S	*	.			trans	-126.2	64.6	-174	-55.5	0	0	0	0	109.5	T147	T147-S149 WeakPolarHBondContact O-CB 3.16Å; T147-S149 PolarHBondContact O-N 3.21Å; T147-S149 PolarHBondContact O-OG 2.91Å
150	L	38.1	Very low	64.7	Low	161 Å²	161	82.9 Å²	82.9	84%	0.843	49%	0.49	S	S	*	.			trans	-91.9	22.7	155.2	-78.7	169.2	0	0	0	111
151	A	35.2	Very low	64.4	Low	64 Å²	64	81.6 Å²	81.6	53%	0.529	48%	0.483	S	S	.	.	S	Bend	trans	-93.9	115.2	161.7	0	0	0	0	0	108.2	D153	A151-D153 PolarHBondContact O-N 3.38Å
152	T	34.1	Very low	64.3	Low	138 Å²	138	78.6 Å²	78.6	85%	0.847	46%	0.458	S	S	*	.			trans	-70.6	54	174	44.7	0	0	0	0	112
153	D	36.3	Very low	64.3	Low	145 Å²	145	77.4 Å²	77.4	78%	0.775	45%	0.45	S	S	*	.	S	Bend	trans	-148.2	120.5	165.5	-92	-38.5	0	0	0	110.7	A151 S155	A151-D153 PolarHBondContact O-N 3.38Å; D153-S155 VanDerWaalsContact C-N 3.35Å; D153-S155 PolarHBondContact O-N 2.74Å
154	S	38.8	Very low	64.4	Low	127 Å²	127	71.2 Å²	71.2	89%	0.888	42%	0.417	S	S	*	.			trans	-67.2	81.4	179.4	51	0	0	0	0	111.7
155	S	40.3	Very low	64.7	Low	71 Å²	71	67.4 Å²	67.4	50%	0.497	40%	0.401	S	S	.	.			trans	-111.5	128.2	156.4	80.7	0	0	0	0	110.3	D153 T157	D153-S155 VanDerWaalsContact C-N 3.35Å; D153-S155 PolarHBondContact O-N 2.74Å; S155-T157 WeakPolarHBondContact CB-OG1 3.06Å; S155-T157 PolarHBondContact O-N 3.36Å; S155-T157 PolarHBondContact OG-OG1 2.97Å
156	P	45.8	Very low	65.1	Low	130 Å²	130	64.2 Å²	64.2	84%	0.844	39%	0.385	S	S	*	.			trans	-78.5	25.7	178.2	33.3	-34.5	0	0	0	112.5
157	T	51.3	Low	65.6	Low	91 Å²	91	67.8 Å²	67.8	56%	0.558	40%	0.404	S	S	*	.			trans	-97.1	-9.2	-157.2	51.2	0	0	0	0	115.8	S155	S155-T157 WeakPolarHBondContact CB-OG1 3.06Å; S155-T157 PolarHBondContact O-N 3.36Å; S155-T157 PolarHBondContact OG-OG1 2.97Å
158	H	64.4	Low	66.8	Low	136 Å²	136	72.2 Å²	72.2	63%	0.63	42%	0.416	S	S	*	.	S	Bend	trans	-119.6	137.2	-176.4	-65.4	-79.7	0	0	0	112.6
159	K	75.8	Confident	68.4	Low	29 Å²	29	71.7 Å²	71.7	13%	0.126	41%	0.413	C	S	.	.			trans	-65.3	126.8	179.9	-163.9	-169.9	86.3	175.7	0	110	W161 D269 E296 Y335 T357	K159-W161 PolarHBondContact O-N 2.87Å; K159-D269 IonicContact NZ-OD2 3.81Å; K159-E296 WeakPolarHBondContact CD-OE2 3.33Å; K159-E296 WeakPolarHBondContact CE-OE2 3.48Å; K159-E296 IonicContact NZ-OE2 2.86Å; K159-E296 PolarHBondContact NZ-OE2 2.98Å; K159-Y335 HydrophobicContact CG-CD1 4.02Å; K159-Y335 HydrophobicContact CG-CE1 3.93Å; K159-T357 WeakPolarHBondContact CD-OG1 3.46Å; K159-T357 WeakPolarHBondContact CE-OG1 3.35Å; K159-T357 PolarHBondContact NZ-OG1 3.35Å
160	P	84.4	Confident	70.7	Confident	21 Å²	21	68.9 Å²	68.9	14%	0.136	39%	0.391	C	S	.	.			trans	-77.9	124.6	-174.5	29.8	-34	0	0	0	112.1	S162 Y335	P160-S162 PolarHBondContact O-N 2.82Å; P160-Y335 HydrophobicContact CG-CD1 4.14Å; P160-Y335 HydrophobicContact CG-CD2 3.64Å; P160-Y335 HydrophobicContact CG-CE2 4.14Å; P160-Y335 HydrophobicContact CG-CG 3.63Å
161	W	91.6	Very high	73.4	Confident	9 Å²	9	61.2 Å²	61.2	3%	0.034	35%	0.351	C	S	.	.			trans	-93.5	70.2	169.8	-63.2	106.8	0	0	0	110.4	K159 V163 F194 K267 D269 I294 E296 T357	K159-W161 PolarHBondContact O-N 2.87Å; W161-V163 PolarHBondContact O-N 2.89Å; W161-F194 HydrophobicContact CB-CB 4.15Å; W161-F194 HydrophobicContact CB-CD1 4.17Å; W161-F194 HydrophobicContact CB-CD2 3.54Å; W161-F194 HydrophobicContact CB-CE1 4.47Å; W161-F194 HydrophobicContact CB-CE2 3.89Å; W161-F194 HydrophobicContact CB-CG 3.68Å; W161-F194 HydrophobicContact CB-CZ 4.34Å; W161-F194 HydrophobicContact CG-CB 4.19Å; W161-F194 HydrophobicContact CG-CD2 4.44Å; W161-F194 HydrophobicContact CG-CG 4.14Å; W161-F194 VanDerWaalsContact O-CE2 3.23Å; W161-F194 WeakPolarHBondContact O-CE2 3.37Å; W161-K267 HydrophobicContact CD2-CD 3.79Å; W161-K267 HydrophobicContact CD2-CG 4.3Å; W161-K267 HydrophobicContact CE3-CD 3.77Å; W161-K267 VanDerWaalsContact CE3-CE 3.45Å; W161-K267 HydrophobicContact CE3-CG 3.75Å; W161-K267 HydrophobicContact CG-CD 4.2Å; W161-K267 HydrophobicContact CH2-CD 4.41Å; W161-K267 HydrophobicContact CH2-CG 4.2Å; W161-K267 HydrophobicContact CZ2-CD 4.45Å; W161-K267 HydrophobicContact CZ3-CD 4.11Å; W161-K267 HydrophobicContact CZ3-CG 3.72Å; W161-D269 HydrophobicContact CH2-CB 3.96Å; W161-I294 HydrophobicContact CE3-CB 4.46Å; W161-I294 HydrophobicContact CE3-CG2 3.64Å; W161-I294 HydrophobicContact CZ3-CG2 4.13Å; W161-E296 HydrophobicContact CH2-CB 4.23Å; W161-T357 HydrophobicContact CE3-CG2 4.11Å; W161-T357 HydrophobicContact CZ3-CG2 4.22Å
162	S	93.5	Very high	76.1	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.33	C	S	.	.			trans	-69.9	124.4	-169.5	-56.2	0	0	0	0	113.4	N146 T147 P160 I294 F332 H333 S359	N146-S162 WeakPolarHBondContact O-CA 3.5Å; T147-S162 WeakPolarHBondContact CG2-OG 3.14Å; P160-S162 PolarHBondContact O-N 2.82Å; S162-I294 WeakPolarHBondContact O-CD1 3.21Å; S162-F332 WeakPolarHBondContact O-CZ 3.48Å; S162-H333 PolarHBondContact OG-CD2 2.81Å; S162-H333 PolarHBondContact OG-NE2 3.37Å; S162-S359 WeakPolarHBondContact O-CB 3.48Å; S162-S359 PolarHBondContact O-OG 3.36Å
163	V	95.6	Very high	79	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	146.3	169.8	-66.1	0	0	0	0	111.2	M145 N146 W161 L165 L171 F194 I265 I294	M145-V163 WeakPolarHBondContact CA-O 3.35Å; N146-V163 HydrophobicContact CB-CG2 3.77Å; N146-V163 PolarHBondContact N-O 3.28Å; N146-V163 PolarHBondContact O-N 3.25Å; N146-V163 VanDerWaalsContact O-N 3.08Å; W161-V163 PolarHBondContact O-N 2.89Å; V163-L165 HydrophobicContact CG2-CD2 4.12Å; V163-L165 HydrophobicContact CG2-CG 4.36Å; V163-L171 HydrophobicContact CB-CD2 3.89Å; V163-L171 HydrophobicContact CG1-CD2 4.33Å; V163-L171 HydrophobicContact CG2-CD2 4.27Å; V163-F194 HydrophobicContact CG1-CE2 4.11Å; V163-F194 HydrophobicContact CG1-CZ 3.84Å; V163-I265 HydrophobicContact CG1-CD1 3.87Å; V163-I265 HydrophobicContact CG1-CG1 4.22Å; V163-I265 HydrophobicContact CG1-CG2 4.28Å; V163-I294 HydrophobicContact CG1-CD1 3.6Å
164	C	96.4	Very high	81.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.6	174.3	-169.1	0	0	0	0	111.7	C142 F169 Q292 F332	C142-C164 HydrophobicContact CB-CB 3.94Å; C142-C164 WeakPolarHBondContact CB-SG 3.49Å; C142-C164 WeakPolarHBondContact SG-CA 3.37Å; C142-C164 WeakPolarHBondContact SG-CB 3.3Å; C142-C164 CovalentContact SG-SG 2.03Å; C142-C164 PolarHBondContact SG-SG 2.9Å; C164-F169 HydrophobicContact CB-CD2 4.37Å; C164-F169 VanDerWaalsContact SG-CD2 3.57Å; C164-Q292 PolarHBondContact O-NE2 2.97Å; C164-F332 HydrophobicContact CB-CD1 4.26Å; C164-F332 HydrophobicContact CB-CD2 4.2Å; C164-F332 HydrophobicContact CB-CE1 3.95Å; C164-F332 HydrophobicContact CB-CE2 3.91Å; C164-F332 HydrophobicContact CB-CG 4.36Å; C164-F332 HydrophobicContact CB-CZ 3.77Å
165	L	95.6	Very high	84.4	Confident	40 Å²	40	45.5 Å²	45.5	21%	0.209	24%	0.24	C	C	.	.			trans	-109.9	11	-177.6	-60.3	-176.5	0	0	0	113.1	H144 N146 V163 D167 L171 A172 I175	H144-L165 HydrophobicContact CB-CB 4.12Å; H144-L165 WeakPolarHBondContact O-CA 3.33Å; H144-L165 WeakPolarHBondContact O-CB 3.45Å; H144-L165 PolarHBondContact O-N 2.77Å; N146-L165 HydrophobicContact CB-CD1 3.6Å; N146-L165 HydrophobicContact CB-CG 4.18Å; V163-L165 HydrophobicContact CG2-CD2 4.12Å; V163-L165 HydrophobicContact CG2-CG 4.36Å; L165-D167 PolarHBondContact O-N 2.95Å; L165-L171 HydrophobicContact CD2-CD2 3.81Å; L165-L171 HydrophobicContact CD2-CG 4Å; L165-A172 HydrophobicContact CB-CB 4.16Å; L165-A172 HydrophobicContact CD2-CB 4.42Å; L165-A172 VanDerWaalsContact O-CB 3.31Å; L165-A172 WeakPolarHBondContact O-CB 3.25Å; L165-I175 HydrophobicContact CD2-CD1 3.77Å
166	D	95.6	Very high	87	Confident	8 Å²	8	48.9 Å²	48.9	4%	0.043	24%	0.242	C	C	.	.			trans	-56.4	129.9	170.9	-73	-9.3	0	0	0	109.9	N143 H144 R168 F169	N143-D166 WeakPolarHBondContact CB-OD1 2.99Å; N143-D166 PolarHBondContact N-OD1 3.02Å; N143-D166 PolarHBondContact N-OD2 3.4Å; H144-D166 IonicContact CG-OD1 3.82Å; H144-D166 PolarHBondContact N-OD1 2.96Å; H144-D166 IonicContact ND1-OD1 3.18Å; H144-D166 PolarHBondContact ND1-OD1 3.03Å; D166-R168 HydrophobicContact CB-CG 4Å; D166-R168 PolarHBondContact O-N 2.82Å; D166-R168 IonicContact OD2-CZ 3.54Å; D166-R168 IonicContact OD2-NE 3.38Å; D166-R168 PolarHBondContact OD2-NE 2.81Å; D166-R168 IonicContact OD2-NH2 2.81Å; D166-R168 PolarHBondContact OD2-NH2 2.84Å; D166-F169 HydrophobicContact CB-CD2 3.84Å; D166-F169 HydrophobicContact CB-CE2 4.01Å; D166-F169 PolarHBondContact O-N 2.89Å
167	D	92.4	Very high	89.3	Confident	104 Å²	104	46.2 Å²	46.2	56%	0.556	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-56.5	-27.2	-174	-72.6	-51.9	0	0	0	113.3	L165 F169 N170 R176	L165-D167 PolarHBondContact O-N 2.95Å; D167-F169 PolarHBondContact O-N 3.26Å; D167-F169 VanDerWaalsContact O-N 3.11Å; D167-N170 PolarHBondContact O-N 3.16Å; D167-N170 VanDerWaalsContact O-N 3.16Å; D167-R176 IonicContact OD1-CZ 3.68Å; D167-R176 IonicContact OD1-NH1 3.37Å; D167-R176 PolarHBondContact OD1-NH1 3.13Å; D167-R176 IonicContact OD1-NH2 2.96Å; D167-R176 PolarHBondContact OD1-NH2 3.39Å
168	R	93.5	Very high	91.3	Very high	139 Å²	139	47.6 Å²	47.6	53%	0.525	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-62.3	-14.1	176.8	65.2	-178.9	165.5	170.2	-1.7	114.9	A141 D166	A141-R168 PolarHBondContact O-NH2 2.93Å; D166-R168 HydrophobicContact CB-CG 4Å; D166-R168 PolarHBondContact O-N 2.82Å; D166-R168 IonicContact OD2-CZ 3.54Å; D166-R168 IonicContact OD2-NE 3.38Å; D166-R168 PolarHBondContact OD2-NE 2.81Å; D166-R168 IonicContact OD2-NH2 2.81Å; D166-R168 PolarHBondContact OD2-NH2 2.84Å
169	F	93.6	Very high	92.7	Very high	7 Å²	7	47.4 Å²	47.4	3%	0.031	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-109.2	10.1	179.1	-52.9	-55.2	0	0	0	113.4	I140 C164 D166 D167 L171 V361 T363	I140-F169 HydrophobicContact CD1-CE1 4.35Å; I140-F169 HydrophobicContact CD1-CZ 3.75Å; C164-F169 HydrophobicContact CB-CD2 4.37Å; C164-F169 VanDerWaalsContact SG-CD2 3.57Å; D166-F169 HydrophobicContact CB-CD2 3.84Å; D166-F169 HydrophobicContact CB-CE2 4.01Å; D166-F169 PolarHBondContact O-N 2.89Å; D167-F169 PolarHBondContact O-N 3.26Å; D167-F169 VanDerWaalsContact O-N 3.11Å; F169-L171 PolarHBondContact O-N 3.36Å; F169-V361 HydrophobicContact CB-CG2 3.68Å; F169-V361 HydrophobicContact CD1-CG1 4.47Å; F169-V361 HydrophobicContact CD1-CG2 3.54Å; F169-V361 HydrophobicContact CD2-CG1 4.42Å; F169-V361 HydrophobicContact CD2-CG2 3.7Å; F169-V361 HydrophobicContact CE1-CG1 4.12Å; F169-V361 HydrophobicContact CE1-CG2 4.03Å; F169-V361 HydrophobicContact CE2-CG1 4.05Å; F169-V361 HydrophobicContact CE2-CG2 4.16Å; F169-V361 HydrophobicContact CG-CG2 3.35Å; F169-V361 HydrophobicContact CZ-CG1 3.89Å; F169-V361 HydrophobicContact CZ-CG2 4.32Å; F169-T363 HydrophobicContact CE1-CG2 4.24Å
170	N	91.9	Very high	93.6	Very high	26 Å²	26	46.1 Å²	46.1	14%	0.139	21%	0.213	C	C	.	.	S	Bend	trans	61.1	-16.3	174.2	-155.5	36.6	0	0	0	118	D167 A172 H173 Q174 K366	D167-N170 PolarHBondContact O-N 3.16Å; D167-N170 VanDerWaalsContact O-N 3.16Å; N170-A172 VanDerWaalsContact C-N 3.35Å; N170-A172 PolarHBondContact O-N 2.67Å; N170-H173 WeakPolarHBondContact O-CB 3.46Å; N170-H173 PolarHBondContact O-N 2.78Å; N170-H173 VanDerWaalsContact O-N 3.08Å; N170-H173 WeakPolarHBondContact OD1-CB 3.2Å; N170-H173 PolarHBondContact OD1-CD2 3.3Å; N170-Q174 PolarHBondContact ND2-NE2 3.35Å; N170-Q174 WeakPolarHBondContact O-CG 3.5Å; N170-Q174 PolarHBondContact O-N 3.11Å; N170-K366 PolarHBondContact ND2-OXT 3.23Å
171	L	94.5	Very high	94.3	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-56.5	-45.6	-177.5	175.4	62.9	0	0	0	112.6	V163 L165 F169 H173 Q174 I175 D264 I265	V163-L171 HydrophobicContact CB-CD2 3.89Å; V163-L171 HydrophobicContact CG1-CD2 4.33Å; V163-L171 HydrophobicContact CG2-CD2 4.27Å; L165-L171 HydrophobicContact CD2-CD2 3.81Å; L165-L171 HydrophobicContact CD2-CG 4Å; F169-L171 PolarHBondContact O-N 3.36Å; L171-H173 VanDerWaalsContact C-N 3.26Å; L171-H173 PolarHBondContact O-N 2.82Å; L171-Q174 PolarHBondContact O-N 3.2Å; L171-Q174 VanDerWaalsContact O-N 3.16Å; L171-I175 HydrophobicContact CD1-CD1 3.96Å; L171-I175 HydrophobicContact CD1-CG1 4.08Å; L171-I175 HydrophobicContact CD2-CD1 4.38Å; L171-I175 HydrophobicContact CG-CD1 3.83Å; L171-I175 HydrophobicContact CG-CG1 4.38Å; L171-I175 WeakPolarHBondContact O-CG1 3.3Å; L171-I175 PolarHBondContact O-N 3.13Å; L171-D264 HydrophobicContact CD1-CB 3.79Å; L171-I265 HydrophobicContact CD1-CD1 3.81Å; L171-I265 HydrophobicContact CD1-CG1 3.96Å; L171-I265 HydrophobicContact CD2-CD1 3.85Å; L171-I265 HydrophobicContact CD2-CG1 3.96Å
172	A	93.6	Very high	94.6	Very high	10 Å²	10	47.5 Å²	47.5	8%	0.083	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-36.8	179.5	0	0	0	0	0	112.4	L165 N170 R176	L165-A172 HydrophobicContact CB-CB 4.16Å; L165-A172 HydrophobicContact CD2-CB 4.42Å; L165-A172 VanDerWaalsContact O-CB 3.31Å; L165-A172 WeakPolarHBondContact O-CB 3.25Å; N170-A172 VanDerWaalsContact C-N 3.35Å; N170-A172 PolarHBondContact O-N 2.67Å; A172-R176 WeakPolarHBondContact O-CG 3.37Å; A172-R176 PolarHBondContact O-N 2.51Å
173	H	93.8	Very high	94.8	Very high	79 Å²	79	47.5 Å²	47.5	37%	0.366	22%	0.216	S	C	.	.	H	α-helix	trans	-68.1	-42.6	175	-179.3	77.3	0	0	0	111.7	N170 L171 I175 R176 N177	N170-H173 WeakPolarHBondContact O-CB 3.46Å; N170-H173 PolarHBondContact O-N 2.78Å; N170-H173 VanDerWaalsContact O-N 3.08Å; N170-H173 WeakPolarHBondContact OD1-CB 3.2Å; N170-H173 PolarHBondContact OD1-CD2 3.3Å; L171-H173 VanDerWaalsContact C-N 3.26Å; L171-H173 PolarHBondContact O-N 2.82Å; H173-I175 VanDerWaalsContact C-N 3.32Å; H173-I175 PolarHBondContact O-N 2.93Å; H173-R176 PolarHBondContact O-N 2.79Å; H173-N177 PolarHBondContact CD2-ND2 3.2Å; H173-N177 PolarHBondContact CE1-ND2 3.34Å; H173-N177 PolarHBondContact NE2-ND2 3.16Å; H173-N177 PolarHBondContact O-N 3.44Å
174	Q	94.7	Very high	94.8	Very high	32 Å²	32	47.5 Å²	47.5	15%	0.15	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-40.3	175.3	-64.6	-63.1	-15.2	0	0	112.2	N170 L171 N177 K178 Q179 C180	N170-Q174 PolarHBondContact ND2-NE2 3.35Å; N170-Q174 WeakPolarHBondContact O-CG 3.5Å; N170-Q174 PolarHBondContact O-N 3.11Å; L171-Q174 PolarHBondContact O-N 3.2Å; L171-Q174 VanDerWaalsContact O-N 3.16Å; Q174-N177 PolarHBondContact O-N 3.12Å; Q174-K178 PolarHBondContact O-N 3.19Å; Q174-K178 VanDerWaalsContact O-N 3.1Å; Q174-Q179 PolarHBondContact O-N 2.95Å; Q174-C180 HydrophobicContact CB-CB 3.91Å; Q174-C180 PolarHBondContact O-N 3.08Å
175	I	94.5	Very high	94.7	Very high	22 Å²	22	47.5 Å²	47.5	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-47.8	174.9	-65.7	167.3	0	0	0	111.2	L165 L171 H173 N177 K178 C180 M198 N201	L165-I175 HydrophobicContact CD2-CD1 3.77Å; L171-I175 HydrophobicContact CD1-CD1 3.96Å; L171-I175 HydrophobicContact CD1-CG1 4.08Å; L171-I175 HydrophobicContact CD2-CD1 4.38Å; L171-I175 HydrophobicContact CG-CD1 3.83Å; L171-I175 HydrophobicContact CG-CG1 4.38Å; L171-I175 WeakPolarHBondContact O-CG1 3.3Å; L171-I175 PolarHBondContact O-N 3.13Å; H173-I175 VanDerWaalsContact C-N 3.32Å; H173-I175 PolarHBondContact O-N 2.93Å; I175-N177 VanDerWaalsContact C-N 3.26Å; I175-N177 PolarHBondContact O-N 3.41Å; I175-K178 PolarHBondContact O-N 3.02Å; I175-K178 VanDerWaalsContact O-N 3.12Å; I175-C180 VanDerWaalsContact CA-SG 3.55Å; I175-C180 HydrophobicContact CG1-CB 4.09Å; I175-M198 HydrophobicContact CD1-CE 4.01Å; I175-M198 HydrophobicContact CG1-CE 4.39Å; I175-N201 HydrophobicContact CG2-CB 4.09Å
176	R	93.9	Very high	94.2	Very high	142 Å²	142	46.3 Å²	46.3	54%	0.536	21%	0.213	S	C	.	.	H	α-helix	trans	-58.2	-39.2	178.1	-74.2	-174	-61.8	-102.3	8.9	112.1	D167 A172 H173 K178	D167-R176 IonicContact OD1-CZ 3.68Å; D167-R176 IonicContact OD1-NH1 3.37Å; D167-R176 PolarHBondContact OD1-NH1 3.13Å; D167-R176 IonicContact OD1-NH2 2.96Å; D167-R176 PolarHBondContact OD1-NH2 3.39Å; A172-R176 WeakPolarHBondContact O-CG 3.37Å; A172-R176 PolarHBondContact O-N 2.51Å; H173-R176 PolarHBondContact O-N 2.79Å; R176-K178 VanDerWaalsContact C-N 3.34Å
177	N	94.8	Very high	93.1	Very high	74 Å²	74	50.2 Å²	50.2	40%	0.396	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.6	-179.3	-64.2	-15.5	0	0	0	114.4	H173 Q174 I175 Q179	H173-N177 PolarHBondContact CD2-ND2 3.2Å; H173-N177 PolarHBondContact CE1-ND2 3.34Å; H173-N177 PolarHBondContact NE2-ND2 3.16Å; H173-N177 PolarHBondContact O-N 3.44Å; Q174-N177 PolarHBondContact O-N 3.12Å; I175-N177 VanDerWaalsContact C-N 3.26Å; I175-N177 PolarHBondContact O-N 3.41Å; N177-Q179 HydrophobicContact CB-CB 4.5Å; N177-Q179 HydrophobicContact CB-CG 4.33Å; N177-Q179 PolarHBondContact O-N 3.33Å
178	K	93.3	Very high	91.7	Very high	121 Å²	121	46.5 Å²	46.5	53%	0.526	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	35.2	-177.9	-45.4	-68.9	166.6	-177.6	0	112.8	Q174 I175 R176 N201	Q174-K178 PolarHBondContact O-N 3.19Å; Q174-K178 VanDerWaalsContact O-N 3.1Å; I175-K178 PolarHBondContact O-N 3.02Å; I175-K178 VanDerWaalsContact O-N 3.12Å; R176-K178 VanDerWaalsContact C-N 3.34Å; K178-N201 PolarHBondContact NZ-O 3.05Å
179	Q	93.9	Very high	90.5	Very high	131 Å²	131	43 Å²	43	61%	0.612	22%	0.216	S	C	*	.			trans	-117.3	5.3	-177.9	-74	-177.1	-25	0	0	113	Q174 N177	Q174-Q179 PolarHBondContact O-N 2.95Å; N177-Q179 HydrophobicContact CB-CB 4.5Å; N177-Q179 HydrophobicContact CB-CG 4.33Å; N177-Q179 PolarHBondContact O-N 3.33Å
180	C	95.8	Very high	89.3	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.02	26%	0.256	C	S	.	.			trans	-76.3	144.1	177.5	45.5	0	0	0	0	112.4	Q174 I175 C203 E204 D264	Q174-C180 HydrophobicContact CB-CB 3.91Å; Q174-C180 PolarHBondContact O-N 3.08Å; I175-C180 VanDerWaalsContact CA-SG 3.55Å; I175-C180 HydrophobicContact CG1-CB 4.09Å; C180-C203 HydrophobicContact CB-CB 3.9Å; C180-C203 WeakPolarHBondContact CB-SG 3.41Å; C180-C203 CarbonylContact O-C 3.58Å; C180-C203 VanDerWaalsContact O-CA 3.27Å; C180-C203 WeakPolarHBondContact O-CA 3.48Å; C180-C203 WeakPolarHBondContact O-CB 3.31Å; C180-C203 WeakPolarHBondContact SG-CA 3.41Å; C180-C203 WeakPolarHBondContact SG-CB 3.48Å; C180-C203 CovalentContact SG-SG 2.02Å; C180-C203 PolarHBondContact SG-SG 2.85Å; C180-E204 PolarHBondContact O-N 2.99Å; C180-D264 VanDerWaalsContact CA-OD2 3.25Å; C180-D264 WeakPolarHBondContact CA-OD2 3.41Å
181	R	97.7	Very high	88.9	Confident	58 Å²	58	51.4 Å²	51.4	22%	0.219	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.6	172.7	-172.5	173	-68.9	115.1	-0.5	111.9	Y183 E204 K262 I263 D264 I265	R181-Y183 HydrophobicContact CG-CD1 4.21Å; R181-Y183 HydrophobicContact CG-CE1 4.15Å; R181-E204 CarbonylContact C-O 3.58Å; R181-E204 VanDerWaalsContact CA-O 3.31Å; R181-E204 WeakPolarHBondContact CA-O 3.49Å; R181-E204 IonicContact CZ-OE2 2.7Å; R181-E204 IonicContact NE-OE2 3.86Å; R181-E204 PolarHBondContact NE-OE2 3.5Å; R181-E204 IonicContact NH2-OE2 2.5Å; R181-E204 PolarHBondContact NH2-OE2 3.43Å; R181-K262 PolarHBondContact NH1-O 3.08Å; R181-I263 HydrophobicContact CG-CG2 4.14Å; R181-D264 PolarHBondContact N-OD2 2.59Å; R181-D264 PolarHBondContact O-N 3.02Å; R181-I265 PolarHBondContact O-N 2.96Å
182	L	97.7	Very high	88.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.2	176.5	166.4	64.9	0	0	0	109.8	F194 M198 E204 V205 H206 I265 K267	L182-F194 HydrophobicContact CD1-CE1 3.9Å; L182-F194 HydrophobicContact CD2-CD1 4.11Å; L182-F194 HydrophobicContact CD2-CE1 3.71Å; L182-M198 HydrophobicContact CD2-CB 3.79Å; L182-M198 HydrophobicContact CD2-CG 3.91Å; L182-E204 PolarHBondContact N-O 2.9Å; L182-V205 HydrophobicContact CB-CG1 4.33Å; L182-V205 HydrophobicContact CB-CG2 4.17Å; L182-V205 HydrophobicContact CD2-CG1 3.75Å; L182-V205 HydrophobicContact CD2-CG2 4.07Å; L182-V205 HydrophobicContact CG-CG1 4.03Å; L182-V205 WeakPolarHBondContact O-CA 3.29Å; L182-H206 PolarHBondContact O-N 2.72Å; L182-I265 WeakPolarHBondContact CA-O 3.19Å; L182-I265 HydrophobicContact CD1-CB 3.6Å; L182-I265 HydrophobicContact CD1-CG2 3.46Å; L182-I265 VanDerWaalsContact CD1-CG2 3.46Å; L182-K267 HydrophobicContact CD1-CB 4.33Å
183	Y	97.9	Very high	88.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.2	164.5	-88.3	38	0	0	0	109	R181 H206 F208 L251 I254 L255 F258 H260 I263 I265 L266 K267	R181-Y183 HydrophobicContact CG-CD1 4.21Å; R181-Y183 HydrophobicContact CG-CE1 4.15Å; Y183-H206 WeakPolarHBondContact CA-O 3.32Å; Y183-H206 HydrophobicContact CD1-CB 3.82Å; Y183-H206 AromaticContact CD1-CD2 3.9Å; Y183-H206 HydrophobicContact CE1-CB 3.74Å; Y183-H206 AromaticContact CE1-CD2 3.39Å; Y183-H206 WeakPolarHBondContact CE1-CD2 3.49Å; Y183-H206 AromaticContact CE1-CG 3.66Å; Y183-H206 HydrophobicContact CG-CB 4.42Å; Y183-F208 HydrophobicContact CD1-CE2 4.35Å; Y183-F208 HydrophobicContact CD2-CD2 4.3Å; Y183-F208 AromaticContact CD2-CE2 3.28Å; Y183-F208 HydrophobicContact CD2-CE2 3.28Å; Y183-F208 AromaticContact CD2-CZ 3.71Å; Y183-F208 HydrophobicContact CD2-CZ 3.71Å; Y183-F208 AromaticContact CE2-CE2 3.52Å; Y183-F208 HydrophobicContact CE2-CE2 3.52Å; Y183-F208 AromaticContact CE2-CZ 3.39Å; Y183-F208 HydrophobicContact CE2-CZ 3.39Å; Y183-F208 AromaticContact CG-CE2 3.74Å; Y183-F208 HydrophobicContact CG-CE2 3.74Å; Y183-F208 HydrophobicContact CG-CZ 4.43Å; Y183-F208 AromaticContact CZ-CZ 3.86Å; Y183-L251 HydrophobicContact CD2-CD1 3.61Å; Y183-L251 HydrophobicContact CE2-CD1 3.98Å; Y183-I254 HydrophobicContact CE2-CG2 3.95Å; Y183-L255 HydrophobicContact CD2-CD2 4.35Å; Y183-L255 HydrophobicContact CE2-CD2 3.74Å; Y183-L255 HydrophobicContact CE2-CG 4.43Å; Y183-F258 VanDerWaalsContact OH-CD2 3.28Å; Y183-F258 WeakPolarHBondContact OH-CD2 3.26Å; Y183-H260 AromaticContact CE1-ND1 3.65Å; Y183-H260 AromaticContact CZ-ND1 3.61Å; Y183-H260 PolarHBondContact OH-ND1 3.23Å; Y183-I263 HydrophobicContact CD1-CG2 3.72Å; Y183-I263 HydrophobicContact CE1-CG2 3.9Å; Y183-I263 HydrophobicContact CG-CD1 4.29Å; Y183-I263 HydrophobicContact CG-CG2 4.14Å; Y183-I265 PolarHBondContact N-O 3.14Å; Y183-L266 WeakPolarHBondContact O-CA 3.25Å; Y183-K267 PolarHBondContact O-N 3.46Å
184	S	95.8	Very high	88.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.007	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.3	174.6	-174.6	0	0	0	0	110.3	E195 H206 R207 F208 K267	S184-E195 VanDerWaalsContact CB-OE1 3.27Å; S184-E195 WeakPolarHBondContact CB-OE1 3.48Å; S184-E195 PolarHBondContact OG-OE1 3.21Å; S184-H206 PolarHBondContact N-O 2.89Å; S184-R207 WeakPolarHBondContact O-CA 3.36Å; S184-F208 PolarHBondContact O-N 2.82Å; S184-K267 PolarHBondContact OG-NZ 2.7Å
185	L	94.1	Very high	88.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.3	-178.8	-41.1	-177.7	0	0	0	108.2	F208 I230 L266 K267 A268 D269 L270	L185-F208 HydrophobicContact CD2-CB 4.35Å; L185-F208 HydrophobicContact CD2-CD2 3.48Å; L185-F208 VanDerWaalsContact CD2-CD2 3.48Å; L185-F208 HydrophobicContact CD2-CE2 4.14Å; L185-F208 HydrophobicContact CD2-CG 4.14Å; L185-I230 HydrophobicContact CB-CG1 3.89Å; L185-I230 HydrophobicContact CD1-CB 4.29Å; L185-I230 HydrophobicContact CD1-CG1 3.81Å; L185-I230 HydrophobicContact CD1-CG2 4.04Å; L185-I230 HydrophobicContact CD2-CD1 3.83Å; L185-I230 HydrophobicContact CD2-CG1 3.55Å; L185-I230 HydrophobicContact CG-CG1 3.91Å; L185-L266 HydrophobicContact CD1-CD1 3.71Å; L185-L266 HydrophobicContact CD1-CG 4.45Å; L185-L266 HydrophobicContact CD2-CD1 4.1Å; L185-L266 HydrophobicContact CG-CD1 3.77Å; L185-K267 PolarHBondContact N-O 3.26Å; L185-A268 HydrophobicContact CB-CB 4.43Å; L185-A268 HydrophobicContact CD1-CB 4.31Å; L185-D269 PolarHBondContact O-N 2.95Å; L185-L270 HydrophobicContact CB-CD2 3.93Å
186	G	84.6	Confident	88	Confident	14 Å²	14	53.7 Å²	53.7	14%	0.144	28%	0.277	C	S	.	.			trans	-150.7	159.7	-177	0	0	0	0	0	113.1	F208 D269	G186-F208 PolarHBondContact N-O 3.3Å; G186-D269 WeakPolarHBondContact CA-O 3.23Å
187	L	72.4	Confident	87.9	Confident	90 Å²	90	48 Å²	48	47%	0.471	26%	0.259	S	S	.	.	S	Bend	trans	-102.5	40	178.9	-63.1	177.9	0	0	0	113	E271	L187-E271 HydrophobicContact CD1-CB 3.99Å; L187-E271 HydrophobicContact CD1-CG 3.87Å
188	G	63.4	Low	87.9	Confident	27 Å²	27	44.6 Å²	44.6	28%	0.278	24%	0.24	S	C	.	.	S	Bend	trans	88	32.8	172.8	0	0	0	0	0	115.8	D209	G188-D209 WeakPolarHBondContact CA-OD2 3.45Å
189	S	68.6	Low	87.9	Confident	64 Å²	64	38.9 Å²	38.9	45%	0.448	22%	0.216	S	C	.	.			trans	-68.6	135.2	172.5	177	0	0	0	0	111.4	D191 R207	S189-D191 PolarHBondContact O-N 2.78Å; S189-D191 PolarHBondContact OG-N 3.2Å; S189-R207 PolarHBondContact O-NH2 3.26Å
190	D	69.4	Low	87.9	Confident	161 Å²	161	38.4 Å²	38.4	86%	0.861	22%	0.217	S	C	*	.	S	Bend	trans	-68.5	-13.7	174	-66.2	-33.4	0	0	0	112.8	T192	D190-T192 PolarHBondContact O-N 3.33Å; D190-T192 VanDerWaalsContact O-N 3.16Å
191	D	81.8	Confident	87.7	Confident	49 Å²	49	41.2 Å²	41.2	26%	0.262	23%	0.232	S	C	.	.			trans	-72.8	107.8	173.7	-169.4	4.2	0	0	0	110.4	S189 H193 R207	S189-D191 PolarHBondContact O-N 2.78Å; S189-D191 PolarHBondContact OG-N 3.2Å; D191-H193 PolarHBondContact OD1-N 3.4Å; D191-R207 PolarHBondContact O-NH1 3.3Å; D191-R207 VanDerWaalsContact O-NH1 3.16Å
192	T	87.3	Confident	87.4	Confident	42 Å²	42	38.7 Å²	38.7	26%	0.258	22%	0.224	S	C	.	.			trans	-121.6	4.2	-177.6	53.6	0	0	0	0	111.9	D190 F194 E195 V196 Y225	D190-T192 PolarHBondContact O-N 3.33Å; D190-T192 VanDerWaalsContact O-N 3.16Å; T192-F194 VanDerWaalsContact C-N 3.3Å; T192-F194 PolarHBondContact O-N 3.28Å; T192-E195 VanDerWaalsContact CA-OE2 3.31Å; T192-E195 WeakPolarHBondContact CA-OE2 3.33Å; T192-E195 PolarHBondContact O-N 3.48Å; T192-V196 WeakPolarHBondContact O-CB 3.48Å; T192-V196 WeakPolarHBondContact O-CG2 3.43Å; T192-V196 PolarHBondContact O-N 2.93Å; T192-Y225 WeakPolarHBondContact CG2-OH 3.28Å
193	H	88.9	Confident	87.3	Confident	94 Å²	94	38.7 Å²	38.7	44%	0.435	22%	0.224	S	C	.	.	H	α-helix	trans	-59.6	-43.8	-168.1	-178	-85.9	0	0	0	111.4	D148 D191 V196 S197	D148-H193 PolarHBondContact O-CE1 3.26Å; D148-H193 IonicContact OD1-CE1 2.73Å; D148-H193 IonicContact OD1-ND1 3.08Å; D148-H193 PolarHBondContact OD1-ND1 2.82Å; D148-H193 IonicContact OD2-CE1 3.72Å; D148-H193 IonicContact OD2-CG 2.73Å; D148-H193 IonicContact OD2-ND1 3.87Å; D148-H193 PolarHBondContact OD2-ND1 3.39Å; D191-H193 PolarHBondContact OD1-N 3.4Å; H193-V196 PolarHBondContact O-N 3.16Å; H193-S197 WeakPolarHBondContact O-CB 3.43Å; H193-S197 PolarHBondContact O-N 2.95Å
194	F	91.3	Very high	87.3	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-47.4	178.1	-179.5	-106.7	0	0	0	112.5	D148 W161 V163 L182 T192 V196 S197 M198 I265 K267 I294	D148-F194 HydrophobicContact CB-CD2 4.31Å; D148-F194 WeakPolarHBondContact OD2-CA 3.3Å; D148-F194 VanDerWaalsContact OD2-CB 3.29Å; D148-F194 WeakPolarHBondContact OD2-CB 3.29Å; D148-F194 PolarHBondContact OD2-N 3.28Å; W161-F194 HydrophobicContact CB-CB 4.15Å; W161-F194 HydrophobicContact CB-CD1 4.17Å; W161-F194 HydrophobicContact CB-CD2 3.54Å; W161-F194 HydrophobicContact CB-CE1 4.47Å; W161-F194 HydrophobicContact CB-CE2 3.89Å; W161-F194 HydrophobicContact CB-CG 3.68Å; W161-F194 HydrophobicContact CB-CZ 4.34Å; W161-F194 HydrophobicContact CG-CB 4.19Å; W161-F194 HydrophobicContact CG-CD2 4.44Å; W161-F194 HydrophobicContact CG-CG 4.14Å; W161-F194 VanDerWaalsContact O-CE2 3.23Å; W161-F194 WeakPolarHBondContact O-CE2 3.37Å; V163-F194 HydrophobicContact CG1-CE2 4.11Å; V163-F194 HydrophobicContact CG1-CZ 3.84Å; L182-F194 HydrophobicContact CD1-CE1 3.9Å; L182-F194 HydrophobicContact CD2-CD1 4.11Å; L182-F194 HydrophobicContact CD2-CE1 3.71Å; T192-F194 VanDerWaalsContact C-N 3.3Å; T192-F194 PolarHBondContact O-N 3.28Å; F194-V196 PolarHBondContact O-N 3.17Å; F194-S197 PolarHBondContact O-N 3.36Å; F194-M198 HydrophobicContact CD2-CG 4.35Å; F194-M198 HydrophobicContact CE1-CG 4.25Å; F194-M198 HydrophobicContact CE2-CG 4.01Å; F194-M198 HydrophobicContact CE2-SD 4.29Å; F194-M198 HydrophobicContact CZ-CG 3.96Å; F194-M198 HydrophobicContact CZ-SD 4.42Å; F194-M198 WeakPolarHBondContact O-CB 3.39Å; F194-M198 VanDerWaalsContact O-CG 3.26Å; F194-M198 WeakPolarHBondContact O-CG 3.45Å; F194-M198 PolarHBondContact O-N 3.13Å; F194-I265 HydrophobicContact CZ-CG2 4.48Å; F194-K267 HydrophobicContact CD1-CD 3.5Å; F194-K267 VanDerWaalsContact CD1-CD 3.5Å; F194-K267 HydrophobicContact CE1-CB 4.38Å; F194-K267 HydrophobicContact CE1-CD 3.86Å; F194-K267 HydrophobicContact CG-CD 4.43Å; F194-I294 HydrophobicContact CZ-CD1 4.21Å
195	E	93.5	Very high	87.3	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-44.1	179	-68.2	77.6	-170	0	0	111.7	S184 T192 M198 A199 V205 R207 L223 K267	S184-E195 VanDerWaalsContact CB-OE1 3.27Å; S184-E195 WeakPolarHBondContact CB-OE1 3.48Å; S184-E195 PolarHBondContact OG-OE1 3.21Å; T192-E195 VanDerWaalsContact CA-OE2 3.31Å; T192-E195 WeakPolarHBondContact CA-OE2 3.33Å; T192-E195 PolarHBondContact O-N 3.48Å; E195-M198 PolarHBondContact O-N 2.68Å; E195-A199 WeakPolarHBondContact O-CB 3.21Å; E195-A199 PolarHBondContact O-N 3.15Å; E195-V205 HydrophobicContact CB-CG1 3.99Å; E195-V205 HydrophobicContact CG-CG1 4.12Å; E195-R207 IonicContact OE2-NH1 3.68Å; E195-L223 HydrophobicContact CB-CD1 4.11Å; E195-K267 WeakPolarHBondContact OE1-CD 3.33Å; E195-K267 WeakPolarHBondContact OE1-CE 3.34Å; E195-K267 IonicContact OE1-NZ 3.02Å; E195-K267 PolarHBondContact OE1-NZ 3.22Å
196	V	92.6	Very high	87.5	Confident	53 Å²	53	41.7 Å²	41.7	32%	0.321	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-45.1	177.9	171.4	0	0	0	0	110.6	T192 H193 F194 M198 A199 N200 L223	T192-V196 WeakPolarHBondContact O-CB 3.48Å; T192-V196 WeakPolarHBondContact O-CG2 3.43Å; T192-V196 PolarHBondContact O-N 2.93Å; H193-V196 PolarHBondContact O-N 3.16Å; F194-V196 PolarHBondContact O-N 3.17Å; V196-M198 PolarHBondContact O-N 3.18Å; V196-A199 PolarHBondContact O-N 3.22Å; V196-N200 WeakPolarHBondContact O-CB 3.47Å; V196-N200 PolarHBondContact O-N 3.42Å; V196-N200 PolarHBondContact O-ND2 2.64Å; V196-L223 HydrophobicContact CG2-CD2 4.09Å
197	S	91.6	Very high	88	Confident	23 Å²	23	41.7 Å²	41.7	16%	0.161	23%	0.234	C	C	.	.	H	α-helix	trans	-57	-47.3	176.2	177.9	0	0	0	0	111.5	D148 H193 F194 N200 N201	D148-S197 VanDerWaalsContact OD1-CB 3.3Å; D148-S197 WeakPolarHBondContact OD1-CB 3.45Å; D148-S197 PolarHBondContact OD1-OG 2.93Å; H193-S197 WeakPolarHBondContact O-CB 3.43Å; H193-S197 PolarHBondContact O-N 2.95Å; F194-S197 PolarHBondContact O-N 3.36Å; S197-N200 PolarHBondContact O-N 3.02Å; S197-N201 PolarHBondContact O-N 2.94Å; S197-N201 PolarHBondContact O-ND2 2.84Å
198	M	93.4	Very high	89	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-38.4	178.8	-66.9	-62.7	-56.8	0	0	112.6	I175 L182 F194 E195 V196 N201 G202 C203 V205 I265	I175-M198 HydrophobicContact CD1-CE 4.01Å; I175-M198 HydrophobicContact CG1-CE 4.39Å; L182-M198 HydrophobicContact CD2-CB 3.79Å; L182-M198 HydrophobicContact CD2-CG 3.91Å; F194-M198 HydrophobicContact CD2-CG 4.35Å; F194-M198 HydrophobicContact CE1-CG 4.25Å; F194-M198 HydrophobicContact CE2-CG 4.01Å; F194-M198 HydrophobicContact CE2-SD 4.29Å; F194-M198 HydrophobicContact CZ-CG 3.96Å; F194-M198 HydrophobicContact CZ-SD 4.42Å; F194-M198 WeakPolarHBondContact O-CB 3.39Å; F194-M198 VanDerWaalsContact O-CG 3.26Å; F194-M198 WeakPolarHBondContact O-CG 3.45Å; F194-M198 PolarHBondContact O-N 3.13Å; E195-M198 PolarHBondContact O-N 2.68Å; V196-M198 PolarHBondContact O-N 3.18Å; M198-N201 CarbonylContact O-C 3.56Å; M198-N201 PolarHBondContact O-N 2.85Å; M198-G202 PolarHBondContact O-N 2.87Å; M198-C203 HydrophobicContact CE-CB 4.49Å; M198-C203 WeakPolarHBondContact CE-SG 3.4Å; M198-C203 WeakPolarHBondContact O-CB 3.45Å; M198-C203 PolarHBondContact O-N 2.87Å; M198-V205 HydrophobicContact CB-CG2 4.11Å; M198-I265 HydrophobicContact CE-CD1 3.37Å; M198-I265 HydrophobicContact SD-CD1 4.45Å
199	A	94.9	Very high	90.2	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-40.3	174.7	0	0	0	0	0	112.3	E195 V196 N201 G202 V205 H222 L223	E195-A199 WeakPolarHBondContact O-CB 3.21Å; E195-A199 PolarHBondContact O-N 3.15Å; V196-A199 PolarHBondContact O-N 3.22Å; A199-N201 VanDerWaalsContact C-N 3.28Å; A199-N201 PolarHBondContact O-N 2.85Å; A199-G202 WeakPolarHBondContact O-CA 3.27Å; A199-G202 PolarHBondContact O-N 2.85Å; A199-V205 HydrophobicContact CB-CB 4.44Å; A199-V205 HydrophobicContact CB-CG2 3.81Å; A199-H222 HydrophobicContact CB-CB 4.24Å; A199-H222 PolarHBondContact O-ND1 2.9Å; A199-L223 HydrophobicContact CB-CB 4.05Å
200	N	92.9	Very high	91.1	Very high	120 Å²	120	35.7 Å²	35.7	64%	0.642	19%	0.194	S	C	*	.	H	α-helix	trans	-66.1	-32.4	175.4	-72.2	-17.7	0	0	0	112	V196 S197 G202	V196-N200 WeakPolarHBondContact O-CB 3.47Å; V196-N200 PolarHBondContact O-N 3.42Å; V196-N200 PolarHBondContact O-ND2 2.64Å; S197-N200 PolarHBondContact O-N 3.02Å; N200-G202 PolarHBondContact O-N 3.37Å
201	N	91	Very high	91.8	Very high	62 Å²	62	32 Å²	32	33%	0.332	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-0.2	170.5	-77.3	-76.1	0	0	0	113.2	I175 K178 S197 M198 A199	I175-N201 HydrophobicContact CG2-CB 4.09Å; K178-N201 PolarHBondContact NZ-O 3.05Å; S197-N201 PolarHBondContact O-N 2.94Å; S197-N201 PolarHBondContact O-ND2 2.84Å; M198-N201 CarbonylContact O-C 3.56Å; M198-N201 PolarHBondContact O-N 2.85Å; A199-N201 VanDerWaalsContact C-N 3.28Å; A199-N201 PolarHBondContact O-N 2.85Å
202	G	91.6	Very high	92	Very high	5 Å²	5	30.7 Å²	30.7	5%	0.052	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	21.2	170.7	0	0	0	0	0	115.1	M198 A199 N200	M198-G202 PolarHBondContact O-N 2.87Å; A199-G202 WeakPolarHBondContact O-CA 3.27Å; A199-G202 PolarHBondContact O-N 2.85Å; N200-G202 PolarHBondContact O-N 3.37Å
203	C	96	Very high	91.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.			trans	-80.6	144.8	166.9	-59.4	0	0	0	0	111.1	C180 M198 V205 H222	C180-C203 HydrophobicContact CB-CB 3.9Å; C180-C203 WeakPolarHBondContact CB-SG 3.41Å; C180-C203 CarbonylContact O-C 3.58Å; C180-C203 VanDerWaalsContact O-CA 3.27Å; C180-C203 WeakPolarHBondContact O-CA 3.48Å; C180-C203 WeakPolarHBondContact O-CB 3.31Å; C180-C203 WeakPolarHBondContact SG-CA 3.41Å; C180-C203 WeakPolarHBondContact SG-CB 3.48Å; C180-C203 CovalentContact SG-SG 2.02Å; C180-C203 PolarHBondContact SG-SG 2.85Å; M198-C203 HydrophobicContact CE-CB 4.49Å; M198-C203 WeakPolarHBondContact CE-SG 3.4Å; M198-C203 WeakPolarHBondContact O-CB 3.45Å; M198-C203 PolarHBondContact O-N 2.87Å; C203-V205 HydrophobicContact CB-CG2 4.31Å; C203-V205 PolarHBondContact O-N 2.91Å; C203-H222 WeakPolarHBondContact O-CB 3.31Å
204	E	97.5	Very high	91.7	Very high	59 Å²	59	36 Å²	36	28%	0.276	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	112.1	165.3	-170.1	-176.3	-163.4	0	0	109.1	C180 R181 L182 H206	C180-E204 PolarHBondContact O-N 2.99Å; R181-E204 CarbonylContact C-O 3.58Å; R181-E204 VanDerWaalsContact CA-O 3.31Å; R181-E204 WeakPolarHBondContact CA-O 3.49Å; R181-E204 IonicContact CZ-OE2 2.7Å; R181-E204 IonicContact NE-OE2 3.86Å; R181-E204 PolarHBondContact NE-OE2 3.5Å; R181-E204 IonicContact NH2-OE2 2.5Å; R181-E204 PolarHBondContact NH2-OE2 3.43Å; L182-E204 PolarHBondContact N-O 2.9Å; E204-H206 WeakPolarHBondContact CG-NE2 3.02Å; E204-H206 IonicContact OE1-CE1 3.75Å; E204-H206 IonicContact OE1-NE2 3.2Å; E204-H206 PolarHBondContact OE1-NE2 2.9Å; E204-H206 IonicContact OE2-NE2 3.97Å
205	V	97.3	Very high	91.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.6	-175.8	-175.3	0	0	0	0	109.9	L182 E195 M198 A199 C203 H222 L223 W224	L182-V205 HydrophobicContact CB-CG1 4.33Å; L182-V205 HydrophobicContact CB-CG2 4.17Å; L182-V205 HydrophobicContact CD2-CG1 3.75Å; L182-V205 HydrophobicContact CD2-CG2 4.07Å; L182-V205 HydrophobicContact CG-CG1 4.03Å; L182-V205 WeakPolarHBondContact O-CA 3.29Å; E195-V205 HydrophobicContact CB-CG1 3.99Å; E195-V205 HydrophobicContact CG-CG1 4.12Å; M198-V205 HydrophobicContact CB-CG2 4.11Å; A199-V205 HydrophobicContact CB-CB 4.44Å; A199-V205 HydrophobicContact CB-CG2 3.81Å; C203-V205 HydrophobicContact CB-CG2 4.31Å; C203-V205 PolarHBondContact O-N 2.91Å; V205-H222 PolarHBondContact N-O 2.81Å; V205-L223 HydrophobicContact CB-CD1 3.75Å; V205-L223 HydrophobicContact CG1-CD1 3.51Å; V205-W224 PolarHBondContact O-N 2.73Å
206	H	97	Very high	91.2	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.028	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.4	172.9	-61.1	-87.7	0	0	0	109.5	L182 Y183 S184 E204 F208 W224 H226 H260	L182-H206 PolarHBondContact O-N 2.72Å; Y183-H206 WeakPolarHBondContact CA-O 3.32Å; Y183-H206 HydrophobicContact CD1-CB 3.82Å; Y183-H206 AromaticContact CD1-CD2 3.9Å; Y183-H206 HydrophobicContact CE1-CB 3.74Å; Y183-H206 AromaticContact CE1-CD2 3.39Å; Y183-H206 WeakPolarHBondContact CE1-CD2 3.49Å; Y183-H206 AromaticContact CE1-CG 3.66Å; Y183-H206 HydrophobicContact CG-CB 4.42Å; S184-H206 PolarHBondContact N-O 2.89Å; E204-H206 WeakPolarHBondContact CG-NE2 3.02Å; E204-H206 IonicContact OE1-CE1 3.75Å; E204-H206 IonicContact OE1-NE2 3.2Å; E204-H206 PolarHBondContact OE1-NE2 2.9Å; E204-H206 IonicContact OE2-NE2 3.97Å; H206-F208 HydrophobicContact CB-CE2 3.71Å; H206-F208 HydrophobicContact CB-CZ 3.93Å; H206-W224 AromaticContact CE1-CD1 3.65Å; H206-W224 AromaticContact ND1-CD1 3.9Å; H206-H226 AromaticContact CG-NE2 3.63Å; H206-H226 AromaticContact ND1-CE1 3.59Å; H206-H226 AromaticContact ND1-NE2 2.89Å; H206-H226 PolarHBondContact ND1-NE2 3.35Å; H206-H260 AromaticContact CE1-CE1 3.6Å; H206-H260 AromaticContact NE2-CE1 3.28Å; H206-H260 PolarHBondContact NE2-CE1 3.47Å; H206-H260 VanDerWaalsContact NE2-CE1 3.28Å; H206-H260 AromaticContact NE2-ND1 3.98Å
207	R	95.1	Very high	91.1	Very high	13 Å²	13	43.7 Å²	43.7	5%	0.049	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.9	175.5	-178.9	168.5	160.5	139.6	-5.2	109.9	S184 S189 D191 E195 D209 W224 Y225 H226	S184-R207 WeakPolarHBondContact O-CA 3.36Å; S189-R207 PolarHBondContact O-NH2 3.26Å; D191-R207 PolarHBondContact O-NH1 3.3Å; D191-R207 VanDerWaalsContact O-NH1 3.16Å; E195-R207 IonicContact OE2-NH1 3.68Å; R207-D209 IonicContact CZ-OD2 3.63Å; R207-D209 IonicContact NE-OD2 3.18Å; R207-D209 IonicContact NH2-OD2 3.34Å; R207-D209 PolarHBondContact NH2-OD2 3.22Å; R207-W224 PolarHBondContact N-O 3.36Å; R207-Y225 HydrophobicContact CB-CD1 4.36Å; R207-Y225 VanDerWaalsContact CD-CE1 3.4Å; R207-Y225 HydrophobicContact CG-CD1 4.18Å; R207-Y225 HydrophobicContact CG-CE1 4.15Å; R207-Y225 CarbonylContact O-C 3.57Å; R207-Y225 WeakPolarHBondContact O-CA 3.38Å; R207-H226 PolarHBondContact O-N 3.16Å
208	F	93.9	Very high	91	Very high	1 Å²	1	46.7 Å²	46.7	0%	0.004	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109	-179.8	-62.7	-87	0	0	0	108.5	Y183 S184 L185 G186 H206 H226 L228 I230 I254 F258	Y183-F208 HydrophobicContact CD1-CE2 4.35Å; Y183-F208 HydrophobicContact CD2-CD2 4.3Å; Y183-F208 AromaticContact CD2-CE2 3.28Å; Y183-F208 HydrophobicContact CD2-CE2 3.28Å; Y183-F208 AromaticContact CD2-CZ 3.71Å; Y183-F208 HydrophobicContact CD2-CZ 3.71Å; Y183-F208 AromaticContact CE2-CE2 3.52Å; Y183-F208 HydrophobicContact CE2-CE2 3.52Å; Y183-F208 AromaticContact CE2-CZ 3.39Å; Y183-F208 HydrophobicContact CE2-CZ 3.39Å; Y183-F208 AromaticContact CG-CE2 3.74Å; Y183-F208 HydrophobicContact CG-CE2 3.74Å; Y183-F208 HydrophobicContact CG-CZ 4.43Å; Y183-F208 AromaticContact CZ-CZ 3.86Å; S184-F208 PolarHBondContact O-N 2.82Å; L185-F208 HydrophobicContact CD2-CB 4.35Å; L185-F208 HydrophobicContact CD2-CD2 3.48Å; L185-F208 VanDerWaalsContact CD2-CD2 3.48Å; L185-F208 HydrophobicContact CD2-CE2 4.14Å; L185-F208 HydrophobicContact CD2-CG 4.14Å; G186-F208 PolarHBondContact N-O 3.3Å; H206-F208 HydrophobicContact CB-CE2 3.71Å; H206-F208 HydrophobicContact CB-CZ 3.93Å; F208-H226 HydrophobicContact CD1-CB 3.82Å; F208-H226 HydrophobicContact CE1-CB 4.01Å; F208-H226 AromaticContact CE1-CD2 3.95Å; F208-H226 AromaticContact CE1-CG 3.97Å; F208-L228 CarbonylContact C-O 3.58Å; F208-L228 WeakPolarHBondContact CB-O 3.34Å; F208-L228 HydrophobicContact CD1-CB 4.16Å; F208-L228 HydrophobicContact CD1-CD2 3.86Å; F208-L228 HydrophobicContact CD1-CG 4.49Å; F208-L228 HydrophobicContact CE1-CD2 4.06Å; F208-I230 HydrophobicContact CB-CD1 4.23Å; F208-I230 HydrophobicContact CB-CG1 4.34Å; F208-I230 HydrophobicContact CD1-CD1 4.31Å; F208-I230 HydrophobicContact CG-CD1 4.1Å; F208-I254 HydrophobicContact CD1-CD1 4.47Å; F208-I254 HydrophobicContact CE1-CD1 4.37Å; F208-I254 HydrophobicContact CE1-CG2 3.51Å; F208-I254 HydrophobicContact CZ-CG2 3.62Å; F208-F258 AromaticContact CE1-CE2 3.81Å; F208-F258 HydrophobicContact CE1-CE2 3.81Å; F208-F258 HydrophobicContact CE1-CZ 4.12Å; F208-F258 AromaticContact CZ-CE2 3.85Å; F208-F258 HydrophobicContact CZ-CE2 3.85Å
209	D	88.9	Confident	90.7	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.027	29%	0.286	C	S	.	.			trans	-142.6	108	-171.9	-172.8	-25.3	0	0	0	109.7	G188 R207 S211 V212 H226 R227 L228	G188-D209 WeakPolarHBondContact CA-OD2 3.45Å; R207-D209 IonicContact CZ-OD2 3.63Å; R207-D209 IonicContact NE-OD2 3.18Å; R207-D209 IonicContact NH2-OD2 3.34Å; R207-D209 PolarHBondContact NH2-OD2 3.22Å; D209-S211 PolarHBondContact O-N 3.16Å; D209-S211 VanDerWaalsContact O-N 3.14Å; D209-S211 VanDerWaalsContact OD1-CB 3.25Å; D209-S211 WeakPolarHBondContact OD1-CB 3.46Å; D209-S211 PolarHBondContact OD1-N 2.67Å; D209-S211 PolarHBondContact OD1-OG 3.2Å; D209-V212 HydrophobicContact CB-CG1 4.08Å; D209-V212 WeakPolarHBondContact O-CG2 3.41Å; D209-V212 PolarHBondContact O-N 2.5Å; D209-H226 PolarHBondContact N-O 2.98Å; D209-R227 WeakPolarHBondContact O-CA 3.23Å; D209-L228 PolarHBondContact N-O 3.01Å
210	P	87.1	Confident	90.3	Very high	49 Å²	49	54.8 Å²	54.8	32%	0.318	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-12.2	-176.4	28.5	-35.3	0	0	0	113.9
211	S	84.1	Confident	90	Very high	85 Å²	85	56.8 Å²	56.8	59%	0.594	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-19.8	-177.2	76.1	0	0	0	0	113.6	D209	D209-S211 PolarHBondContact O-N 3.16Å; D209-S211 VanDerWaalsContact O-N 3.14Å; D209-S211 VanDerWaalsContact OD1-CB 3.25Å; D209-S211 WeakPolarHBondContact OD1-CB 3.46Å; D209-S211 PolarHBondContact OD1-N 2.67Å; D209-S211 PolarHBondContact OD1-OG 3.2Å
212	V	85.4	Confident	90.1	Very high	20 Å²	20	56.7 Å²	56.7	12%	0.121	30%	0.304	C	S	.	.	S	Bend	trans	-67.9	149.9	-177.6	-54	0	0	0	0	111.8	D209 I217 Y225 R227	D209-V212 HydrophobicContact CB-CG1 4.08Å; D209-V212 WeakPolarHBondContact O-CG2 3.41Å; D209-V212 PolarHBondContact O-N 2.5Å; V212-I217 HydrophobicContact CB-CD1 4.35Å; V212-Y225 HydrophobicContact CG1-CD1 3.82Å; V212-Y225 HydrophobicContact CG1-CG 4.4Å; V212-R227 HydrophobicContact CG2-CB 3.58Å; V212-R227 HydrophobicContact CG2-CG 4.09Å; V212-R227 WeakPolarHBondContact O-CD 3.46Å; V212-R227 VanDerWaalsContact O-CG 3.22Å; V212-R227 WeakPolarHBondContact O-CG 3.36Å; V212-R227 PolarHBondContact O-NE 2.61Å
213	K	84	Confident	90.3	Very high	185 Å²	185	56.6 Å²	56.6	80%	0.804	30%	0.302	S	S	*	.	S	Bend	trans	-74.9	-42.7	-168.5	-65.8	178.4	-177.2	171.2	0	112.9	R227	K213-R227 PolarHBondContact O-NH1 2.86Å
214	S	85.9	Confident	90.3	Very high	64 Å²	64	60.7 Å²	60.7	45%	0.448	32%	0.317	S	S	.	.	S	Bend	trans	-101.7	155.5	-175.2	-54.5	0	0	0	0	111.4	H216 R227	S214-H216 VanDerWaalsContact C-N 3.32Å; S214-H216 PolarHBondContact O-N 3.18Å; S214-R227 VanDerWaalsContact O-CB 3.31Å; S214-R227 WeakPolarHBondContact O-CB 3.32Å
215	A	85.5	Confident	90.1	Very high	60 Å²	60	59.1 Å²	59.1	50%	0.496	31%	0.309	S	S	.	.	S	Bend	trans	-56.9	-44.7	-178.1	0	0	0	0	0	112.8	H226 R227	A215-H226 WeakPolarHBondContact O-CA 3.29Å; A215-R227 PolarHBondContact O-N 3.02Å
216	H	89.3	Confident	90	Very high	106 Å²	106	59.5 Å²	59.5	49%	0.491	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	131.4	176.7	-57.1	-53.3	0	0	0	109.2	S214 Y225 H226	S214-H216 VanDerWaalsContact C-N 3.32Å; S214-H216 PolarHBondContact O-N 3.18Å; H216-Y225 CarbonylContact C-O 3.59Å; H216-Y225 VanDerWaalsContact CA-O 3.31Å; H216-Y225 WeakPolarHBondContact CA-O 3.5Å; H216-H226 AromaticContact CE1-ND1 3.37Å; H216-H226 PolarHBondContact CE1-ND1 3.08Å; H216-H226 AromaticContact CG-ND1 3.99Å; H216-H226 AromaticContact ND1-CE1 3.77Å; H216-H226 AromaticContact ND1-CG 3.76Å; H216-H226 AromaticContact ND1-ND1 2.87Å; H216-H226 PolarHBondContact ND1-ND1 3.48Å
217	I	90.1	Very high	89.7	Confident	50 Å²	50	64.6 Å²	64.6	26%	0.256	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.6	175.4	-56.9	174.6	0	0	0	107.2	V212 W224 Y225	V212-I217 HydrophobicContact CB-CD1 4.35Å; I217-W224 CarbonylContact O-C 3.57Å; I217-W224 WeakPolarHBondContact O-CA 3.37Å; I217-Y225 PolarHBondContact N-O 3.25Å; I217-Y225 PolarHBondContact O-N 3.23Å
218	L	90.2	Very high	89.5	Confident	86 Å²	86	65.2 Å²	65.2	45%	0.45	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	104.6	166.1	-175.2	66.8	0	0	0	107.1	S220 W224	L218-S220 WeakPolarHBondContact CD1-O 3.42Å; L218-S220 WeakPolarHBondContact CG-O 3.49Å; L218-W224 HydrophobicContact CB-CE3 3.98Å; L218-W224 HydrophobicContact CB-CH2 4.28Å; L218-W224 HydrophobicContact CB-CZ3 3.82Å; L218-W224 HydrophobicContact CD1-CD2 3.61Å; L218-W224 HydrophobicContact CD1-CE3 3.88Å; L218-W224 HydrophobicContact CD1-CG 4.16Å; L218-W224 HydrophobicContact CD1-CH2 4.02Å; L218-W224 HydrophobicContact CD1-CZ2 3.77Å; L218-W224 HydrophobicContact CD1-CZ3 4.08Å; L218-W224 HydrophobicContact CD2-CH2 4.26Å; L218-W224 HydrophobicContact CD2-CZ2 4.47Å; L218-W224 HydrophobicContact CG-CH2 4.44Å; L218-W224 HydrophobicContact CG-CZ3 4.41Å
219	E	86.2	Confident	89.3	Confident	128 Å²	128	66.2 Å²	66.2	60%	0.598	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	-37.9	-177.8	-171.3	68	-165.3	0	0	110.9	L223 Y225	E219-L223 HydrophobicContact CB-CD2 4.4Å; E219-L223 HydrophobicContact CB-CG 4.42Å; E219-L223 PolarHBondContact N-O 2.73Å; E219-Y225 HydrophobicContact CB-CD2 3.7Å; E219-Y225 HydrophobicContact CB-CE2 3.53Å; E219-Y225 HydrophobicContact CG-CD2 4.42Å; E219-Y225 HydrophobicContact CG-CE2 3.85Å
220	S	86.6	Confident	89.5	Confident	47 Å²	47	66.6 Å²	66.6	33%	0.329	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	172.7	174.8	77.1	0	0	0	0	110.2	L218 H222 L223	L218-S220 WeakPolarHBondContact CD1-O 3.42Å; L218-S220 WeakPolarHBondContact CG-O 3.49Å; S220-H222 PolarHBondContact O-N 3.07Å; S220-L223 PolarHBondContact O-N 2.99Å; S220-L223 VanDerWaalsContact OG-CB 3.3Å; S220-L223 WeakPolarHBondContact OG-CB 3.39Å
221	Q	87.2	Confident	89.7	Confident	162 Å²	162	66.2 Å²	66.2	76%	0.757	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-27.4	-171.1	-171.8	175.7	-4.5	0	0	115.1
222	H	94.2	Very high	90	Very high	60 Å²	60	64.1 Å²	64.1	28%	0.278	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130	13.1	179.1	-47.5	101.5	0	0	0	114.3	A199 C203 V205 S220	A199-H222 HydrophobicContact CB-CB 4.24Å; A199-H222 PolarHBondContact O-ND1 2.9Å; C203-H222 WeakPolarHBondContact O-CB 3.31Å; V205-H222 PolarHBondContact N-O 2.81Å; S220-H222 PolarHBondContact O-N 3.07Å
223	L	95.6	Very high	90.2	Very high	3 Å²	3	69.4 Å²	69.4	2%	0.016	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	108.4	-176.6	-179.3	58.6	0	0	0	111.6	E195 V196 A199 V205 E219 S220 Y225	E195-L223 HydrophobicContact CB-CD1 4.11Å; V196-L223 HydrophobicContact CG2-CD2 4.09Å; A199-L223 HydrophobicContact CB-CB 4.05Å; V205-L223 HydrophobicContact CB-CD1 3.75Å; V205-L223 HydrophobicContact CG1-CD1 3.51Å; E219-L223 HydrophobicContact CB-CD2 4.4Å; E219-L223 HydrophobicContact CB-CG 4.42Å; E219-L223 PolarHBondContact N-O 2.73Å; S220-L223 PolarHBondContact O-N 2.99Å; S220-L223 VanDerWaalsContact OG-CB 3.3Å; S220-L223 WeakPolarHBondContact OG-CB 3.39Å; L223-Y225 HydrophobicContact CD1-CE2 4.36Å; L223-Y225 HydrophobicContact CD2-CE2 3.74Å; L223-Y225 HydrophobicContact CG-CD2 4.29Å; L223-Y225 HydrophobicContact CG-CE2 3.77Å
224	W	95.4	Very high	90.2	Very high	85 Å²	85	63.5 Å²	63.5	32%	0.322	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.1	176.8	-60.4	94.3	0	0	0	111.2	V205 H206 R207 I217 L218 H226	V205-W224 PolarHBondContact O-N 2.73Å; H206-W224 AromaticContact CE1-CD1 3.65Å; H206-W224 AromaticContact ND1-CD1 3.9Å; R207-W224 PolarHBondContact N-O 3.36Å; I217-W224 CarbonylContact O-C 3.57Å; I217-W224 WeakPolarHBondContact O-CA 3.37Å; L218-W224 HydrophobicContact CB-CE3 3.98Å; L218-W224 HydrophobicContact CB-CH2 4.28Å; L218-W224 HydrophobicContact CB-CZ3 3.82Å; L218-W224 HydrophobicContact CD1-CD2 3.61Å; L218-W224 HydrophobicContact CD1-CE3 3.88Å; L218-W224 HydrophobicContact CD1-CG 4.16Å; L218-W224 HydrophobicContact CD1-CH2 4.02Å; L218-W224 HydrophobicContact CD1-CZ2 3.77Å; L218-W224 HydrophobicContact CD1-CZ3 4.08Å; L218-W224 HydrophobicContact CD2-CH2 4.26Å; L218-W224 HydrophobicContact CD2-CZ2 4.47Å; L218-W224 HydrophobicContact CG-CH2 4.44Å; L218-W224 HydrophobicContact CG-CZ3 4.41Å; W224-H226 WeakPolarHBondContact CB-NE2 2.99Å
225	Y	93.9	Very high	89.9	Confident	27 Å²	27	61.8 Å²	61.8	11%	0.106	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.6	165.4	-73.8	-103.4	0	0	0	109.5	T192 R207 V212 H216 I217 E219 L223	T192-Y225 WeakPolarHBondContact CG2-OH 3.28Å; R207-Y225 HydrophobicContact CB-CD1 4.36Å; R207-Y225 VanDerWaalsContact CD-CE1 3.4Å; R207-Y225 HydrophobicContact CG-CD1 4.18Å; R207-Y225 HydrophobicContact CG-CE1 4.15Å; R207-Y225 CarbonylContact O-C 3.57Å; R207-Y225 WeakPolarHBondContact O-CA 3.38Å; V212-Y225 HydrophobicContact CG1-CD1 3.82Å; V212-Y225 HydrophobicContact CG1-CG 4.4Å; H216-Y225 CarbonylContact C-O 3.59Å; H216-Y225 VanDerWaalsContact CA-O 3.31Å; H216-Y225 WeakPolarHBondContact CA-O 3.5Å; I217-Y225 PolarHBondContact N-O 3.25Å; I217-Y225 PolarHBondContact O-N 3.23Å; E219-Y225 HydrophobicContact CB-CD2 3.7Å; E219-Y225 HydrophobicContact CB-CE2 3.53Å; E219-Y225 HydrophobicContact CG-CD2 4.42Å; E219-Y225 HydrophobicContact CG-CE2 3.85Å; L223-Y225 HydrophobicContact CD1-CE2 4.36Å; L223-Y225 HydrophobicContact CD2-CE2 3.74Å; L223-Y225 HydrophobicContact CG-CD2 4.29Å; L223-Y225 HydrophobicContact CG-CE2 3.77Å
226	H	93.4	Very high	89.5	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.037	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.3	176.6	-54.8	-88.4	0	0	0	109	H206 R207 F208 D209 A215 H216 W224 L228 F258	H206-H226 AromaticContact CG-NE2 3.63Å; H206-H226 AromaticContact ND1-CE1 3.59Å; H206-H226 AromaticContact ND1-NE2 2.89Å; H206-H226 PolarHBondContact ND1-NE2 3.35Å; R207-H226 PolarHBondContact O-N 3.16Å; F208-H226 HydrophobicContact CD1-CB 3.82Å; F208-H226 HydrophobicContact CE1-CB 4.01Å; F208-H226 AromaticContact CE1-CD2 3.95Å; F208-H226 AromaticContact CE1-CG 3.97Å; D209-H226 PolarHBondContact N-O 2.98Å; A215-H226 WeakPolarHBondContact O-CA 3.29Å; H216-H226 AromaticContact CE1-ND1 3.37Å; H216-H226 PolarHBondContact CE1-ND1 3.08Å; H216-H226 AromaticContact CG-ND1 3.99Å; H216-H226 AromaticContact ND1-CE1 3.77Å; H216-H226 AromaticContact ND1-CG 3.76Å; H216-H226 AromaticContact ND1-ND1 2.87Å; H216-H226 PolarHBondContact ND1-ND1 3.48Å; W224-H226 WeakPolarHBondContact CB-NE2 2.99Å; H226-L228 HydrophobicContact CB-CB 4.41Å; H226-L228 PolarHBondContact O-N 3.18Å; H226-F258 AromaticContact CE1-CE2 3.34Å; H226-F258 WeakPolarHBondContact CE1-CE2 3.18Å; H226-F258 AromaticContact CE1-CZ 3.67Å; H226-F258 AromaticContact ND1-CE2 3.51Å; H226-F258 AromaticContact ND1-CZ 3.38Å; H226-F258 WeakPolarHBondContact ND1-CZ 3.31Å; H226-F258 AromaticContact NE2-CE2 3.73Å
227	R	91.8	Very high	88.8	Confident	113 Å²	113	64.8 Å²	64.8	43%	0.426	31%	0.312	S	S	.	.	S	Bend	trans	-74.9	66	174	-166.6	-174.1	180	176.8	-9.4	111.3	D209 V212 K213 S214 A215 N247	D209-R227 WeakPolarHBondContact O-CA 3.23Å; V212-R227 HydrophobicContact CG2-CB 3.58Å; V212-R227 HydrophobicContact CG2-CG 4.09Å; V212-R227 WeakPolarHBondContact O-CD 3.46Å; V212-R227 VanDerWaalsContact O-CG 3.22Å; V212-R227 WeakPolarHBondContact O-CG 3.36Å; V212-R227 PolarHBondContact O-NE 2.61Å; K213-R227 PolarHBondContact O-NH1 2.86Å; S214-R227 VanDerWaalsContact O-CB 3.31Å; S214-R227 WeakPolarHBondContact O-CB 3.32Å; A215-R227 PolarHBondContact O-N 3.02Å; R227-N247 VanDerWaalsContact O-CB 3.28Å; R227-N247 WeakPolarHBondContact O-CB 3.45Å; R227-N247 PolarHBondContact O-ND2 3.21Å
228	L	90.7	Very high	88	Confident	25 Å²	25	65.2 Å²	65.2	13%	0.131	32%	0.323	C	S	.	.			trans	-144.7	135.7	-173.7	-172.5	81	0	0	0	108.6	F208 D209 H226 N247 R249 I254	F208-L228 CarbonylContact C-O 3.58Å; F208-L228 WeakPolarHBondContact CB-O 3.34Å; F208-L228 HydrophobicContact CD1-CB 4.16Å; F208-L228 HydrophobicContact CD1-CD2 3.86Å; F208-L228 HydrophobicContact CD1-CG 4.49Å; F208-L228 HydrophobicContact CE1-CD2 4.06Å; D209-L228 PolarHBondContact N-O 3.01Å; H226-L228 HydrophobicContact CB-CB 4.41Å; H226-L228 PolarHBondContact O-N 3.18Å; L228-N247 CarbonylContact C-O 3.55Å; L228-N247 WeakPolarHBondContact CA-O 3.31Å; L228-N247 HydrophobicContact CD1-CB 4.07Å; L228-N247 VanDerWaalsContact CD1-O 3.31Å; L228-N247 WeakPolarHBondContact CD1-O 2.95Å; L228-R249 HydrophobicContact CD1-CB 4.3Å; L228-R249 HydrophobicContact CD1-CG 3.9Å; L228-R249 HydrophobicContact CD2-CB 4.32Å; L228-I254 HydrophobicContact CD2-CD1 3.33Å; L228-I254 HydrophobicContact CD2-CG1 3.52Å; L228-I254 HydrophobicContact CD2-CG2 4.44Å; L228-I254 HydrophobicContact CG-CD1 4.4Å
229	S	89.6	Confident	86.9	Confident	22 Å²	22	64.5 Å²	64.5	15%	0.154	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	143.7	172.8	-177.4	0	0	0	0	109.8	N247 T248 R249	S229-N247 PolarHBondContact N-O 2.99Å; S229-T248 VanDerWaalsContact O-CA 3.31Å; S229-T248 WeakPolarHBondContact O-CA 3.16Å; S229-R249 PolarHBondContact O-N 3.5Å; S229-R249 VanDerWaalsContact O-N 3.16Å
230	I	92.7	Very high	86	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.072	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	138.3	176.2	-53.7	-58.7	0	0	0	109.7	L185 F208 R249 I254 L270 V277	L185-I230 HydrophobicContact CB-CG1 3.89Å; L185-I230 HydrophobicContact CD1-CB 4.29Å; L185-I230 HydrophobicContact CD1-CG1 3.81Å; L185-I230 HydrophobicContact CD1-CG2 4.04Å; L185-I230 HydrophobicContact CD2-CD1 3.83Å; L185-I230 HydrophobicContact CD2-CG1 3.55Å; L185-I230 HydrophobicContact CG-CG1 3.91Å; F208-I230 HydrophobicContact CB-CD1 4.23Å; F208-I230 HydrophobicContact CB-CG1 4.34Å; F208-I230 HydrophobicContact CD1-CD1 4.31Å; F208-I230 HydrophobicContact CG-CD1 4.1Å; I230-R249 WeakPolarHBondContact CA-O 3.04Å; I230-I254 HydrophobicContact CD1-CD1 3.11Å; I230-L270 HydrophobicContact CB-CD2 4.49Å; I230-V277 HydrophobicContact CG2-CG1 4.45Å; I230-V277 HydrophobicContact CG2-CG2 4.25Å
231	D	91.8	Very high	85	Confident	41 Å²	41	61.6 Å²	61.6	22%	0.219	32%	0.322	C	S	.	.			trans	-133.6	165.2	175.9	-158.8	-32.1	0	0	0	109.2	R233 R249 K250	D231-R233 VanDerWaalsContact C-N 3.31Å; D231-R233 WeakPolarHBondContact CB-O 3.36Å; D231-R233 PolarHBondContact OD1-N 3.08Å; D231-R249 PolarHBondContact N-O 3.12Å; D231-K250 VanDerWaalsContact O-CA 3.26Å; D231-K250 WeakPolarHBondContact O-CA 3.5Å
232	W	91.5	Very high	83.7	Confident	40 Å²	40	62.1 Å²	62.1	15%	0.152	33%	0.325	C	S	.	.	S	Bend	trans	-88.7	-1.3	172.7	60.1	98	0	0	0	112.6	A273 K276 V277 N280 F304 E305	W232-A273 HydrophobicContact CE3-CB 4.26Å; W232-A273 HydrophobicContact CZ3-CB 3.8Å; W232-K276 HydrophobicContact CB-CB 3.79Å; W232-K276 WeakPolarHBondContact CB-O 3.22Å; W232-K276 HydrophobicContact CD2-CB 3.43Å; W232-K276 VanDerWaalsContact CD2-CB 3.43Å; W232-K276 HydrophobicContact CD2-CG 4.1Å; W232-K276 HydrophobicContact CE3-CB 3.76Å; W232-K276 HydrophobicContact CE3-CG 4.5Å; W232-K276 HydrophobicContact CG-CB 3.45Å; W232-K276 VanDerWaalsContact CG-CB 3.45Å; W232-K276 HydrophobicContact CG-CG 4.33Å; W232-V277 HydrophobicContact CB-CG2 4.44Å; W232-N280 HydrophobicContact CB-CB 4.1Å; W232-N280 PolarHBondContact O-ND2 3.3Å; W232-F304 HydrophobicContact CH2-CB 3.36Å; W232-F304 HydrophobicContact CH2-CD1 4.44Å; W232-F304 HydrophobicContact CH2-CD2 4.45Å; W232-F304 AromaticContact CH2-CG 3.87Å; W232-F304 HydrophobicContact CH2-CG 3.87Å; W232-F304 HydrophobicContact CZ2-CB 3.89Å; W232-F304 HydrophobicContact CZ3-CB 4.04Å; W232-F304 HydrophobicContact CZ3-CG 4.4Å; W232-E305 HydrophobicContact CZ2-CG 4.02Å; W232-E305 PolarHBondContact NE1-OE2 3.44Å
233	R	88.8	Confident	82.2	Confident	132 Å²	132	65.8 Å²	65.8	50%	0.498	34%	0.34	S	S	.	.	S	Bend	trans	-139.9	146.5	174.8	-63.6	177.2	-175.3	159.8	4	110.5	D231 E305	D231-R233 VanDerWaalsContact C-N 3.31Å; D231-R233 WeakPolarHBondContact CB-O 3.36Å; D231-R233 PolarHBondContact OD1-N 3.08Å; R233-E305 IonicContact CZ-OE1 2.81Å; R233-E305 IonicContact CZ-OE2 3.32Å; R233-E305 IonicContact NE-OE2 3.54Å; R233-E305 IonicContact NH1-OE1 3.62Å; R233-E305 PolarHBondContact NH1-OE1 3.39Å; R233-E305 IonicContact NH1-OE2 3.43Å; R233-E305 PolarHBondContact NH1-OE2 2.95Å; R233-E305 IonicContact NH2-OE1 2.59Å; R233-E305 IonicContact NH2-OE2 3.83Å; R233-E305 PolarHBondContact NH2-OE2 3.22Å
234	D	85.1	Confident	80.3	Confident	61 Å²	61	70.3 Å²	70.3	33%	0.326	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-75.5	145.3	163.2	-72.9	-35.6	0	0	0	110.1	H236 R249 K250 S253	D234-H236 PolarHBondContact O-N 3.37Å; D234-R249 WeakPolarHBondContact OD1-CA 3.33Å; D234-R249 VanDerWaalsContact OD1-CD 3.26Å; D234-R249 WeakPolarHBondContact OD1-CD 3.28Å; D234-K250 PolarHBondContact OD1-N 3.42Å; D234-K250 WeakPolarHBondContact OD2-CE 3.46Å; D234-S253 PolarHBondContact OD2-OG 2.93Å
235	P	79.4	Confident	78.5	Confident	27 Å²	27	74.1 Å²	74.1	18%	0.175	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-60.8	137.3	178	24.2	-32.7	0	0	0	110.1	A240 T248	P235-A240 HydrophobicContact CG-CB 4.44Å; P235-T248 VanDerWaalsContact CD-O 3.27Å; P235-T248 WeakPolarHBondContact CD-O 3.38Å
236	H	77.1	Confident	77	Confident	131 Å²	131	74.5 Å²	74.5	61%	0.606	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-55.5	137.4	176.8	-168.3	-78.1	0	0	0	109.7	D234 A238 V239 A240	D234-H236 PolarHBondContact O-N 3.37Å; H236-A238 PolarHBondContact ND1-N 3.01Å; H236-A238 PolarHBondContact O-N 3.32Å; H236-V239 HydrophobicContact CB-CG2 4.22Å; H236-V239 WeakPolarHBondContact O-CA 3.46Å; H236-V239 WeakPolarHBondContact O-CB 3.42Å; H236-V239 PolarHBondContact O-N 3.32Å; H236-A240 PolarHBondContact O-N 3.08Å
237	P	74.8	Confident	76.3	Confident	99 Å²	99	77 Å²	77	64%	0.643	41%	0.411	S	S	*	.	H	α-helix	trans	-52.3	-37.6	-175.3	-30.1	34.9	0	0	0	114	V239 A240 A241	P237-V239 VanDerWaalsContact C-N 3.33Å; P237-V239 PolarHBondContact O-N 3.27Å; P237-A240 PolarHBondContact O-N 3.24Å; P237-A241 WeakPolarHBondContact O-CB 3.18Å; P237-A241 PolarHBondContact O-N 3.15Å
238	A	72.6	Confident	76.2	Confident	58 Å²	58	73.1 Å²	73.1	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-62	-34.4	174.5	0	0	0	0	0	114	H236	H236-A238 PolarHBondContact ND1-N 3.01Å; H236-A238 PolarHBondContact O-N 3.32Å
239	V	67.1	Low	76.2	Confident	71 Å²	71	75.8 Å²	75.8	43%	0.43	41%	0.408	S	S	.	.	H	α-helix	trans	-80.3	-39.4	176.5	179.6	0	0	0	0	110.6	H236 P237 A241 Q242 K243	H236-V239 HydrophobicContact CB-CG2 4.22Å; H236-V239 WeakPolarHBondContact O-CA 3.46Å; H236-V239 WeakPolarHBondContact O-CB 3.42Å; H236-V239 PolarHBondContact O-N 3.32Å; P237-V239 VanDerWaalsContact C-N 3.33Å; P237-V239 PolarHBondContact O-N 3.27Å; V239-A241 VanDerWaalsContact C-N 3.26Å; V239-A241 PolarHBondContact O-N 3.24Å; V239-Q242 PolarHBondContact O-N 2.87Å; V239-Q242 VanDerWaalsContact O-N 3.11Å; V239-K243 PolarHBondContact O-N 3.33Å
240	A	67	Low	76.5	Confident	32 Å²	32	76.6 Å²	76.6	26%	0.264	41%	0.409	S	S	.	.	H	α-helix	trans	-59.7	-37.6	174.6	0	0	0	0	0	111.8	P235 H236 P237 Q242 K243 P244	P235-A240 HydrophobicContact CG-CB 4.44Å; H236-A240 PolarHBondContact O-N 3.08Å; P237-A240 PolarHBondContact O-N 3.24Å; A240-Q242 VanDerWaalsContact C-N 3.34Å; A240-Q242 PolarHBondContact O-N 3.08Å; A240-K243 CarbonylContact O-C 3.53Å; A240-P244 WeakPolarHBondContact O-CA 3.44Å
241	A	64.8	Low	76.6	Confident	82 Å²	82	76 Å²	76	68%	0.678	41%	0.406	S	S	*	.	H	α-helix	trans	-66.1	-32.5	175.3	0	0	0	0	0	113.4	P237 V239	P237-A241 WeakPolarHBondContact O-CB 3.18Å; P237-A241 PolarHBondContact O-N 3.15Å; V239-A241 VanDerWaalsContact C-N 3.26Å; V239-A241 PolarHBondContact O-N 3.24Å
242	Q	61.6	Low	76.8	Confident	173 Å²	173	74.2 Å²	74.2	81%	0.808	40%	0.397	S	S	*	.	H	α-helix	trans	-87.2	-27.7	178.9	-67.8	-164.6	10	0	0	113.5	V239 A240 P244	V239-Q242 PolarHBondContact O-N 2.87Å; V239-Q242 VanDerWaalsContact O-N 3.11Å; A240-Q242 VanDerWaalsContact C-N 3.34Å; A240-Q242 PolarHBondContact O-N 3.08Å; Q242-P244 VanDerWaalsContact C-CD 3.46Å; Q242-P244 WeakPolarHBondContact O-CD 3.43Å
243	K	61.6	Low	76.9	Confident	138 Å²	138	73.7 Å²	73.7	60%	0.6	40%	0.4	S	S	*	.			trans	-123.2	74.9	174.3	-66.7	-174.8	-179.4	-179.3	0	108.8	V239 A240 H245 S246	V239-K243 PolarHBondContact O-N 3.33Å; A240-K243 CarbonylContact O-C 3.53Å; K243-H245 PolarHBondContact O-N 3.22Å; K243-S246 VanDerWaalsContact O-CB 3.31Å; K243-S246 WeakPolarHBondContact O-CB 3.44Å; K243-S246 PolarHBondContact O-N 3.19Å
244	P	56	Low	77.2	Confident	97 Å²	97	67.4 Å²	67.4	63%	0.63	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.8	178.9	23	-32.5	0	0	0	112.9	A240 Q242	A240-P244 WeakPolarHBondContact O-CA 3.44Å; Q242-P244 VanDerWaalsContact C-CD 3.46Å; Q242-P244 WeakPolarHBondContact O-CD 3.43Å
245	H	56.4	Low	77.7	Confident	165 Å²	165	64.5 Å²	64.5	76%	0.764	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	10.5	175.8	-52.9	93.4	0	0	0	113.7	K243 N247	K243-H245 PolarHBondContact O-N 3.22Å; H245-N247 VanDerWaalsContact C-N 3.3Å; H245-N247 PolarHBondContact O-N 3.21Å; H245-N247 PolarHBondContact O-OD1 3.46Å
246	S	63.2	Low	78.5	Confident	36 Å²	36	67.7 Å²	67.7	25%	0.252	38%	0.376	S	S	.	.			trans	-71.4	91.2	171.1	-172	0	0	0	0	108.6	K243 T248	K243-S246 VanDerWaalsContact O-CB 3.31Å; K243-S246 WeakPolarHBondContact O-CB 3.44Å; K243-S246 PolarHBondContact O-N 3.19Å; S246-T248 PolarHBondContact O-N 3.01Å
247	N	79.8	Confident	79.2	Confident	59 Å²	59	67.5 Å²	67.5	32%	0.316	38%	0.375	S	S	.	.			trans	-86.8	50.5	-177	-66.8	-0	0	0	0	110.6	R227 L228 S229 H245	R227-N247 VanDerWaalsContact O-CB 3.28Å; R227-N247 WeakPolarHBondContact O-CB 3.45Å; R227-N247 PolarHBondContact O-ND2 3.21Å; L228-N247 CarbonylContact C-O 3.55Å; L228-N247 WeakPolarHBondContact CA-O 3.31Å; L228-N247 HydrophobicContact CD1-CB 4.07Å; L228-N247 VanDerWaalsContact CD1-O 3.31Å; L228-N247 WeakPolarHBondContact CD1-O 2.95Å; S229-N247 PolarHBondContact N-O 2.99Å; H245-N247 VanDerWaalsContact C-N 3.3Å; H245-N247 PolarHBondContact O-N 3.21Å; H245-N247 PolarHBondContact O-OD1 3.46Å
248	T	88.5	Confident	80.2	Confident	33 Å²	33	65.1 Å²	65.1	20%	0.202	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.6	170.8	54.4	0	0	0	0	110.2	S229 P235 S246	S229-T248 VanDerWaalsContact O-CA 3.31Å; S229-T248 WeakPolarHBondContact O-CA 3.16Å; P235-T248 VanDerWaalsContact CD-O 3.27Å; P235-T248 WeakPolarHBondContact CD-O 3.38Å; S246-T248 PolarHBondContact O-N 3.01Å
249	R	91.4	Very high	81.3	Confident	80 Å²	80	64.4 Å²	64.4	30%	0.302	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	150.9	179	-71.9	-67.2	-175.4	-96.5	0.8	110.6	L228 S229 I230 D231 D234 I254	L228-R249 HydrophobicContact CD1-CB 4.3Å; L228-R249 HydrophobicContact CD1-CG 3.9Å; L228-R249 HydrophobicContact CD2-CB 4.32Å; S229-R249 PolarHBondContact O-N 3.5Å; S229-R249 VanDerWaalsContact O-N 3.16Å; I230-R249 WeakPolarHBondContact CA-O 3.04Å; D231-R249 PolarHBondContact N-O 3.12Å; D234-R249 WeakPolarHBondContact OD1-CA 3.33Å; D234-R249 VanDerWaalsContact OD1-CD 3.26Å; D234-R249 WeakPolarHBondContact OD1-CD 3.28Å; R249-I254 HydrophobicContact CB-CD1 3.92Å; R249-I254 HydrophobicContact CB-CG1 3.7Å; R249-I254 HydrophobicContact CG-CG1 4.49Å
250	K	94.6	Very high	82.7	Confident	40 Å²	40	62.1 Å²	62.1	17%	0.174	34%	0.338	C	S	.	.			trans	-72.9	150.6	166.2	66.9	-178.4	174.4	160.3	0	111.7	D231 D234 G252 S253 I254 E284	D231-K250 VanDerWaalsContact O-CA 3.26Å; D231-K250 WeakPolarHBondContact O-CA 3.5Å; D234-K250 PolarHBondContact OD1-N 3.42Å; D234-K250 WeakPolarHBondContact OD2-CE 3.46Å; K250-G252 VanDerWaalsContact C-N 3.28Å; K250-G252 PolarHBondContact O-N 2.8Å; K250-S253 WeakPolarHBondContact CE-OG 3.42Å; K250-S253 VanDerWaalsContact CG-OG 3.3Å; K250-S253 WeakPolarHBondContact CG-OG 3.48Å; K250-S253 WeakPolarHBondContact O-CB 3.43Å; K250-S253 PolarHBondContact O-N 3.07Å; K250-S253 VanDerWaalsContact O-N 3.08Å; K250-I254 WeakPolarHBondContact O-CG1 3.43Å; K250-I254 PolarHBondContact O-N 2.79Å; K250-E284 WeakPolarHBondContact CD-OE1 3.25Å; K250-E284 WeakPolarHBondContact CD-OE2 3.47Å; K250-E284 WeakPolarHBondContact CE-OE2 3.23Å; K250-E284 IonicContact NZ-OE1 3.59Å; K250-E284 PolarHBondContact NZ-OE1 2.65Å; K250-E284 IonicContact NZ-OE2 3.72Å; K250-E284 PolarHBondContact NZ-OE2 3.12Å
251	L	95.7	Very high	83.9	Confident	1 Å²	1	67 Å²	67	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-57.3	-40.9	-178.2	-178	61.9	0	0	0	112.4	Y183 S253 I254 L255 L266 L281 V286 I290	Y183-L251 HydrophobicContact CD2-CD1 3.61Å; Y183-L251 HydrophobicContact CE2-CD1 3.98Å; L251-S253 VanDerWaalsContact C-N 3.29Å; L251-S253 PolarHBondContact O-N 2.91Å; L251-I254 PolarHBondContact O-N 2.78Å; L251-L255 HydrophobicContact CD1-CG 4.25Å; L251-L255 HydrophobicContact CG-CD1 4.06Å; L251-L255 HydrophobicContact CG-CG 4.27Å; L251-L255 WeakPolarHBondContact O-CG 3.49Å; L251-L255 PolarHBondContact O-N 3.32Å; L251-L266 HydrophobicContact CD2-CD1 3.9Å; L251-L266 HydrophobicContact CD2-CD2 3.59Å; L251-L266 HydrophobicContact CD2-CG 4.41Å; L251-L281 HydrophobicContact CB-CD2 3.89Å; L251-L281 HydrophobicContact CD2-CD2 3.59Å; L251-L281 HydrophobicContact CG-CD2 4.22Å; L251-V286 HydrophobicContact CD2-CG1 4.4Å; L251-I290 HydrophobicContact CD2-CD1 4.39Å
252	G	95.1	Very high	85.3	Confident	4 Å²	4	68.3 Å²	68.3	4%	0.041	35%	0.345	C	S	.	.	H	α-helix	trans	-58.5	-38.9	177.9	0	0	0	0	0	113.2	K250 N256	K250-G252 VanDerWaalsContact C-N 3.28Å; K250-G252 PolarHBondContact O-N 2.8Å; G252-N256 PolarHBondContact O-N 2.91Å; G252-N256 PolarHBondContact O-ND2 3.21Å; G252-N256 VanDerWaalsContact O-ND2 3.08Å
253	S	94.4	Very high	87	Confident	28 Å²	28	60.1 Å²	60.1	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-67.8	-41.8	177	-67.1	0	0	0	0	111.5	D234 K250 L251 N256 E257	D234-S253 PolarHBondContact OD2-OG 2.93Å; K250-S253 WeakPolarHBondContact CE-OG 3.42Å; K250-S253 VanDerWaalsContact CG-OG 3.3Å; K250-S253 WeakPolarHBondContact CG-OG 3.48Å; K250-S253 WeakPolarHBondContact O-CB 3.43Å; K250-S253 PolarHBondContact O-N 3.07Å; K250-S253 VanDerWaalsContact O-N 3.08Å; L251-S253 VanDerWaalsContact C-N 3.29Å; L251-S253 PolarHBondContact O-N 2.91Å; S253-N256 PolarHBondContact O-N 2.83Å; S253-E257 WeakPolarHBondContact O-CB 3.31Å; S253-E257 PolarHBondContact O-N 2.83Å
254	I	94.8	Very high	88.7	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-46.6	178.2	-62.9	166	0	0	0	111.2	Y183 F208 L228 I230 R249 K250 L251 N256 E257 F258	Y183-I254 HydrophobicContact CE2-CG2 3.95Å; F208-I254 HydrophobicContact CD1-CD1 4.47Å; F208-I254 HydrophobicContact CE1-CD1 4.37Å; F208-I254 HydrophobicContact CE1-CG2 3.51Å; F208-I254 HydrophobicContact CZ-CG2 3.62Å; L228-I254 HydrophobicContact CD2-CD1 3.33Å; L228-I254 HydrophobicContact CD2-CG1 3.52Å; L228-I254 HydrophobicContact CD2-CG2 4.44Å; L228-I254 HydrophobicContact CG-CD1 4.4Å; I230-I254 HydrophobicContact CD1-CD1 3.11Å; R249-I254 HydrophobicContact CB-CD1 3.92Å; R249-I254 HydrophobicContact CB-CG1 3.7Å; R249-I254 HydrophobicContact CG-CG1 4.49Å; K250-I254 WeakPolarHBondContact O-CG1 3.43Å; K250-I254 PolarHBondContact O-N 2.79Å; L251-I254 PolarHBondContact O-N 2.78Å; I254-N256 VanDerWaalsContact C-N 3.26Å; I254-N256 PolarHBondContact O-N 2.89Å; I254-E257 PolarHBondContact O-N 2.65Å; I254-F258 HydrophobicContact CG2-CD2 4.23Å; I254-F258 HydrophobicContact CG2-CE2 4.07Å; I254-F258 HydrophobicContact CG2-CZ 4.24Å; I254-F258 PolarHBondContact O-N 3.39Å
255	L	96.2	Very high	90.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.3	-42.6	176.7	-73.2	173.7	0	0	0	111.2	Y183 L251 G259 H260 I263 V286	Y183-L255 HydrophobicContact CD2-CD2 4.35Å; Y183-L255 HydrophobicContact CE2-CD2 3.74Å; Y183-L255 HydrophobicContact CE2-CG 4.43Å; L251-L255 HydrophobicContact CD1-CG 4.25Å; L251-L255 HydrophobicContact CG-CD1 4.06Å; L251-L255 HydrophobicContact CG-CG 4.27Å; L251-L255 WeakPolarHBondContact O-CG 3.49Å; L251-L255 PolarHBondContact O-N 3.32Å; L255-G259 PolarHBondContact O-N 2.8Å; L255-G259 VanDerWaalsContact O-N 3.13Å; L255-H260 WeakPolarHBondContact CB-O 3.39Å; L255-H260 HydrophobicContact CD2-CB 3.98Å; L255-H260 PolarHBondContact O-N 3.32Å; L255-I263 HydrophobicContact CD2-CG2 3.73Å; L255-V286 HydrophobicContact CD1-CG1 3.75Å
256	N	95.2	Very high	92.7	Very high	94 Å²	94	41.6 Å²	41.6	50%	0.503	22%	0.215	S	C	.	.	H	α-helix	trans	-69.7	-40.8	177.9	-64.8	-27	0	0	0	112.4	G252 S253 I254 G259 R289	G252-N256 PolarHBondContact O-N 2.91Å; G252-N256 PolarHBondContact O-ND2 3.21Å; G252-N256 VanDerWaalsContact O-ND2 3.08Å; S253-N256 PolarHBondContact O-N 2.83Å; I254-N256 VanDerWaalsContact C-N 3.26Å; I254-N256 PolarHBondContact O-N 2.89Å; N256-G259 PolarHBondContact O-N 3.08Å; N256-R289 PolarHBondContact OD1-NH1 2.8Å
257	E	93.3	Very high	94.3	Very high	128 Å²	128	40.4 Å²	40.4	60%	0.598	21%	0.205	S	C	*	.	H	α-helix	trans	-63.1	-41	178.5	-174.6	177	159.3	0	0	111.7	S253 I254 G259	S253-E257 WeakPolarHBondContact O-CB 3.31Å; S253-E257 PolarHBondContact O-N 2.83Å; I254-E257 PolarHBondContact O-N 2.65Å; E257-G259 VanDerWaalsContact C-N 3.27Å; E257-G259 PolarHBondContact O-N 3.12Å
258	F	94.6	Very high	95	Very high	48 Å²	48	37.6 Å²	37.6	21%	0.211	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-4.2	178.5	-66.9	6.7	0	0	0	112.6	Y183 F208 H226 I254 H260	Y183-F258 VanDerWaalsContact OH-CD2 3.28Å; Y183-F258 WeakPolarHBondContact OH-CD2 3.26Å; F208-F258 AromaticContact CE1-CE2 3.81Å; F208-F258 HydrophobicContact CE1-CE2 3.81Å; F208-F258 HydrophobicContact CE1-CZ 4.12Å; F208-F258 AromaticContact CZ-CE2 3.85Å; F208-F258 HydrophobicContact CZ-CE2 3.85Å; H226-F258 AromaticContact CE1-CE2 3.34Å; H226-F258 WeakPolarHBondContact CE1-CE2 3.18Å; H226-F258 AromaticContact CE1-CZ 3.67Å; H226-F258 AromaticContact ND1-CE2 3.51Å; H226-F258 AromaticContact ND1-CZ 3.38Å; H226-F258 WeakPolarHBondContact ND1-CZ 3.31Å; H226-F258 AromaticContact NE2-CE2 3.73Å; I254-F258 HydrophobicContact CG2-CD2 4.23Å; I254-F258 HydrophobicContact CG2-CE2 4.07Å; I254-F258 HydrophobicContact CG2-CZ 4.24Å; I254-F258 PolarHBondContact O-N 3.39Å; F258-H260 PolarHBondContact O-CD2 3.11Å; F258-H260 VanDerWaalsContact O-CD2 3.28Å; F258-H260 PolarHBondContact O-N 2.6Å
259	G	96.2	Very high	95.3	Very high	43 Å²	43	37.3 Å²	37.3	44%	0.443	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	21.1	-176.6	0	0	0	0	0	113.7	L255 N256 E257	L255-G259 PolarHBondContact O-N 2.8Å; L255-G259 VanDerWaalsContact O-N 3.13Å; N256-G259 PolarHBondContact O-N 3.08Å; E257-G259 VanDerWaalsContact C-N 3.27Å; E257-G259 PolarHBondContact O-N 3.12Å
260	H	96.1	Very high	95.4	Very high	23 Å²	23	33.7 Å²	33.7	11%	0.106	17%	0.174	C	C	.	.			trans	-90.6	108.7	-179	-64.4	165.6	0	0	0	110.8	Y183 H206 L255 F258	Y183-H260 AromaticContact CE1-ND1 3.65Å; Y183-H260 AromaticContact CZ-ND1 3.61Å; Y183-H260 PolarHBondContact OH-ND1 3.23Å; H206-H260 AromaticContact CE1-CE1 3.6Å; H206-H260 AromaticContact NE2-CE1 3.28Å; H206-H260 PolarHBondContact NE2-CE1 3.47Å; H206-H260 VanDerWaalsContact NE2-CE1 3.28Å; H206-H260 AromaticContact NE2-ND1 3.98Å; L255-H260 WeakPolarHBondContact CB-O 3.39Å; L255-H260 HydrophobicContact CD2-CB 3.98Å; L255-H260 PolarHBondContact O-N 3.32Å; F258-H260 PolarHBondContact O-CD2 3.11Å; F258-H260 VanDerWaalsContact O-CD2 3.28Å; F258-H260 PolarHBondContact O-N 2.6Å
261	H	92.6	Very high	95.3	Very high	135 Å²	135	36.6 Å²	36.6	63%	0.625	19%	0.188	S	C	*	.			trans	-89.8	-16.6	-179.5	-60.2	-57.5	0	0	0	114	R289	H261-R289 WeakPolarHBondContact O-CB 3.49Å; H261-R289 WeakPolarHBondContact O-CD 3.13Å; H261-R289 WeakPolarHBondContact O-CG 3.48Å
262	K	94.8	Very high	95.1	Very high	110 Å²	110	36.6 Å²	36.6	48%	0.478	19%	0.188	S	C	.	.			trans	-143.5	142	177.8	-73.1	-169.7	171	-169.6	0	110.6	R181 R289 W365 K366	R181-K262 PolarHBondContact NH1-O 3.08Å; K262-R289 WeakPolarHBondContact CA-O 3.42Å; K262-W365 HydrophobicContact CB-CH2 3.91Å; K262-W365 HydrophobicContact CB-CZ2 4.18Å; K262-W365 HydrophobicContact CD-CH2 3.86Å; K262-W365 HydrophobicContact CD-CZ2 4.07Å; K262-W365 HydrophobicContact CG-CH2 3.81Å; K262-W365 HydrophobicContact CG-CZ2 4.35Å; K262-K366 PolarHBondContact NZ-O 3.34Å
263	I	96.9	Very high	95.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138	166.9	60.1	173.6	0	0	0	108.8	R181 Y183 L255 L266 R289 I290 G291 W365	R181-I263 HydrophobicContact CG-CG2 4.14Å; Y183-I263 HydrophobicContact CD1-CG2 3.72Å; Y183-I263 HydrophobicContact CE1-CG2 3.9Å; Y183-I263 HydrophobicContact CG-CD1 4.29Å; Y183-I263 HydrophobicContact CG-CG2 4.14Å; L255-I263 HydrophobicContact CD2-CG2 3.73Å; I263-L266 HydrophobicContact CD1-CB 3.91Å; I263-L266 HydrophobicContact CD1-CD1 4.1Å; I263-L266 HydrophobicContact CD1-CG 4.48Å; I263-R289 PolarHBondContact N-O 3.4Å; I263-I290 HydrophobicContact CD1-CD1 4.25Å; I263-I290 HydrophobicContact CD1-CG1 3.91Å; I263-I290 HydrophobicContact CD1-CG2 4.35Å; I263-I290 HydrophobicContact CG1-CB 4.26Å; I263-I290 HydrophobicContact CG1-CG1 3.82Å; I263-I290 HydrophobicContact CG1-CG2 4.17Å; I263-I290 WeakPolarHBondContact O-CA 3.44Å; I263-G291 PolarHBondContact O-N 3.48Å; I263-W365 WeakPolarHBondContact O-CZ2 3.44Å
264	D	97.6	Very high	95.1	Very high	11 Å²	11	35.6 Å²	35.6	6%	0.059	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-32.9	-177.5	-60.3	-77	0	0	0	111.4	L171 C180 R181 G291 Q292 W365	L171-D264 HydrophobicContact CD1-CB 3.79Å; C180-D264 VanDerWaalsContact CA-OD2 3.25Å; C180-D264 WeakPolarHBondContact CA-OD2 3.41Å; R181-D264 PolarHBondContact N-OD2 2.59Å; R181-D264 PolarHBondContact O-N 3.02Å; D264-G291 CarbonylContact O-C 3.37Å; D264-G291 WeakPolarHBondContact O-CA 3.38Å; D264-Q292 PolarHBondContact O-N 2.98Å; D264-W365 PolarHBondContact OD1-NE1 3.46Å
265	I	97.9	Very high	95.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131.5	179.7	-54.4	156.8	0	0	0	109.4	V163 L171 R181 L182 Y183 F194 M198 Q292 I294	V163-I265 HydrophobicContact CG1-CD1 3.87Å; V163-I265 HydrophobicContact CG1-CG1 4.22Å; V163-I265 HydrophobicContact CG1-CG2 4.28Å; L171-I265 HydrophobicContact CD1-CD1 3.81Å; L171-I265 HydrophobicContact CD1-CG1 3.96Å; L171-I265 HydrophobicContact CD2-CD1 3.85Å; L171-I265 HydrophobicContact CD2-CG1 3.96Å; R181-I265 PolarHBondContact O-N 2.96Å; L182-I265 WeakPolarHBondContact CA-O 3.19Å; L182-I265 HydrophobicContact CD1-CB 3.6Å; L182-I265 HydrophobicContact CD1-CG2 3.46Å; L182-I265 VanDerWaalsContact CD1-CG2 3.46Å; Y183-I265 PolarHBondContact N-O 3.14Å; F194-I265 HydrophobicContact CZ-CG2 4.48Å; M198-I265 HydrophobicContact CE-CD1 3.37Å; M198-I265 HydrophobicContact SD-CD1 4.45Å; I265-Q292 WeakPolarHBondContact CA-O 3.48Å; I265-I294 HydrophobicContact CG2-CD1 4.04Å
266	L	98	Very high	95.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	111.3	164.8	-179.8	66.7	0	0	0	109.2	Y183 L185 L251 I263 L281 I290 Q292 L293 I294 F295	Y183-L266 WeakPolarHBondContact O-CA 3.25Å; L185-L266 HydrophobicContact CD1-CD1 3.71Å; L185-L266 HydrophobicContact CD1-CG 4.45Å; L185-L266 HydrophobicContact CD2-CD1 4.1Å; L185-L266 HydrophobicContact CG-CD1 3.77Å; L251-L266 HydrophobicContact CD2-CD1 3.9Å; L251-L266 HydrophobicContact CD2-CD2 3.59Å; L251-L266 HydrophobicContact CD2-CG 4.41Å; I263-L266 HydrophobicContact CD1-CB 3.91Å; I263-L266 HydrophobicContact CD1-CD1 4.1Å; I263-L266 HydrophobicContact CD1-CG 4.48Å; L266-L281 HydrophobicContact CD2-CD1 3.87Å; L266-I290 HydrophobicContact CB-CD1 4.45Å; L266-I290 HydrophobicContact CB-CG2 3.95Å; L266-I290 HydrophobicContact CD2-CD1 3.76Å; L266-Q292 PolarHBondContact N-O 3.02Å; L266-L293 HydrophobicContact CB-CD2 4.01Å; L266-L293 HydrophobicContact CD2-CD2 3.85Å; L266-L293 HydrophobicContact CG-CD2 4.42Å; L266-I294 PolarHBondContact O-N 3.15Å; L266-F295 HydrophobicContact CD2-CE1 4.07Å; L266-F295 HydrophobicContact CD2-CZ 4.37Å; L266-F295 HydrophobicContact CG-CE1 4.39Å
267	K	96.8	Very high	95.2	Very high	11 Å²	11	32.4 Å²	32.4	5%	0.048	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.4	170.2	169.6	175.4	177.5	-96	0	109	W161 L182 Y183 S184 L185 F194 E195 I294	W161-K267 HydrophobicContact CD2-CD 3.79Å; W161-K267 HydrophobicContact CD2-CG 4.3Å; W161-K267 HydrophobicContact CE3-CD 3.77Å; W161-K267 VanDerWaalsContact CE3-CE 3.45Å; W161-K267 HydrophobicContact CE3-CG 3.75Å; W161-K267 HydrophobicContact CG-CD 4.2Å; W161-K267 HydrophobicContact CH2-CD 4.41Å; W161-K267 HydrophobicContact CH2-CG 4.2Å; W161-K267 HydrophobicContact CZ2-CD 4.45Å; W161-K267 HydrophobicContact CZ3-CD 4.11Å; W161-K267 HydrophobicContact CZ3-CG 3.72Å; L182-K267 HydrophobicContact CD1-CB 4.33Å; Y183-K267 PolarHBondContact O-N 3.46Å; S184-K267 PolarHBondContact OG-NZ 2.7Å; L185-K267 PolarHBondContact N-O 3.26Å; F194-K267 HydrophobicContact CD1-CD 3.5Å; F194-K267 VanDerWaalsContact CD1-CD 3.5Å; F194-K267 HydrophobicContact CE1-CB 4.38Å; F194-K267 HydrophobicContact CE1-CD 3.86Å; F194-K267 HydrophobicContact CG-CD 4.43Å; E195-K267 WeakPolarHBondContact OE1-CD 3.33Å; E195-K267 WeakPolarHBondContact OE1-CE 3.34Å; E195-K267 IonicContact OE1-NZ 3.02Å; E195-K267 PolarHBondContact OE1-NZ 3.22Å; K267-I294 CarbonylContact C-O 3.49Å; K267-I294 WeakPolarHBondContact CA-O 3.44Å
268	A	95.2	Very high	95.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	127.3	178.4	0	0	0	0	0	112.3	L185 L270 I294 F295 E296	L185-A268 HydrophobicContact CB-CB 4.43Å; L185-A268 HydrophobicContact CD1-CB 4.31Å; A268-L270 HydrophobicContact CB-CD1 4.33Å; A268-L270 HydrophobicContact CB-CG 4.41Å; A268-I294 PolarHBondContact N-O 3.46Å; A268-F295 HydrophobicContact CB-CD1 3.67Å; A268-F295 HydrophobicContact CB-CE1 3.64Å; A268-F295 HydrophobicContact CB-CE2 4.5Å; A268-F295 HydrophobicContact CB-CG 4.13Å; A268-F295 HydrophobicContact CB-CZ 4.07Å; A268-F295 WeakPolarHBondContact O-CA 3Å; A268-E296 PolarHBondContact O-N 2.87Å
269	D	93.8	Very high	95.5	Very high	26 Å²	26	25.4 Å²	25.4	14%	0.139	13%	0.131	C	C	.	.			trans	-136.4	98.4	170.5	-165.1	-19.9	0	0	0	108.1	K159 W161 L185 G186 E296 H298	K159-D269 IonicContact NZ-OD2 3.81Å; W161-D269 HydrophobicContact CH2-CB 3.96Å; L185-D269 PolarHBondContact O-N 2.95Å; G186-D269 WeakPolarHBondContact CA-O 3.23Å; D269-E296 HydrophobicContact CB-CB 4.39Å; D269-H298 IonicContact OD1-CE1 3.87Å
270	L	93.1	Very high	95.5	Very high	5 Å²	5	24.3 Å²	24.3	3%	0.026	12%	0.115	C	C	.	.			trans	-129.1	22.8	-163.8	-58.8	175.4	0	0	0	112.6	L185 I230 A268 S272 A273 E274 V277	L185-L270 HydrophobicContact CB-CD2 3.93Å; I230-L270 HydrophobicContact CB-CD2 4.49Å; A268-L270 HydrophobicContact CB-CD1 4.33Å; A268-L270 HydrophobicContact CB-CG 4.41Å; L270-S272 VanDerWaalsContact C-N 3.35Å; L270-S272 PolarHBondContact O-N 3.47Å; L270-A273 HydrophobicContact CB-CB 3.97Å; L270-A273 WeakPolarHBondContact O-CB 3.41Å; L270-A273 PolarHBondContact O-N 3.35Å; L270-E274 WeakPolarHBondContact CA-OE1 3.41Å; L270-E274 HydrophobicContact CB-CG 4.09Å; L270-E274 PolarHBondContact N-OE1 2.91Å; L270-V277 HydrophobicContact CD1-CB 4.15Å; L270-V277 HydrophobicContact CD1-CG1 4.25Å; L270-V277 HydrophobicContact CD1-CG2 3.76Å
271	E	92.1	Very high	95.5	Very high	100 Å²	100	23.2 Å²	23.2	47%	0.467	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	53.1	173	-63.5	-70	169.9	0	0	112.5	L187 E274 H298 F304	L187-E271 HydrophobicContact CD1-CB 3.99Å; L187-E271 HydrophobicContact CD1-CG 3.87Å; E271-E274 PolarHBondContact N-OE1 3.42Å; E271-H298 IonicContact OE2-NE2 2.95Å; E271-F304 WeakPolarHBondContact O-CE2 3.46Å
272	S	92.7	Very high	95.7	Very high	1 Å²	1	17 Å²	17	1%	0.007	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	1	-179.9	-37.8	0	0	0	0	116.6	L270 E274 H298 W301 G303	L270-S272 VanDerWaalsContact C-N 3.35Å; L270-S272 PolarHBondContact O-N 3.47Å; S272-E274 VanDerWaalsContact C-N 3.26Å; S272-E274 WeakPolarHBondContact CA-OE2 3.47Å; S272-E274 PolarHBondContact N-OE1 2.74Å; S272-E274 PolarHBondContact N-OE2 3.44Å; S272-H298 PolarHBondContact N-ND1 3.19Å; S272-H298 WeakPolarHBondContact OG-CB 3.49Å; S272-W301 PolarHBondContact OG-NE1 3.24Å; S272-G303 WeakPolarHBondContact O-CA 3.31Å
273	A	94.3	Very high	95.7	Very high	11 Å²	11	13.7 Å²	13.7	9%	0.091	7%	0.069	C	C	.	.			trans	-79.9	-7.2	169.3	0	0	0	0	0	113.1	W232 L270 W275 K276 V277 F304	W232-A273 HydrophobicContact CE3-CB 4.26Å; W232-A273 HydrophobicContact CZ3-CB 3.8Å; L270-A273 HydrophobicContact CB-CB 3.97Å; L270-A273 WeakPolarHBondContact O-CB 3.41Å; L270-A273 PolarHBondContact O-N 3.35Å; A273-W275 PolarHBondContact O-N 3.28Å; A273-K276 PolarHBondContact O-N 2.74Å; A273-V277 WeakPolarHBondContact O-CG2 3.28Å; A273-V277 PolarHBondContact O-N 3.08Å; A273-F304 HydrophobicContact CB-CD2 3.95Å; A273-F304 HydrophobicContact CB-CE2 4.36Å
274	E	95.3	Very high	95.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-58.7	-35.1	-176.8	-52.5	81.8	-173.1	0	0	111.6	L270 E271 S272 V277 L278 F295 E296 H298	L270-E274 WeakPolarHBondContact CA-OE1 3.41Å; L270-E274 HydrophobicContact CB-CG 4.09Å; L270-E274 PolarHBondContact N-OE1 2.91Å; E271-E274 PolarHBondContact N-OE1 3.42Å; S272-E274 VanDerWaalsContact C-N 3.26Å; S272-E274 WeakPolarHBondContact CA-OE2 3.47Å; S272-E274 PolarHBondContact N-OE1 2.74Å; S272-E274 PolarHBondContact N-OE2 3.44Å; E274-V277 PolarHBondContact O-N 3.02Å; E274-L278 WeakPolarHBondContact O-CB 3.43Å; E274-L278 PolarHBondContact O-N 2.98Å; E274-F295 HydrophobicContact CB-CD2 3.89Å; E274-F295 HydrophobicContact CB-CE2 4.28Å; E274-F295 HydrophobicContact CG-CD2 4.47Å; E274-E296 VanDerWaalsContact CG-O 3.25Å; E274-E296 WeakPolarHBondContact CG-O 3.35Å; E274-E296 VanDerWaalsContact OE1-O 3.06Å; E274-H298 IonicContact OE1-CE1 3.97Å; E274-H298 IonicContact OE1-ND1 3.92Å; E274-H298 PolarHBondContact OE1-ND1 3.16Å; E274-H298 VanDerWaalsContact OE1-ND1 3.09Å; E274-H298 IonicContact OE2-ND1 2.67Å
275	W	96.4	Very high	95.3	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-62.5	-45.5	178.8	-61.8	116.6	0	0	0	112.9	F131 A273 E279 I297 H298 L299 V306 W317 L320 L321	F131-W275 AromaticContact CE2-CH2 3.86Å; F131-W275 HydrophobicContact CE2-CH2 3.86Å; F131-W275 AromaticContact CZ-CH2 3.74Å; F131-W275 HydrophobicContact CZ-CH2 3.74Å; F131-W275 HydrophobicContact CZ-CZ2 4.16Å; A273-W275 PolarHBondContact O-N 3.28Å; W275-E279 PolarHBondContact O-N 2.67Å; W275-I297 HydrophobicContact CH2-CB 4.31Å; W275-I297 HydrophobicContact CH2-CD1 4.08Å; W275-I297 HydrophobicContact CH2-CG2 4.11Å; W275-I297 HydrophobicContact CZ2-CB 3.95Å; W275-I297 HydrophobicContact CZ2-CD1 4.16Å; W275-I297 HydrophobicContact CZ2-CG2 4.14Å; W275-H298 PolarHBondContact NE1-O 3.42Å; W275-L299 HydrophobicContact CZ2-CD2 3.8Å; W275-V306 HydrophobicContact CB-CG2 4.45Å; W275-W317 AromaticContact CD1-CD1 3.99Å; W275-W317 AromaticContact CD1-NE1 3.48Å; W275-W317 HydrophobicContact CD2-CB 4.46Å; W275-W317 AromaticContact CD2-CD1 3.31Å; W275-W317 AromaticContact CD2-CG 3.91Å; W275-W317 HydrophobicContact CD2-CG 3.91Å; W275-W317 AromaticContact CD2-NE1 3.63Å; W275-W317 AromaticContact CE2-CD1 3.52Å; W275-W317 AromaticContact CE2-CD2 3.98Å; W275-W317 AromaticContact CE2-CE2 3.79Å; W275-W317 AromaticContact CE2-CG 3.79Å; W275-W317 AromaticContact CE2-NE1 3.54Å; W275-W317 HydrophobicContact CE3-CB 4.07Å; W275-W317 AromaticContact CE3-CD1 3.64Å; W275-W317 HydrophobicContact CE3-CG 4.01Å; W275-W317 AromaticContact CG-CD1 3.66Å; W275-W317 AromaticContact CG-NE1 3.6Å; W275-W317 HydrophobicContact CH2-CB 3.77Å; W275-W317 HydrophobicContact CH2-CD2 4.45Å; W275-W317 AromaticContact CH2-CG 3.95Å; W275-W317 HydrophobicContact CH2-CG 3.95Å; W275-W317 HydrophobicContact CZ2-CB 4.15Å; W275-W317 AromaticContact CZ2-CD2 3.95Å; W275-W317 HydrophobicContact CZ2-CD2 3.95Å; W275-W317 HydrophobicContact CZ2-CE3 4.47Å; W275-W317 AromaticContact CZ2-CG 3.83Å; W275-W317 HydrophobicContact CZ2-CG 3.83Å; W275-W317 HydrophobicContact CZ3-CB 3.71Å; W275-W317 HydrophobicContact CZ3-CG 4.03Å; W275-W317 AromaticContact NE1-CD1 3.9Å; W275-W317 AromaticContact NE1-CE2 3.63Å; W275-W317 AromaticContact NE1-CZ2 3.94Å; W275-W317 AromaticContact NE1-NE1 3.42Å; W275-L320 HydrophobicContact CB-CD1 4.39Å; W275-L320 HydrophobicContact CE3-CD1 3.94Å; W275-L320 VanDerWaalsContact O-CD1 3.31Å; W275-L320 WeakPolarHBondContact O-CD1 3.36Å; W275-L321 HydrophobicContact CZ3-CD2 4.32Å
276	K	95.9	Very high	95.2	Very high	23 Å²	23	21 Å²	21	10%	0.1	11%	0.105	C	C	.	.	H	α-helix	trans	-77.3	-34.6	179.2	-66.3	-64.1	-69.9	178.4	0	112.1	W232 A273 L278 E279 N280 F304 E305 V306	W232-K276 HydrophobicContact CB-CB 3.79Å; W232-K276 WeakPolarHBondContact CB-O 3.22Å; W232-K276 HydrophobicContact CD2-CB 3.43Å; W232-K276 VanDerWaalsContact CD2-CB 3.43Å; W232-K276 HydrophobicContact CD2-CG 4.1Å; W232-K276 HydrophobicContact CE3-CB 3.76Å; W232-K276 HydrophobicContact CE3-CG 4.5Å; W232-K276 HydrophobicContact CG-CB 3.45Å; W232-K276 VanDerWaalsContact CG-CB 3.45Å; W232-K276 HydrophobicContact CG-CG 4.33Å; A273-K276 PolarHBondContact O-N 2.74Å; K276-L278 VanDerWaalsContact C-N 3.35Å; K276-E279 WeakPolarHBondContact CD-OE2 3.47Å; K276-E279 VanDerWaalsContact CE-OE2 3.3Å; K276-E279 WeakPolarHBondContact CE-OE2 3.46Å; K276-E279 IonicContact NZ-OE2 2.65Å; K276-E279 PolarHBondContact NZ-OE2 3.24Å; K276-E279 PolarHBondContact O-N 3.46Å; K276-N280 PolarHBondContact O-N 3.06Å; K276-F304 WeakPolarHBondContact CD-O 3.31Å; K276-F304 WeakPolarHBondContact CG-O 3.28Å; K276-E305 HydrophobicContact CD-CB 4.32Å; K276-V306 HydrophobicContact CD-CG2 4.25Å
277	V	96.1	Very high	95.1	Very high	2 Å²	2	21 Å²	21	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-62	-47.1	172.3	170.1	0	0	0	0	109.5	I230 W232 L270 A273 E274 E279 N280 L281	I230-V277 HydrophobicContact CG2-CG1 4.45Å; I230-V277 HydrophobicContact CG2-CG2 4.25Å; W232-V277 HydrophobicContact CB-CG2 4.44Å; L270-V277 HydrophobicContact CD1-CB 4.15Å; L270-V277 HydrophobicContact CD1-CG1 4.25Å; L270-V277 HydrophobicContact CD1-CG2 3.76Å; A273-V277 WeakPolarHBondContact O-CG2 3.28Å; A273-V277 PolarHBondContact O-N 3.08Å; E274-V277 PolarHBondContact O-N 3.02Å; V277-E279 PolarHBondContact O-N 3.49Å; V277-N280 WeakPolarHBondContact O-CB 3.33Å; V277-N280 PolarHBondContact O-N 2.97Å; V277-N280 VanDerWaalsContact O-N 3.11Å; V277-L281 HydrophobicContact CG1-CD1 4.32Å; V277-L281 HydrophobicContact CG1-CG 4.34Å; V277-L281 VanDerWaalsContact O-CG 3.31Å; V277-L281 WeakPolarHBondContact O-CG 3.29Å; V277-L281 PolarHBondContact O-N 3.4Å
278	L	97.2	Very high	95	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-58.5	-45.6	175.6	-178.7	55.1	0	0	0	112.2	E274 K276 N280 L281 I282 F295 L320 L321 L324	E274-L278 WeakPolarHBondContact O-CB 3.43Å; E274-L278 PolarHBondContact O-N 2.98Å; K276-L278 VanDerWaalsContact C-N 3.35Å; L278-N280 VanDerWaalsContact C-N 3.31Å; L278-N280 PolarHBondContact O-N 2.81Å; L278-L281 PolarHBondContact O-N 2.9Å; L278-I282 HydrophobicContact CD1-CD1 4.07Å; L278-I282 HydrophobicContact CD1-CG1 4.33Å; L278-I282 HydrophobicContact CG-CD1 3.93Å; L278-I282 WeakPolarHBondContact O-CD1 3.42Å; L278-I282 VanDerWaalsContact O-CG1 3.31Å; L278-I282 WeakPolarHBondContact O-CG1 3.18Å; L278-I282 PolarHBondContact O-N 2.89Å; L278-F295 HydrophobicContact CB-CE2 4.05Å; L278-L320 HydrophobicContact CD2-CB 3.9Å; L278-L320 HydrophobicContact CG-CB 4.35Å; L278-L321 HydrophobicContact CD2-CD2 4.23Å; L278-L324 HydrophobicContact CD1-CD1 4.12Å; L278-L324 HydrophobicContact CD1-CD2 3.72Å; L278-L324 HydrophobicContact CD1-CG 3.99Å; L278-L324 HydrophobicContact CD2-CD1 4.06Å; L278-L324 HydrophobicContact CD2-CG 4.44Å
279	E	96.9	Very high	95	Very high	26 Å²	26	30 Å²	30	12%	0.121	15%	0.145	C	C	.	.	H	α-helix	trans	-55.1	-46.2	173.7	-179.2	177.9	-148.8	0	0	111.6	I112 W275 K276 V277 I282 L283 F316 L320	I112-E279 HydrophobicContact CD1-CG 4.26Å; I112-E279 HydrophobicContact CG1-CG 3.81Å; W275-E279 PolarHBondContact O-N 2.67Å; K276-E279 WeakPolarHBondContact CD-OE2 3.47Å; K276-E279 VanDerWaalsContact CE-OE2 3.3Å; K276-E279 WeakPolarHBondContact CE-OE2 3.46Å; K276-E279 IonicContact NZ-OE2 2.65Å; K276-E279 PolarHBondContact NZ-OE2 3.24Å; K276-E279 PolarHBondContact O-N 3.46Å; V277-E279 PolarHBondContact O-N 3.49Å; E279-I282 PolarHBondContact O-N 3.34Å; E279-L283 HydrophobicContact CG-CD1 3.83Å; E279-L283 HydrophobicContact CG-CG 4.36Å; E279-L283 VanDerWaalsContact O-CG 3.31Å; E279-L283 WeakPolarHBondContact O-CG 3.25Å; E279-L283 PolarHBondContact O-N 2.68Å; E279-F316 HydrophobicContact CB-CZ 4.47Å; E279-L320 HydrophobicContact CB-CD2 3.87Å; E279-L320 HydrophobicContact CG-CD2 4.32Å
280	N	96.1	Very high	95.2	Very high	20 Å²	20	28.8 Å²	28.8	11%	0.107	14%	0.138	C	C	.	.	H	α-helix	trans	-63.2	-43.1	176.7	179.9	-104.8	0	0	0	112.3	W232 K276 V277 L278 I282 L283 E284	W232-N280 HydrophobicContact CB-CB 4.1Å; W232-N280 PolarHBondContact O-ND2 3.3Å; K276-N280 PolarHBondContact O-N 3.06Å; V277-N280 WeakPolarHBondContact O-CB 3.33Å; V277-N280 PolarHBondContact O-N 2.97Å; V277-N280 VanDerWaalsContact O-N 3.11Å; L278-N280 VanDerWaalsContact C-N 3.31Å; L278-N280 PolarHBondContact O-N 2.81Å; N280-I282 PolarHBondContact O-N 2.87Å; N280-L283 PolarHBondContact O-N 2.67Å; N280-E284 PolarHBondContact ND2-OE1 3.2Å; N280-E284 WeakPolarHBondContact O-CB 3.37Å; N280-E284 PolarHBondContact O-N 2.67Å
281	L	96.4	Very high	95.4	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-37.1	177.4	-64.4	-179.4	0	0	0	112.3	L251 L266 V277 L278 D285 V286 L287 I290 F295	L251-L281 HydrophobicContact CB-CD2 3.89Å; L251-L281 HydrophobicContact CD2-CD2 3.59Å; L251-L281 HydrophobicContact CG-CD2 4.22Å; L266-L281 HydrophobicContact CD2-CD1 3.87Å; V277-L281 HydrophobicContact CG1-CD1 4.32Å; V277-L281 HydrophobicContact CG1-CG 4.34Å; V277-L281 VanDerWaalsContact O-CG 3.31Å; V277-L281 WeakPolarHBondContact O-CG 3.29Å; V277-L281 PolarHBondContact O-N 3.4Å; L278-L281 PolarHBondContact O-N 2.9Å; L281-D285 PolarHBondContact O-N 3.33Å; L281-V286 HydrophobicContact CD2-CB 3.87Å; L281-V286 HydrophobicContact CD2-CG1 3.74Å; L281-V286 HydrophobicContact CD2-CG2 4.46Å; L281-V286 PolarHBondContact O-N 3.04Å; L281-L287 HydrophobicContact CB-CD2 3.87Å; L281-L287 HydrophobicContact CB-CG 4.06Å; L281-L287 HydrophobicContact CD1-CD2 4.25Å; L281-I290 HydrophobicContact CD1-CD1 4.5Å; L281-F295 HydrophobicContact CD1-CZ 4.12Å
282	I	96.1	Very high	95.7	Very high	5 Å²	5	24 Å²	24	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-69.8	-52	176.4	-67	158.2	0	0	0	110.6	I112 L278 E279 N280 E284 D285 L287 L320 E323	I112-I282 HydrophobicContact CD1-CB 4.16Å; I112-I282 HydrophobicContact CD1-CD1 4.37Å; I112-I282 HydrophobicContact CD1-CG2 3.68Å; L278-I282 HydrophobicContact CD1-CD1 4.07Å; L278-I282 HydrophobicContact CD1-CG1 4.33Å; L278-I282 HydrophobicContact CG-CD1 3.93Å; L278-I282 WeakPolarHBondContact O-CD1 3.42Å; L278-I282 VanDerWaalsContact O-CG1 3.31Å; L278-I282 WeakPolarHBondContact O-CG1 3.18Å; L278-I282 PolarHBondContact O-N 2.89Å; E279-I282 PolarHBondContact O-N 3.34Å; N280-I282 PolarHBondContact O-N 2.87Å; I282-E284 VanDerWaalsContact C-N 3.29Å; I282-E284 PolarHBondContact O-N 3.11Å; I282-D285 PolarHBondContact O-N 2.95Å; I282-L287 HydrophobicContact CB-CD1 4.38Å; I282-L287 HydrophobicContact CG1-CD1 3.53Å; I282-L320 HydrophobicContact CD1-CB 4.39Å; I282-L320 HydrophobicContact CD1-CD2 3.81Å; I282-E323 HydrophobicContact CD1-CB 3.64Å; I282-E323 HydrophobicContact CD1-CG 4.35Å; I282-E323 HydrophobicContact CG1-CB 4.16Å; I282-E323 HydrophobicContact CG2-CB 4.04Å; I282-E323 HydrophobicContact CG2-CG 4.27Å
283	L	95.1	Very high	96	Very high	40 Å²	40	24 Å²	24	21%	0.209	12%	0.115	C	C	.	.	H	α-helix	trans	-68.8	-26.8	-173.6	-66.8	176.4	0	0	0	113.3	R109 I112 E279 N280	R109-L283 HydrophobicContact CB-CD2 4.34Å; R109-L283 HydrophobicContact CG-CD2 4Å; I112-L283 HydrophobicContact CD1-CD2 3.86Å; I112-L283 HydrophobicContact CD1-CG 4.09Å; I112-L283 HydrophobicContact CG1-CD2 4.49Å; E279-L283 HydrophobicContact CG-CD1 3.83Å; E279-L283 HydrophobicContact CG-CG 4.36Å; E279-L283 VanDerWaalsContact O-CG 3.31Å; E279-L283 WeakPolarHBondContact O-CG 3.25Å; E279-L283 PolarHBondContact O-N 2.68Å; N280-L283 PolarHBondContact O-N 2.67Å
284	E	93.1	Very high	96.1	Very high	75 Å²	75	23.4 Å²	23.4	35%	0.35	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	8.1	177.9	-64.4	-164.8	-168.9	0	0	114.1	K250 N280 I282 V286	K250-E284 WeakPolarHBondContact CD-OE1 3.25Å; K250-E284 WeakPolarHBondContact CD-OE2 3.47Å; K250-E284 WeakPolarHBondContact CE-OE2 3.23Å; K250-E284 IonicContact NZ-OE1 3.59Å; K250-E284 PolarHBondContact NZ-OE1 2.65Å; K250-E284 IonicContact NZ-OE2 3.72Å; K250-E284 PolarHBondContact NZ-OE2 3.12Å; N280-E284 PolarHBondContact ND2-OE1 3.2Å; N280-E284 WeakPolarHBondContact O-CB 3.37Å; N280-E284 PolarHBondContact O-N 2.67Å; I282-E284 VanDerWaalsContact C-N 3.29Å; I282-E284 PolarHBondContact O-N 3.11Å; E284-V286 HydrophobicContact CB-CG2 3.87Å; E284-V286 PolarHBondContact O-N 2.96Å; E284-V286 VanDerWaalsContact O-N 3.16Å
285	D	93.4	Very high	96.2	Very high	84 Å²	84	23.6 Å²	23.6	45%	0.449	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	32.7	-178.5	-68.6	-50.2	0	0	0	113.1	L281 I282 K327	L281-D285 PolarHBondContact O-N 3.33Å; I282-D285 PolarHBondContact O-N 2.95Å; D285-K327 IonicContact OD1-NZ 3.46Å; D285-K327 PolarHBondContact OD1-NZ 3.24Å
286	V	95.7	Very high	96.1	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.03	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-75.9	-28.9	179.4	178.9	0	0	0	0	111.2	L251 L255 L281 E284 E288 R289 I290	L251-V286 HydrophobicContact CD2-CG1 4.4Å; L255-V286 HydrophobicContact CD1-CG1 3.75Å; L281-V286 HydrophobicContact CD2-CB 3.87Å; L281-V286 HydrophobicContact CD2-CG1 3.74Å; L281-V286 HydrophobicContact CD2-CG2 4.46Å; L281-V286 PolarHBondContact O-N 3.04Å; E284-V286 HydrophobicContact CB-CG2 3.87Å; E284-V286 PolarHBondContact O-N 2.96Å; E284-V286 VanDerWaalsContact O-N 3.16Å; V286-E288 PolarHBondContact O-N 2.91Å; V286-E288 VanDerWaalsContact O-N 3.08Å; V286-R289 WeakPolarHBondContact O-CB 3.31Å; V286-R289 PolarHBondContact O-N 3.42Å; V286-I290 HydrophobicContact CG1-CD1 4.42Å
287	L	95.9	Very high	96.2	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-54.2	-30	-178.6	-68.7	178.1	0	0	0	114.1	L281 I282 R289 I290 L293 L324 K327 F329	L281-L287 HydrophobicContact CB-CD2 3.87Å; L281-L287 HydrophobicContact CB-CG 4.06Å; L281-L287 HydrophobicContact CD1-CD2 4.25Å; I282-L287 HydrophobicContact CB-CD1 4.38Å; I282-L287 HydrophobicContact CG1-CD1 3.53Å; L287-R289 PolarHBondContact O-N 3.39Å; L287-R289 VanDerWaalsContact O-N 3.16Å; L287-I290 HydrophobicContact CD2-CD1 4.45Å; L287-I290 PolarHBondContact O-N 3.18Å; L287-I290 VanDerWaalsContact O-N 3.1Å; L287-L293 HydrophobicContact CD2-CD1 3.92Å; L287-L293 HydrophobicContact CD2-CD2 4.43Å; L287-L324 HydrophobicContact CD1-CD2 3.7Å; L287-L324 HydrophobicContact CD2-CD2 3.94Å; L287-L324 HydrophobicContact CG-CD2 4.49Å; L287-K327 HydrophobicContact CD1-CB 4.23Å; L287-K327 HydrophobicContact CD1-CG 4.09Å; L287-F329 HydrophobicContact CB-CE2 4.03Å; L287-F329 HydrophobicContact CD2-CE2 4.49Å
288	E	94.3	Very high	96.2	Very high	121 Å²	121	23 Å²	23	57%	0.565	11%	0.11	S	C	*	.	G	3₁₀ helix	trans	-66.7	-14.1	178.6	-65.9	179.2	-169.3	0	0	113.2	V286 K327	V286-E288 PolarHBondContact O-N 2.91Å; V286-E288 VanDerWaalsContact O-N 3.08Å; E288-K327 IonicContact OE1-NZ 3.35Å; E288-K327 PolarHBondContact OE1-NZ 3.02Å
289	R	95.8	Very high	96.2	Very high	80 Å²	80	22.9 Å²	22.9	30%	0.302	11%	0.109	S	C	.	.	G	3₁₀ helix	trans	-95.5	5.3	177.1	-54.7	-176.7	-171.8	-173.3	2.8	113	N256 H261 K262 I263 V286 L287 W365	N256-R289 PolarHBondContact OD1-NH1 2.8Å; H261-R289 WeakPolarHBondContact O-CB 3.49Å; H261-R289 WeakPolarHBondContact O-CD 3.13Å; H261-R289 WeakPolarHBondContact O-CG 3.48Å; K262-R289 WeakPolarHBondContact CA-O 3.42Å; I263-R289 PolarHBondContact N-O 3.4Å; V286-R289 WeakPolarHBondContact O-CB 3.31Å; V286-R289 PolarHBondContact O-N 3.42Å; L287-R289 PolarHBondContact O-N 3.39Å; L287-R289 VanDerWaalsContact O-N 3.16Å; R289-W365 VanDerWaalsContact C-CH2 3.41Å; R289-W365 VanDerWaalsContact C-CZ3 3.48Å; R289-W365 VanDerWaalsContact O-CH2 3.25Å; R289-W365 WeakPolarHBondContact O-CH2 3.37Å
290	I	97.6	Very high	96	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130.1	-172	-48.6	177.9	0	0	0	110.5	L251 I263 L266 L281 V286 L287 Q292 L293 F329 N362 W365	L251-I290 HydrophobicContact CD2-CD1 4.39Å; I263-I290 HydrophobicContact CD1-CD1 4.25Å; I263-I290 HydrophobicContact CD1-CG1 3.91Å; I263-I290 HydrophobicContact CD1-CG2 4.35Å; I263-I290 HydrophobicContact CG1-CB 4.26Å; I263-I290 HydrophobicContact CG1-CG1 3.82Å; I263-I290 HydrophobicContact CG1-CG2 4.17Å; I263-I290 WeakPolarHBondContact O-CA 3.44Å; L266-I290 HydrophobicContact CB-CD1 4.45Å; L266-I290 HydrophobicContact CB-CG2 3.95Å; L266-I290 HydrophobicContact CD2-CD1 3.76Å; L281-I290 HydrophobicContact CD1-CD1 4.5Å; V286-I290 HydrophobicContact CG1-CD1 4.42Å; L287-I290 HydrophobicContact CD2-CD1 4.45Å; L287-I290 PolarHBondContact O-N 3.18Å; L287-I290 VanDerWaalsContact O-N 3.1Å; I290-Q292 WeakPolarHBondContact CG2-O 3.4Å; I290-L293 HydrophobicContact CB-CD2 4.33Å; I290-L293 HydrophobicContact CD1-CD2 3.9Å; I290-L293 HydrophobicContact CG2-CD2 3.64Å; I290-L293 HydrophobicContact CG2-CG 4.26Å; I290-F329 HydrophobicContact CB-CZ 4.24Å; I290-F329 VanDerWaalsContact O-CZ 3.3Å; I290-F329 WeakPolarHBondContact O-CZ 3.4Å; I290-N362 PolarHBondContact O-ND2 3.13Å; I290-W365 VanDerWaalsContact C-CZ3 3.44Å
291	G	97.6	Very high	96	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-51.1	175.6	0	0	0	0	0	113.8	I263 D264 N362 W365	I263-G291 PolarHBondContact O-N 3.48Å; D264-G291 CarbonylContact O-C 3.37Å; D264-G291 WeakPolarHBondContact O-CA 3.38Å; G291-N362 WeakPolarHBondContact O-CB 3.33Å; G291-N362 PolarHBondContact O-N 3.26Å; G291-W365 VanDerWaalsContact CA-CE2 3.47Å
292	Q	98	Very high	96	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.009	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.1	-179	-59.4	-168.9	43.3	0	0	111.2	C164 D264 I265 L266 I290 W360 V361	C164-Q292 PolarHBondContact O-NE2 2.97Å; D264-Q292 PolarHBondContact O-N 2.98Å; I265-Q292 WeakPolarHBondContact CA-O 3.48Å; L266-Q292 PolarHBondContact N-O 3.02Å; I290-Q292 WeakPolarHBondContact CG2-O 3.4Å; Q292-W360 WeakPolarHBondContact CA-O 3.46Å; Q292-V361 HydrophobicContact CG-CB 4.36Å; Q292-V361 HydrophobicContact CG-CG2 4.05Å
293	L	98.1	Very high	95.8	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.9	177.9	-61.4	169	0	0	0	108.6	L266 L287 I290 F295 L324 F329 S359 W360	L266-L293 HydrophobicContact CB-CD2 4.01Å; L266-L293 HydrophobicContact CD2-CD2 3.85Å; L266-L293 HydrophobicContact CG-CD2 4.42Å; L287-L293 HydrophobicContact CD2-CD1 3.92Å; L287-L293 HydrophobicContact CD2-CD2 4.43Å; I290-L293 HydrophobicContact CB-CD2 4.33Å; I290-L293 HydrophobicContact CD1-CD2 3.9Å; I290-L293 HydrophobicContact CG2-CD2 3.64Å; I290-L293 HydrophobicContact CG2-CG 4.26Å; L293-F295 HydrophobicContact CB-CD1 4.46Å; L293-F295 HydrophobicContact CB-CE1 4.42Å; L293-F295 HydrophobicContact CD2-CE1 4.17Å; L293-L324 HydrophobicContact CD1-CD1 4.46Å; L293-L324 HydrophobicContact CD1-CD2 3.57Å; L293-F329 HydrophobicContact CB-CE1 4.47Å; L293-F329 HydrophobicContact CD1-CD1 3.63Å; L293-F329 HydrophobicContact CD1-CD2 4.43Å; L293-F329 HydrophobicContact CD1-CE1 3.53Å; L293-F329 HydrophobicContact CD1-CE2 4.36Å; L293-F329 HydrophobicContact CD1-CG 4.09Å; L293-F329 HydrophobicContact CD1-CZ 3.9Å; L293-F329 HydrophobicContact CG-CD1 3.96Å; L293-F329 HydrophobicContact CG-CE1 3.51Å; L293-F329 HydrophobicContact CG-CZ 4.08Å; L293-S359 CarbonylContact O-C 3.59Å; L293-S359 WeakPolarHBondContact O-CA 3.31Å; L293-W360 HydrophobicContact CB-CB 4.39Å; L293-W360 HydrophobicContact CB-CE3 4.09Å; L293-W360 PolarHBondContact N-O 3.13Å; L293-W360 PolarHBondContact O-N 3.3Å
294	I	97.3	Very high	95.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	106.3	173.4	-48.2	169.6	0	0	0	108.5	W161 S162 V163 F194 I265 L266 K267 A268 T357 L358	W161-I294 HydrophobicContact CE3-CB 4.46Å; W161-I294 HydrophobicContact CE3-CG2 3.64Å; W161-I294 HydrophobicContact CZ3-CG2 4.13Å; S162-I294 WeakPolarHBondContact O-CD1 3.21Å; V163-I294 HydrophobicContact CG1-CD1 3.6Å; F194-I294 HydrophobicContact CZ-CD1 4.21Å; I265-I294 HydrophobicContact CG2-CD1 4.04Å; L266-I294 PolarHBondContact O-N 3.15Å; K267-I294 CarbonylContact C-O 3.49Å; K267-I294 WeakPolarHBondContact CA-O 3.44Å; A268-I294 PolarHBondContact N-O 3.46Å; I294-T357 HydrophobicContact CG2-CG2 3.8Å; I294-L358 CarbonylContact C-O 3.6Å; I294-L358 VanDerWaalsContact CA-O 3.32Å; I294-L358 WeakPolarHBondContact CA-O 3.4Å
295	F	96.8	Very high	95.6	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.013	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.8	-175.9	-76.6	24.9	0	0	0	110.1	L266 A268 E274 L278 L281 L293 I297 T357 L358 W360	L266-F295 HydrophobicContact CD2-CE1 4.07Å; L266-F295 HydrophobicContact CD2-CZ 4.37Å; L266-F295 HydrophobicContact CG-CE1 4.39Å; A268-F295 HydrophobicContact CB-CD1 3.67Å; A268-F295 HydrophobicContact CB-CE1 3.64Å; A268-F295 HydrophobicContact CB-CE2 4.5Å; A268-F295 HydrophobicContact CB-CG 4.13Å; A268-F295 HydrophobicContact CB-CZ 4.07Å; A268-F295 WeakPolarHBondContact O-CA 3Å; E274-F295 HydrophobicContact CB-CD2 3.89Å; E274-F295 HydrophobicContact CB-CE2 4.28Å; E274-F295 HydrophobicContact CG-CD2 4.47Å; L278-F295 HydrophobicContact CB-CE2 4.05Å; L281-F295 HydrophobicContact CD1-CZ 4.12Å; L293-F295 HydrophobicContact CB-CD1 4.46Å; L293-F295 HydrophobicContact CB-CE1 4.42Å; L293-F295 HydrophobicContact CD2-CE1 4.17Å; F295-I297 HydrophobicContact CB-CG2 4.21Å; F295-I297 PolarHBondContact O-N 3.41Å; F295-T357 WeakPolarHBondContact O-CA 3.41Å; F295-L358 PolarHBondContact N-O 3.13Å; F295-L358 PolarHBondContact O-N 3.42Å; F295-W360 HydrophobicContact CB-CZ3 4.02Å; F295-W360 HydrophobicContact CG-CZ3 4.4Å
296	E	95.9	Very high	95.5	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.028	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	105.3	157.9	-170.7	171.6	101.2	0	0	108.7	K159 W161 A268 D269 E274 H298 C355 Y356	K159-E296 WeakPolarHBondContact CD-OE2 3.33Å; K159-E296 WeakPolarHBondContact CE-OE2 3.48Å; K159-E296 IonicContact NZ-OE2 2.86Å; K159-E296 PolarHBondContact NZ-OE2 2.98Å; W161-E296 HydrophobicContact CH2-CB 4.23Å; A268-E296 PolarHBondContact O-N 2.87Å; D269-E296 HydrophobicContact CB-CB 4.39Å; E274-E296 VanDerWaalsContact CG-O 3.25Å; E274-E296 WeakPolarHBondContact CG-O 3.35Å; E274-E296 VanDerWaalsContact OE1-O 3.06Å; E296-H298 IonicContact OE1-CE1 3.41Å; E296-H298 PolarHBondContact OE1-CE1 3.32Å; E296-H298 IonicContact OE1-NE2 2.67Å; E296-H298 PolarHBondContact OE1-NE2 2.93Å; E296-H298 VanDerWaalsContact OE1-NE2 3.08Å; E296-C355 WeakPolarHBondContact CG-SG 3.43Å; E296-C355 PolarHBondContact OE1-SG 3.48Å; E296-C355 PolarHBondContact OE2-SG 3.42Å; E296-Y356 CarbonylContact C-O 3.29Å; E296-Y356 WeakPolarHBondContact CA-O 3.3Å
297	I	96.4	Very high	95.3	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132.5	176.6	59	161.5	0	0	0	110.9	F131 I135 W275 F295 L299 C355 Y356 L358	F131-I297 HydrophobicContact CZ-CD1 4.07Å; I135-I297 HydrophobicContact CD1-CD1 4.14Å; I135-I297 HydrophobicContact CG2-CD1 4.37Å; W275-I297 HydrophobicContact CH2-CB 4.31Å; W275-I297 HydrophobicContact CH2-CD1 4.08Å; W275-I297 HydrophobicContact CH2-CG2 4.11Å; W275-I297 HydrophobicContact CZ2-CB 3.95Å; W275-I297 HydrophobicContact CZ2-CD1 4.16Å; W275-I297 HydrophobicContact CZ2-CG2 4.14Å; F295-I297 HydrophobicContact CB-CG2 4.21Å; F295-I297 PolarHBondContact O-N 3.41Å; I297-L299 HydrophobicContact CD1-CD2 4.11Å; I297-L299 HydrophobicContact CD1-CG 4.48Å; I297-C355 WeakPolarHBondContact O-CA 3.09Å; I297-Y356 WeakPolarHBondContact CG1-O 3.33Å; I297-Y356 PolarHBondContact N-O 3.06Å; I297-Y356 PolarHBondContact O-N 3.36Å; I297-Y356 VanDerWaalsContact O-N 3.07Å; I297-L358 HydrophobicContact CD1-CD1 3.4Å; I297-L358 VanDerWaalsContact CD1-CD1 3.4Å; I297-L358 HydrophobicContact CD1-CG 4.15Å; I297-L358 HydrophobicContact CG1-CD1 3.89Å; I297-L358 HydrophobicContact CG1-CG 4.17Å; I297-L358 HydrophobicContact CG2-CD1 4.44Å
298	H	96	Very high	95.2	Very high	7 Å²	7	36.5 Å²	36.5	3%	0.032	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124	177.2	-70.3	88.5	0	0	0	110.8	D269 E271 S272 E274 W275 E296 S354	D269-H298 IonicContact OD1-CE1 3.87Å; E271-H298 IonicContact OE2-NE2 2.95Å; S272-H298 PolarHBondContact N-ND1 3.19Å; S272-H298 WeakPolarHBondContact OG-CB 3.49Å; E274-H298 IonicContact OE1-CE1 3.97Å; E274-H298 IonicContact OE1-ND1 3.92Å; E274-H298 PolarHBondContact OE1-ND1 3.16Å; E274-H298 VanDerWaalsContact OE1-ND1 3.09Å; E274-H298 IonicContact OE2-ND1 2.67Å; W275-H298 PolarHBondContact NE1-O 3.42Å; E296-H298 IonicContact OE1-CE1 3.41Å; E296-H298 PolarHBondContact OE1-CE1 3.32Å; E296-H298 IonicContact OE1-NE2 2.67Å; E296-H298 PolarHBondContact OE1-NE2 2.93Å; E296-H298 VanDerWaalsContact OE1-NE2 3.08Å; H298-S354 CarbonylContact C-O 3.18Å; H298-S354 WeakPolarHBondContact CA-O 3.3Å
299	L	96.9	Very high	95.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.			trans	-112.7	-6.1	-174	-59.1	-174.7	0	0	0	114.2	F131 L132 I135 W275 I297 W301 W317 F344 L345 S354 Y356	F131-L299 HydrophobicContact CE1-CD1 3.9Å; F131-L299 HydrophobicContact CE1-CD2 3.75Å; F131-L299 HydrophobicContact CZ-CD2 3.87Å; L132-L299 HydrophobicContact CD2-CD1 4.38Å; I135-L299 HydrophobicContact CD1-CD1 4.17Å; W275-L299 HydrophobicContact CZ2-CD2 3.8Å; I297-L299 HydrophobicContact CD1-CD2 4.11Å; I297-L299 HydrophobicContact CD1-CG 4.48Å; L299-W301 PolarHBondContact O-N 2.78Å; L299-W317 HydrophobicContact CD2-CE3 4.06Å; L299-W317 HydrophobicContact CD2-CH2 4.05Å; L299-W317 HydrophobicContact CD2-CZ3 3.73Å; L299-F344 HydrophobicContact CB-CD2 4.16Å; L299-F344 HydrophobicContact CB-CE2 4.5Å; L299-F344 HydrophobicContact CD1-CD2 4.12Å; L299-F344 HydrophobicContact CD1-CE2 4.09Å; L299-L345 PolarHBondContact O-N 3.31Å; L299-S354 PolarHBondContact N-O 3.05Å; L299-Y356 HydrophobicContact CD1-CD2 3.58Å; L299-Y356 HydrophobicContact CD1-CE2 3.54Å; L299-Y356 HydrophobicContact CG-CD2 4.36Å
300	H	94.6	Very high	95.5	Very high	62 Å²	62	32.4 Å²	32.4	29%	0.287	19%	0.189	S	C	.	.	S	Bend	trans	-69.6	-14.4	-178.1	64	-81.5	0	0	0	113.8	L343 L345 K346	H300-L343 HydrophobicContact CB-CB 4.13Å; H300-L345 CarbonylContact O-C 3.56Å; H300-K346 WeakPolarHBondContact O-CG 3.39Å; H300-K346 PolarHBondContact O-N 3.42Å
301	W	95.3	Very high	95.5	Very high	63 Å²	63	33.2 Å²	33.2	24%	0.239	20%	0.195	C	C	.	.	S	Bend	trans	-154.4	168.7	172	78	-72.4	0	0	0	110.8	S272 L299 G303 F304 W317	S272-W301 PolarHBondContact OG-NE1 3.24Å; L299-W301 PolarHBondContact O-N 2.78Å; W301-G303 VanDerWaalsContact C-N 3.27Å; W301-G303 VanDerWaalsContact CD2-N 3.32Å; W301-G303 VanDerWaalsContact CH2-CA 3.47Å; W301-G303 VanDerWaalsContact CH2-O 3.31Å; W301-G303 WeakPolarHBondContact CH2-O 3.33Å; W301-G303 WeakPolarHBondContact CZ3-O 3.26Å; W301-G303 PolarHBondContact O-N 2.79Å; W301-G303 VanDerWaalsContact O-N 3.13Å; W301-F304 HydrophobicContact CH2-CB 4.22Å; W301-F304 AromaticContact CH2-CD1 3.86Å; W301-F304 HydrophobicContact CH2-CD1 3.86Å; W301-F304 AromaticContact CH2-CD2 3.95Å; W301-F304 HydrophobicContact CH2-CD2 3.95Å; W301-F304 HydrophobicContact CH2-CE1 4.17Å; W301-F304 HydrophobicContact CH2-CE2 4.26Å; W301-F304 AromaticContact CH2-CG 3.74Å; W301-F304 HydrophobicContact CH2-CG 3.74Å; W301-F304 HydrophobicContact CH2-CZ 4.36Å; W301-F304 HydrophobicContact CZ2-CD1 4.35Å; W301-F304 AromaticContact CZ2-CD2 3.8Å; W301-F304 HydrophobicContact CZ2-CD2 3.8Å; W301-F304 HydrophobicContact CZ2-CE1 4.34Å; W301-F304 AromaticContact CZ2-CE2 3.81Å; W301-F304 HydrophobicContact CZ2-CE2 3.81Å; W301-F304 HydrophobicContact CZ2-CG 4.09Å; W301-F304 HydrophobicContact CZ2-CZ 4.08Å; W301-W317 WeakPolarHBondContact O-CZ2 3.33Å
302	P	95.4	Very high	95.5	Very high	31 Å²	31	35 Å²	35	20%	0.201	21%	0.207	C	C	.	.			trans	-56.5	-26.3	-173	-32.6	36.9	0	0	0	118.2	V306 V313 W317 L345	P302-V306 HydrophobicContact CB-CB 4.15Å; P302-V306 HydrophobicContact CB-CG1 4.32Å; P302-V306 WeakPolarHBondContact O-CB 3.45Å; P302-V306 WeakPolarHBondContact O-CG2 3.46Å; P302-V313 HydrophobicContact CB-CG1 3.77Å; P302-V313 HydrophobicContact CB-CG2 3.99Å; P302-V313 HydrophobicContact CG-CG1 4.23Å; P302-V313 HydrophobicContact CG-CG2 4.13Å; P302-W317 WeakPolarHBondContact O-CZ2 3.31Å; P302-W317 PolarHBondContact O-NE1 3.39Å; P302-W317 VanDerWaalsContact O-NE1 3.07Å; P302-L345 HydrophobicContact CG-CD2 3.91Å
303	G	92.8	Very high	95.5	Very high	1 Å²	1	35 Å²	35	1%	0.01	21%	0.207	C	C	.	.			trans	91.9	163.2	-167.3	0	0	0	0	0	112.9	S272 W301 V306	S272-G303 WeakPolarHBondContact O-CA 3.31Å; W301-G303 VanDerWaalsContact C-N 3.27Å; W301-G303 VanDerWaalsContact CD2-N 3.32Å; W301-G303 VanDerWaalsContact CH2-CA 3.47Å; W301-G303 VanDerWaalsContact CH2-O 3.31Å; W301-G303 WeakPolarHBondContact CH2-O 3.33Å; W301-G303 WeakPolarHBondContact CZ3-O 3.26Å; W301-G303 PolarHBondContact O-N 2.79Å; W301-G303 VanDerWaalsContact O-N 3.13Å; G303-V306 PolarHBondContact O-N 2.98Å
304	F	91.8	Very high	95.6	Very high	93 Å²	93	35 Å²	35	41%	0.408	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	136.4	-172.2	-68.5	-85.8	0	0	0	111.8	W232 E271 A273 K276 W301 V306	W232-F304 HydrophobicContact CH2-CB 3.36Å; W232-F304 HydrophobicContact CH2-CD1 4.44Å; W232-F304 HydrophobicContact CH2-CD2 4.45Å; W232-F304 AromaticContact CH2-CG 3.87Å; W232-F304 HydrophobicContact CH2-CG 3.87Å; W232-F304 HydrophobicContact CZ2-CB 3.89Å; W232-F304 HydrophobicContact CZ3-CB 4.04Å; W232-F304 HydrophobicContact CZ3-CG 4.4Å; E271-F304 WeakPolarHBondContact O-CE2 3.46Å; A273-F304 HydrophobicContact CB-CD2 3.95Å; A273-F304 HydrophobicContact CB-CE2 4.36Å; K276-F304 WeakPolarHBondContact CD-O 3.31Å; K276-F304 WeakPolarHBondContact CG-O 3.28Å; W301-F304 HydrophobicContact CH2-CB 4.22Å; W301-F304 AromaticContact CH2-CD1 3.86Å; W301-F304 HydrophobicContact CH2-CD1 3.86Å; W301-F304 AromaticContact CH2-CD2 3.95Å; W301-F304 HydrophobicContact CH2-CD2 3.95Å; W301-F304 HydrophobicContact CH2-CE1 4.17Å; W301-F304 HydrophobicContact CH2-CE2 4.26Å; W301-F304 AromaticContact CH2-CG 3.74Å; W301-F304 HydrophobicContact CH2-CG 3.74Å; W301-F304 HydrophobicContact CH2-CZ 4.36Å; W301-F304 HydrophobicContact CZ2-CD1 4.35Å; W301-F304 AromaticContact CZ2-CD2 3.8Å; W301-F304 HydrophobicContact CZ2-CD2 3.8Å; W301-F304 HydrophobicContact CZ2-CE1 4.34Å; W301-F304 AromaticContact CZ2-CE2 3.81Å; W301-F304 HydrophobicContact CZ2-CE2 3.81Å; W301-F304 HydrophobicContact CZ2-CG 4.09Å; W301-F304 HydrophobicContact CZ2-CZ 4.08Å; F304-V306 PolarHBondContact O-N 3.09Å
305	E	92.1	Very high	95.6	Very high	101 Å²	101	36.9 Å²	36.9	47%	0.472	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	19.1	-178.1	-58.6	-174.7	158.2	0	0	115	W232 R233 K276	W232-E305 HydrophobicContact CZ2-CG 4.02Å; W232-E305 PolarHBondContact NE1-OE2 3.44Å; R233-E305 IonicContact CZ-OE1 2.81Å; R233-E305 IonicContact CZ-OE2 3.32Å; R233-E305 IonicContact NE-OE2 3.54Å; R233-E305 IonicContact NH1-OE1 3.62Å; R233-E305 PolarHBondContact NH1-OE1 3.39Å; R233-E305 IonicContact NH1-OE2 3.43Å; R233-E305 PolarHBondContact NH1-OE2 2.95Å; R233-E305 IonicContact NH2-OE1 2.59Å; R233-E305 IonicContact NH2-OE2 3.83Å; R233-E305 PolarHBondContact NH2-OE2 3.22Å; K276-E305 HydrophobicContact CD-CB 4.32Å
306	V	92.1	Very high	95.7	Very high	19 Å²	19	38 Å²	38	12%	0.115	22%	0.219	C	C	.	.			trans	-96.4	118.1	169.8	-173	0	0	0	0	107.3	W275 K276 P302 G303 F304 V313 F316	W275-V306 HydrophobicContact CB-CG2 4.45Å; K276-V306 HydrophobicContact CD-CG2 4.25Å; P302-V306 HydrophobicContact CB-CB 4.15Å; P302-V306 HydrophobicContact CB-CG1 4.32Å; P302-V306 WeakPolarHBondContact O-CB 3.45Å; P302-V306 WeakPolarHBondContact O-CG2 3.46Å; G303-V306 PolarHBondContact O-N 2.98Å; F304-V306 PolarHBondContact O-N 3.09Å; V306-V313 HydrophobicContact CG1-CB 4.46Å; V306-V313 HydrophobicContact CG1-CG1 4.05Å; V306-V313 HydrophobicContact CG1-CG2 4.16Å; V306-F316 HydrophobicContact CG1-CD1 3.79Å; V306-F316 HydrophobicContact CG1-CE1 4.22Å; V306-F316 HydrophobicContact CG2-CD1 4.29Å; V306-F316 HydrophobicContact CG2-CE1 3.9Å
307	S	90.5	Very high	95.8	Very high	110 Å²	110	37.8 Å²	37.8	77%	0.769	22%	0.218	S	C	*	.			trans	-132.2	161.7	-173.5	65.4	0	0	0	0	111.5
308	G	94.9	Very high	95.9	Very high	62 Å²	62	39.1 Å²	39.1	64%	0.639	22%	0.223	S	C	*	.	S	Bend	trans	125.7	-170.9	-177.6	0	0	0	0	0	111.6
309	S	97.4	Very high	96	Very high	60 Å²	60	38.8 Å²	38.8	42%	0.42	22%	0.222	S	C	.	.			trans	-69.4	160	170.2	72	0	0	0	0	110.8	S311 S312 V313	S309-S311 PolarHBondContact O-N 3.26Å; S309-S311 PolarHBondContact OG-OG 3.37Å; S309-S312 WeakPolarHBondContact O-CA 3.26Å; S309-S312 WeakPolarHBondContact O-CB 3.39Å; S309-S312 PolarHBondContact O-N 3.46Å; S309-S312 PolarHBondContact OG-N 2.82Å; S309-S312 PolarHBondContact OG-OG 3.02Å; S309-V313 WeakPolarHBondContact O-CG2 3.37Å; S309-V313 PolarHBondContact O-N 2.99Å
310	D	97.8	Very high	96.1	Very high	56 Å²	56	38.8 Å²	38.8	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-55.6	-39.6	177.7	-66.5	-40.3	0	0	0	112.2	L124 V313 V314 L345 K347	L124-D310 HydrophobicContact CD1-CB 3.78Å; L124-D310 HydrophobicContact CD2-CB 3.94Å; L124-D310 HydrophobicContact CG-CB 4.35Å; D310-V313 PolarHBondContact O-N 2.65Å; D310-V314 WeakPolarHBondContact O-CG2 3.29Å; D310-V314 PolarHBondContact O-N 3.05Å; D310-L345 HydrophobicContact CB-CD1 3.72Å; D310-K347 VanDerWaalsContact CG-NZ 3.3Å; D310-K347 IonicContact OD1-NZ 2.82Å; D310-K347 WeakPolarHBondContact OD2-CE 3.47Å; D310-K347 IonicContact OD2-NZ 2.72Å; D310-K347 PolarHBondContact OD2-NZ 3.42Å
311	S	98.1	Very high	96.3	Very high	16 Å²	16	35.9 Å²	35.9	11%	0.112	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-38.4	176.2	61.7	0	0	0	0	112	Q122 S309 V313 R315	Q122-S311 VanDerWaalsContact O-CB 3.3Å; Q122-S311 WeakPolarHBondContact O-CB 3.19Å; Q122-S311 PolarHBondContact O-OG 3.29Å; S309-S311 PolarHBondContact O-N 3.26Å; S309-S311 PolarHBondContact OG-OG 3.37Å; S311-V313 VanDerWaalsContact C-N 3.34Å; S311-V313 PolarHBondContact O-N 3.03Å; S311-R315 WeakPolarHBondContact O-CB 3.26Å; S311-R315 PolarHBondContact O-N 3.21Å
312	S	98.1	Very high	96.4	Very high	40 Å²	40	34.8 Å²	34.8	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-62.1	-40.2	173.4	-51.8	0	0	0	0	112.4	S309 F316	S309-S312 WeakPolarHBondContact O-CA 3.26Å; S309-S312 WeakPolarHBondContact O-CB 3.39Å; S309-S312 PolarHBondContact O-N 3.46Å; S309-S312 PolarHBondContact OG-N 2.82Å; S309-S312 PolarHBondContact OG-OG 3.02Å; S312-F316 WeakPolarHBondContact O-CB 3.4Å; S312-F316 PolarHBondContact O-N 2.76Å
313	V	98.2	Very high	96.5	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-50.9	178.5	169.6	0	0	0	0	110.5	P302 V306 S309 D310 S311 R315 F316 W317 L345	P302-V313 HydrophobicContact CB-CG1 3.77Å; P302-V313 HydrophobicContact CB-CG2 3.99Å; P302-V313 HydrophobicContact CG-CG1 4.23Å; P302-V313 HydrophobicContact CG-CG2 4.13Å; V306-V313 HydrophobicContact CG1-CB 4.46Å; V306-V313 HydrophobicContact CG1-CG1 4.05Å; V306-V313 HydrophobicContact CG1-CG2 4.16Å; S309-V313 WeakPolarHBondContact O-CG2 3.37Å; S309-V313 PolarHBondContact O-N 2.99Å; D310-V313 PolarHBondContact O-N 2.65Å; S311-V313 VanDerWaalsContact C-N 3.34Å; S311-V313 PolarHBondContact O-N 3.03Å; V313-R315 VanDerWaalsContact C-N 3.32Å; V313-R315 PolarHBondContact O-N 3.31Å; V313-F316 WeakPolarHBondContact O-CB 3.5Å; V313-F316 PolarHBondContact O-N 3.34Å; V313-F316 VanDerWaalsContact O-N 3.11Å; V313-W317 HydrophobicContact CG1-CD2 4.08Å; V313-W317 HydrophobicContact CG1-CH2 4.12Å; V313-W317 HydrophobicContact CG1-CZ2 3.59Å; V313-W317 PolarHBondContact O-N 2.66Å; V313-L345 HydrophobicContact CG1-CD1 4.43Å; V313-L345 HydrophobicContact CG1-CD2 4.03Å
314	V	98.4	Very high	96.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.7	-38.8	179.6	-178.8	0	0	0	0	111.4	L124 E127 F131 D310 F316 W317 Y318 F344 L345	L124-V314 HydrophobicContact CD1-CG2 3.86Å; E127-V314 HydrophobicContact CB-CB 4Å; E127-V314 HydrophobicContact CB-CG1 3.91Å; E127-V314 WeakPolarHBondContact O-CG1 3.33Å; F131-V314 HydrophobicContact CB-CG1 3.57Å; F131-V314 HydrophobicContact CD1-CG1 4.43Å; F131-V314 HydrophobicContact CG-CG1 3.97Å; D310-V314 WeakPolarHBondContact O-CG2 3.29Å; D310-V314 PolarHBondContact O-N 3.05Å; V314-F316 VanDerWaalsContact C-N 3.29Å; V314-F316 PolarHBondContact O-N 2.77Å; V314-W317 HydrophobicContact CB-CE3 4.36Å; V314-W317 HydrophobicContact CG2-CE3 4.05Å; V314-W317 HydrophobicContact CG2-CZ3 4.05Å; V314-W317 PolarHBondContact O-N 3.11Å; V314-Y318 WeakPolarHBondContact O-CB 3.31Å; V314-Y318 PolarHBondContact O-N 3.43Å; V314-F344 HydrophobicContact CG1-CZ 4.21Å; V314-F344 HydrophobicContact CG2-CE1 3.57Å; V314-F344 HydrophobicContact CG2-CZ 3.54Å; V314-L345 HydrophobicContact CG2-CD1 3.73Å
315	R	98.5	Very high	97	Very high	40 Å²	40	30.5 Å²	30.5	15%	0.151	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-40.6	173.2	179.8	177.5	171.4	-152.5	-3.2	111.9	Q115 W117 E127 S311 V313 S319	Q115-R315 PolarHBondContact O-NE 3.24Å; Q115-R315 PolarHBondContact O-NH2 3.33Å; W117-R315 HydrophobicContact CE3-CB 4.49Å; W117-R315 VanDerWaalsContact CE3-CD 3.41Å; W117-R315 HydrophobicContact CE3-CG 4.48Å; W117-R315 VanDerWaalsContact CZ2-NH1 3.31Å; W117-R315 HydrophobicContact CZ3-CB 4.25Å; W117-R315 VanDerWaalsContact NE1-NH1 3.14Å; E127-R315 HydrophobicContact CG-CB 4.4Å; E127-R315 WeakPolarHBondContact OE2-CA 3.24Å; S311-R315 WeakPolarHBondContact O-CB 3.26Å; S311-R315 PolarHBondContact O-N 3.21Å; V313-R315 VanDerWaalsContact C-N 3.32Å; V313-R315 PolarHBondContact O-N 3.31Å; R315-S319 WeakPolarHBondContact O-CB 3.46Å; R315-S319 PolarHBondContact O-N 2.95Å; R315-S319 PolarHBondContact O-OG 2.96Å
316	F	98.5	Very high	97.2	Very high	28 Å²	28	31.3 Å²	31.3	12%	0.123	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-49.1	175.2	171.1	-103.8	0	0	0	111.6	L114 E279 V306 S312 V313 V314 Y318 S319 L320	L114-F316 HydrophobicContact CD2-CB 4.34Å; L114-F316 HydrophobicContact CD2-CD2 3.88Å; E279-F316 HydrophobicContact CB-CZ 4.47Å; V306-F316 HydrophobicContact CG1-CD1 3.79Å; V306-F316 HydrophobicContact CG1-CE1 4.22Å; V306-F316 HydrophobicContact CG2-CD1 4.29Å; V306-F316 HydrophobicContact CG2-CE1 3.9Å; S312-F316 WeakPolarHBondContact O-CB 3.4Å; S312-F316 PolarHBondContact O-N 2.76Å; V313-F316 WeakPolarHBondContact O-CB 3.5Å; V313-F316 PolarHBondContact O-N 3.34Å; V313-F316 VanDerWaalsContact O-N 3.11Å; V314-F316 VanDerWaalsContact C-N 3.29Å; V314-F316 PolarHBondContact O-N 2.77Å; F316-Y318 VanDerWaalsContact C-N 3.34Å; F316-Y318 PolarHBondContact O-N 3.48Å; F316-S319 WeakPolarHBondContact O-CB 3.08Å; F316-S319 PolarHBondContact O-N 3.3Å; F316-L320 HydrophobicContact CD1-CD1 4.23Å; F316-L320 HydrophobicContact CE1-CD1 3.59Å; F316-L320 HydrophobicContact CE1-CG 4.31Å; F316-L320 HydrophobicContact CE2-CD1 4.34Å; F316-L320 HydrophobicContact CE2-CD2 4.24Å; F316-L320 HydrophobicContact CE2-CG 4.27Å; F316-L320 HydrophobicContact CZ-CD1 3.66Å; F316-L320 HydrophobicContact CZ-CD2 4.17Å; F316-L320 HydrophobicContact CZ-CG 4.08Å; F316-L320 PolarHBondContact O-N 3.42Å
317	W	98.5	Very high	97.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-54.5	-49.7	175.2	-62.1	-22.8	0	0	0	112	F131 W275 L299 W301 P302 V313 V314 S319 L320 L321 F344 L345	F131-W317 HydrophobicContact CD2-CB 4.14Å; F131-W317 HydrophobicContact CE1-CE3 4.33Å; F131-W317 HydrophobicContact CE2-CB 3.72Å; F131-W317 HydrophobicContact CZ-CB 4.36Å; F131-W317 HydrophobicContact CZ-CE3 4.28Å; W275-W317 AromaticContact CD1-CD1 3.99Å; W275-W317 AromaticContact CD1-NE1 3.48Å; W275-W317 HydrophobicContact CD2-CB 4.46Å; W275-W317 AromaticContact CD2-CD1 3.31Å; W275-W317 AromaticContact CD2-CG 3.91Å; W275-W317 HydrophobicContact CD2-CG 3.91Å; W275-W317 AromaticContact CD2-NE1 3.63Å; W275-W317 AromaticContact CE2-CD1 3.52Å; W275-W317 AromaticContact CE2-CD2 3.98Å; W275-W317 AromaticContact CE2-CE2 3.79Å; W275-W317 AromaticContact CE2-CG 3.79Å; W275-W317 AromaticContact CE2-NE1 3.54Å; W275-W317 HydrophobicContact CE3-CB 4.07Å; W275-W317 AromaticContact CE3-CD1 3.64Å; W275-W317 HydrophobicContact CE3-CG 4.01Å; W275-W317 AromaticContact CG-CD1 3.66Å; W275-W317 AromaticContact CG-NE1 3.6Å; W275-W317 HydrophobicContact CH2-CB 3.77Å; W275-W317 HydrophobicContact CH2-CD2 4.45Å; W275-W317 AromaticContact CH2-CG 3.95Å; W275-W317 HydrophobicContact CH2-CG 3.95Å; W275-W317 HydrophobicContact CZ2-CB 4.15Å; W275-W317 AromaticContact CZ2-CD2 3.95Å; W275-W317 HydrophobicContact CZ2-CD2 3.95Å; W275-W317 HydrophobicContact CZ2-CE3 4.47Å; W275-W317 AromaticContact CZ2-CG 3.83Å; W275-W317 HydrophobicContact CZ2-CG 3.83Å; W275-W317 HydrophobicContact CZ3-CB 3.71Å; W275-W317 HydrophobicContact CZ3-CG 4.03Å; W275-W317 AromaticContact NE1-CD1 3.9Å; W275-W317 AromaticContact NE1-CE2 3.63Å; W275-W317 AromaticContact NE1-CZ2 3.94Å; W275-W317 AromaticContact NE1-NE1 3.42Å; L299-W317 HydrophobicContact CD2-CE3 4.06Å; L299-W317 HydrophobicContact CD2-CH2 4.05Å; L299-W317 HydrophobicContact CD2-CZ3 3.73Å; W301-W317 WeakPolarHBondContact O-CZ2 3.33Å; P302-W317 WeakPolarHBondContact O-CZ2 3.31Å; P302-W317 PolarHBondContact O-NE1 3.39Å; P302-W317 VanDerWaalsContact O-NE1 3.07Å; V313-W317 HydrophobicContact CG1-CD2 4.08Å; V313-W317 HydrophobicContact CG1-CH2 4.12Å; V313-W317 HydrophobicContact CG1-CZ2 3.59Å; V313-W317 PolarHBondContact O-N 2.66Å; V314-W317 HydrophobicContact CB-CE3 4.36Å; V314-W317 HydrophobicContact CG2-CE3 4.05Å; V314-W317 HydrophobicContact CG2-CZ3 4.05Å; V314-W317 PolarHBondContact O-N 3.11Å; W317-S319 VanDerWaalsContact C-N 3.26Å; W317-S319 PolarHBondContact O-N 2.98Å; W317-L320 PolarHBondContact O-N 2.66Å; W317-L321 PolarHBondContact O-N 3.37Å; W317-F344 HydrophobicContact CZ3-CE2 4.11Å; W317-F344 AromaticContact CZ3-CZ 3.93Å; W317-F344 HydrophobicContact CZ3-CZ 3.93Å; W317-L345 HydrophobicContact CH2-CD1 4.45Å; W317-L345 HydrophobicContact CH2-CD2 3.35Å; W317-L345 HydrophobicContact CH2-CG 3.88Å; W317-L345 HydrophobicContact CZ2-CD2 3.89Å; W317-L345 HydrophobicContact CZ3-CD2 4.17Å; W317-L345 HydrophobicContact CZ3-CG 4.26Å
318	Y	98.6	Very high	97.7	Very high	32 Å²	32	29.2 Å²	29.2	13%	0.125	16%	0.164	C	C	.	.	H	α-helix	trans	-58.5	-39.5	176.3	180	-102.5	0	0	0	112	Q115 R130 Y134 V314 F316 L320 L321 K322	Q115-Y318 HydrophobicContact CB-CD1 3.96Å; Q115-Y318 HydrophobicContact CB-CE1 4.05Å; Q115-Y318 HydrophobicContact CG-CD1 3.91Å; Q115-Y318 HydrophobicContact CG-CE1 3.9Å; R130-Y318 HydrophobicContact CG-CD2 4.16Å; R130-Y318 HydrophobicContact CG-CE1 4.38Å; R130-Y318 HydrophobicContact CG-CE2 3.75Å; R130-Y318 VanDerWaalsContact CZ-CD1 3.5Å; Y134-Y318 HydrophobicContact CD2-CD2 4.36Å; Y134-Y318 AromaticContact CD2-CE2 3.74Å; Y134-Y318 HydrophobicContact CD2-CE2 3.74Å; Y134-Y318 HydrophobicContact CE2-CE2 4.5Å; Y134-Y318 HydrophobicContact CG-CD2 4.48Å; Y134-Y318 HydrophobicContact CG-CE2 4.21Å; V314-Y318 WeakPolarHBondContact O-CB 3.31Å; V314-Y318 PolarHBondContact O-N 3.43Å; F316-Y318 VanDerWaalsContact C-N 3.34Å; F316-Y318 PolarHBondContact O-N 3.48Å; Y318-L320 PolarHBondContact O-N 2.9Å; Y318-L321 PolarHBondContact O-N 3.43Å; Y318-K322 HydrophobicContact CD1-CG 4.13Å; Y318-K322 HydrophobicContact CE1-CD 4.15Å; Y318-K322 HydrophobicContact CE1-CG 3.66Å; Y318-K322 HydrophobicContact CE2-CD 4.24Å; Y318-K322 HydrophobicContact CE2-CG 4.38Å; Y318-K322 WeakPolarHBondContact O-CG 3.04Å; Y318-K322 PolarHBondContact O-N 3.28Å
319	S	98.5	Very high	97.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.7	-41	179.1	-57.3	0	0	0	0	112.5	L114 Q115 R315 F316 W317 L321 K322 E323	L114-S319 WeakPolarHBondContact CA-OG 2.9Å; Q115-S319 PolarHBondContact N-OG 3.11Å; R315-S319 WeakPolarHBondContact O-CB 3.46Å; R315-S319 PolarHBondContact O-N 2.95Å; R315-S319 PolarHBondContact O-OG 2.96Å; F316-S319 WeakPolarHBondContact O-CB 3.08Å; F316-S319 PolarHBondContact O-N 3.3Å; W317-S319 VanDerWaalsContact C-N 3.26Å; W317-S319 PolarHBondContact O-N 2.98Å; S319-L321 VanDerWaalsContact C-N 3.33Å; S319-L321 PolarHBondContact O-N 3.41Å; S319-K322 PolarHBondContact O-N 3.2Å; S319-E323 WeakPolarHBondContact O-CG 3.42Å; S319-E323 PolarHBondContact O-N 3.48Å
320	L	98.3	Very high	97.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-41.1	174.3	-65.3	175.5	0	0	0	112.1	I112 W275 L278 E279 I282 F316 W317 Y318 K322 E323 L324	I112-L320 HydrophobicContact CD1-CD2 3.99Å; I112-L320 HydrophobicContact CG1-CD2 3.75Å; I112-L320 HydrophobicContact CG2-CD2 4.36Å; W275-L320 HydrophobicContact CB-CD1 4.39Å; W275-L320 HydrophobicContact CE3-CD1 3.94Å; W275-L320 VanDerWaalsContact O-CD1 3.31Å; W275-L320 WeakPolarHBondContact O-CD1 3.36Å; L278-L320 HydrophobicContact CD2-CB 3.9Å; L278-L320 HydrophobicContact CG-CB 4.35Å; E279-L320 HydrophobicContact CB-CD2 3.87Å; E279-L320 HydrophobicContact CG-CD2 4.32Å; I282-L320 HydrophobicContact CD1-CB 4.39Å; I282-L320 HydrophobicContact CD1-CD2 3.81Å; F316-L320 HydrophobicContact CD1-CD1 4.23Å; F316-L320 HydrophobicContact CE1-CD1 3.59Å; F316-L320 HydrophobicContact CE1-CG 4.31Å; F316-L320 HydrophobicContact CE2-CD1 4.34Å; F316-L320 HydrophobicContact CE2-CD2 4.24Å; F316-L320 HydrophobicContact CE2-CG 4.27Å; F316-L320 HydrophobicContact CZ-CD1 3.66Å; F316-L320 HydrophobicContact CZ-CD2 4.17Å; F316-L320 HydrophobicContact CZ-CG 4.08Å; F316-L320 PolarHBondContact O-N 3.42Å; W317-L320 PolarHBondContact O-N 2.66Å; Y318-L320 PolarHBondContact O-N 2.9Å; L320-K322 VanDerWaalsContact C-N 3.3Å; L320-K322 PolarHBondContact O-N 3.35Å; L320-E323 WeakPolarHBondContact O-CB 3.14Å; L320-E323 PolarHBondContact O-N 2.8Å; L320-L324 PolarHBondContact O-N 2.96Å; L320-L324 VanDerWaalsContact O-N 3.15Å
321	L	98.4	Very high	97.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67	-32.4	176.7	-58.4	-171.8	0	0	0	112.1	F131 Y134 I135 W275 L278 W317 Y318 S319 L324 E325 W360	F131-L321 HydrophobicContact CD2-CD1 4.3Å; F131-L321 HydrophobicContact CE2-CD1 3.7Å; Y134-L321 HydrophobicContact CD1-CB 4.26Å; Y134-L321 HydrophobicContact CD1-CD1 3.59Å; Y134-L321 HydrophobicContact CE1-CB 3.64Å; Y134-L321 HydrophobicContact CE1-CD1 3.59Å; Y134-L321 HydrophobicContact CE1-CG 4.19Å; Y134-L321 HydrophobicContact CE2-CB 4.42Å; Y134-L321 PolarHBondContact OH-O 3.4Å; Y134-L321 VanDerWaalsContact OH-O 3.08Å; I135-L321 HydrophobicContact CG2-CD1 3.55Å; W275-L321 HydrophobicContact CZ3-CD2 4.32Å; L278-L321 HydrophobicContact CD2-CD2 4.23Å; W317-L321 PolarHBondContact O-N 3.37Å; Y318-L321 PolarHBondContact O-N 3.43Å; S319-L321 VanDerWaalsContact C-N 3.33Å; S319-L321 PolarHBondContact O-N 3.41Å; L321-L324 HydrophobicContact CD2-CD1 4.11Å; L321-L324 WeakPolarHBondContact O-CB 3.11Å; L321-L324 PolarHBondContact O-N 3.42Å; L321-E325 PolarHBondContact O-N 2.87Å; L321-W360 HydrophobicContact CD2-CH2 4.22Å; L321-W360 HydrophobicContact CD2-CZ2 3.73Å
322	K	98.3	Very high	97.9	Very high	41 Å²	41	24.2 Å²	24.2	18%	0.178	11%	0.111	C	C	.	.	H	α-helix	trans	-69.9	-32.5	172.3	-67.7	-50.9	-56.1	-174.8	0	113.1	Q115 Y134 Y318 S319 L320 L324 E325 Q326	Q115-K322 HydrophobicContact CG-CB 3.94Å; Q115-K322 HydrophobicContact CG-CG 3.73Å; Y134-K322 HydrophobicContact CD2-CD 4.48Å; Y134-K322 HydrophobicContact CE2-CD 3.9Å; Y318-K322 HydrophobicContact CD1-CG 4.13Å; Y318-K322 HydrophobicContact CE1-CD 4.15Å; Y318-K322 HydrophobicContact CE1-CG 3.66Å; Y318-K322 HydrophobicContact CE2-CD 4.24Å; Y318-K322 HydrophobicContact CE2-CG 4.38Å; Y318-K322 WeakPolarHBondContact O-CG 3.04Å; Y318-K322 PolarHBondContact O-N 3.28Å; S319-K322 PolarHBondContact O-N 3.2Å; L320-K322 VanDerWaalsContact C-N 3.3Å; L320-K322 PolarHBondContact O-N 3.35Å; K322-L324 VanDerWaalsContact C-N 3.33Å; K322-E325 IonicContact NZ-OE1 3.35Å; K322-E325 PolarHBondContact NZ-OE1 2.85Å; K322-E325 IonicContact NZ-OE2 2.74Å; K322-E325 PolarHBondContact NZ-OE2 2.98Å; K322-E325 WeakPolarHBondContact O-CB 3.26Å; K322-E325 PolarHBondContact O-N 3Å; K322-Q326 WeakPolarHBondContact O-CG 3.37Å; K322-Q326 PolarHBondContact O-N 2.79Å; K322-Q326 VanDerWaalsContact O-N 3.13Å
323	E	97.8	Very high	97.9	Very high	7 Å²	7	24.2 Å²	24.2	3%	0.033	11%	0.106	C	C	.	.	H	α-helix	trans	-64.4	-38.1	172	-68.9	-75.1	156.9	0	0	111.5	R109 I112 I282 S319 L320 E325 Q326 K327	R109-E323 IonicContact CZ-OE1 3.82Å; R109-E323 IonicContact CZ-OE2 2.74Å; R109-E323 IonicContact NH1-OE1 3.68Å; R109-E323 PolarHBondContact NH1-OE1 3.05Å; R109-E323 VanDerWaalsContact NH1-OE1 3.08Å; R109-E323 IonicContact NH1-OE2 2.68Å; R109-E323 PolarHBondContact NH1-OE2 2.94Å; R109-E323 IonicContact NH2-OE1 3.09Å; R109-E323 PolarHBondContact NH2-OE1 3.07Å; R109-E323 IonicContact NH2-OE2 3.08Å; I112-E323 HydrophobicContact CD1-CG 4.38Å; I112-E323 HydrophobicContact CG2-CG 4.07Å; I282-E323 HydrophobicContact CD1-CB 3.64Å; I282-E323 HydrophobicContact CD1-CG 4.35Å; I282-E323 HydrophobicContact CG1-CB 4.16Å; I282-E323 HydrophobicContact CG2-CB 4.04Å; I282-E323 HydrophobicContact CG2-CG 4.27Å; S319-E323 WeakPolarHBondContact O-CG 3.42Å; S319-E323 PolarHBondContact O-N 3.48Å; L320-E323 WeakPolarHBondContact O-CB 3.14Å; L320-E323 PolarHBondContact O-N 2.8Å; E323-E325 VanDerWaalsContact C-N 3.31Å; E323-E325 PolarHBondContact O-N 2.8Å; E323-Q326 WeakPolarHBondContact O-CB 3.38Å; E323-Q326 PolarHBondContact O-N 3.49Å; E323-Q326 VanDerWaalsContact O-N 3.13Å; E323-K327 PolarHBondContact O-N 3.31Å
324	L	97.8	Very high	97.8	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-56.3	-45.7	171.8	-74.8	178.6	0	0	0	111.7	L278 L287 L293 L320 L321 K322 Q326 K327 D328 F329 W360	L278-L324 HydrophobicContact CD1-CD1 4.12Å; L278-L324 HydrophobicContact CD1-CD2 3.72Å; L278-L324 HydrophobicContact CD1-CG 3.99Å; L278-L324 HydrophobicContact CD2-CD1 4.06Å; L278-L324 HydrophobicContact CD2-CG 4.44Å; L287-L324 HydrophobicContact CD1-CD2 3.7Å; L287-L324 HydrophobicContact CD2-CD2 3.94Å; L287-L324 HydrophobicContact CG-CD2 4.49Å; L293-L324 HydrophobicContact CD1-CD1 4.46Å; L293-L324 HydrophobicContact CD1-CD2 3.57Å; L320-L324 PolarHBondContact O-N 2.96Å; L320-L324 VanDerWaalsContact O-N 3.15Å; L321-L324 HydrophobicContact CD2-CD1 4.11Å; L321-L324 WeakPolarHBondContact O-CB 3.11Å; L321-L324 PolarHBondContact O-N 3.42Å; K322-L324 VanDerWaalsContact C-N 3.33Å; L324-Q326 VanDerWaalsContact C-N 3.3Å; L324-Q326 PolarHBondContact O-N 3.05Å; L324-K327 CarbonylContact O-C 3.1Å; L324-K327 VanDerWaalsContact O-C 3.29Å; L324-K327 WeakPolarHBondContact O-CA 3.4Å; L324-K327 PolarHBondContact O-N 3.15Å; L324-D328 PolarHBondContact O-N 3Å; L324-F329 HydrophobicContact CB-CB 4.09Å; L324-F329 HydrophobicContact CD2-CB 4.47Å; L324-F329 HydrophobicContact CD2-CD2 4.33Å; L324-F329 HydrophobicContact CD2-CG 4.39Å; L324-F329 WeakPolarHBondContact O-CB 3.21Å; L324-F329 PolarHBondContact O-N 3.15Å; L324-W360 HydrophobicContact CD1-CD2 4.23Å; L324-W360 HydrophobicContact CD1-CZ2 4.23Å
325	E	96.8	Very high	97.6	Very high	27 Å²	27	29.4 Å²	29.4	13%	0.126	13%	0.132	C	C	.	.	H	α-helix	trans	-62.5	-36.7	176.3	-73.5	-171.8	-140.1	0	0	113.6	Y134 Q139 L321 K322 E323 K327 D328 F329 R330	Y134-E325 WeakPolarHBondContact CE2-OE1 3.21Å; Y134-E325 WeakPolarHBondContact OH-CG 3.48Å; Y134-E325 PolarHBondContact OH-OE1 2.76Å; Q139-E325 PolarHBondContact NE2-OE1 3.2Å; L321-E325 PolarHBondContact O-N 2.87Å; K322-E325 IonicContact NZ-OE1 3.35Å; K322-E325 PolarHBondContact NZ-OE1 2.85Å; K322-E325 IonicContact NZ-OE2 2.74Å; K322-E325 PolarHBondContact NZ-OE2 2.98Å; K322-E325 WeakPolarHBondContact O-CB 3.26Å; K322-E325 PolarHBondContact O-N 3Å; E323-E325 VanDerWaalsContact C-N 3.31Å; E323-E325 PolarHBondContact O-N 2.8Å; E325-K327 PolarHBondContact O-N 3.24Å; E325-D328 PolarHBondContact O-N 3.13Å; E325-D328 VanDerWaalsContact O-N 3.12Å; E325-F329 WeakPolarHBondContact CA-O 3.48Å; E325-R330 VanDerWaalsContact CG-NH1 3.33Å; E325-R330 IonicContact OE2-NH1 3.44Å; E325-R330 PolarHBondContact OE2-NH1 3.28Å
326	Q	95.9	Very high	97.5	Very high	118 Å²	118	30.2 Å²	30.2	55%	0.551	14%	0.136	S	C	*	.	H	α-helix	trans	-67.4	-25.3	175.8	-68.2	177.4	19	0	0	111.9	K322 E323 L324 D328	K322-Q326 WeakPolarHBondContact O-CG 3.37Å; K322-Q326 PolarHBondContact O-N 2.79Å; K322-Q326 VanDerWaalsContact O-N 3.13Å; E323-Q326 WeakPolarHBondContact O-CB 3.38Å; E323-Q326 PolarHBondContact O-N 3.49Å; E323-Q326 VanDerWaalsContact O-N 3.13Å; L324-Q326 VanDerWaalsContact C-N 3.3Å; L324-Q326 PolarHBondContact O-N 3.05Å; Q326-D328 VanDerWaalsContact C-N 3.28Å
327	K	96.1	Very high	97.2	Very high	49 Å²	49	29.4 Å²	29.4	21%	0.213	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	23.9	171.8	-66.4	-65.7	-163.4	169.3	0	112.9	D285 L287 E288 E323 L324 E325 F329	D285-K327 IonicContact OD1-NZ 3.46Å; D285-K327 PolarHBondContact OD1-NZ 3.24Å; L287-K327 HydrophobicContact CD1-CB 4.23Å; L287-K327 HydrophobicContact CD1-CG 4.09Å; E288-K327 IonicContact OE1-NZ 3.35Å; E288-K327 PolarHBondContact OE1-NZ 3.02Å; E323-K327 PolarHBondContact O-N 3.31Å; L324-K327 CarbonylContact O-C 3.1Å; L324-K327 VanDerWaalsContact O-C 3.29Å; L324-K327 WeakPolarHBondContact O-CA 3.4Å; L324-K327 PolarHBondContact O-N 3.15Å; E325-K327 PolarHBondContact O-N 3.24Å; K327-F329 HydrophobicContact CB-CD2 4.27Å; K327-F329 VanDerWaalsContact O-CD2 3.31Å; K327-F329 WeakPolarHBondContact O-CD2 3.47Å; K327-F329 PolarHBondContact O-N 3.03Å
328	D	96.9	Very high	96.9	Very high	35 Å²	35	35.3 Å²	35.3	19%	0.187	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	13.2	173.4	-58.5	-68.1	0	0	0	115.8	L324 E325 Q326 T363 R364	L324-D328 PolarHBondContact O-N 3Å; E325-D328 PolarHBondContact O-N 3.13Å; E325-D328 VanDerWaalsContact O-N 3.12Å; Q326-D328 VanDerWaalsContact C-N 3.28Å; D328-T363 PolarHBondContact O-N 3.03Å; D328-T363 PolarHBondContact O-OG1 3.13Å; D328-R364 HydrophobicContact CB-CB 4.44Å; D328-R364 HydrophobicContact CB-CG 3.94Å; D328-R364 IonicContact OD1-CZ 2.7Å; D328-R364 IonicContact OD1-NE 3.82Å; D328-R364 PolarHBondContact OD1-NE 3.13Å; D328-R364 IonicContact OD1-NH1 3.24Å; D328-R364 IonicContact OD1-NH2 2.86Å; D328-R364 WeakPolarHBondContact OD2-CD 3.5Å; D328-R364 IonicContact OD2-CZ 3.2Å; D328-R364 IonicContact OD2-NE 3.51Å; D328-R364 PolarHBondContact OD2-NE 3.07Å; D328-R364 IonicContact OD2-NH1 3.85Å; D328-R364 PolarHBondContact OD2-NH1 3.07Å
329	F	98.3	Very high	96.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.5	170.9	-76.4	-93	0	0	0	111	L287 I290 L293 L324 E325 K327 W360 V361 N362	L287-F329 HydrophobicContact CB-CE2 4.03Å; L287-F329 HydrophobicContact CD2-CE2 4.49Å; I290-F329 HydrophobicContact CB-CZ 4.24Å; I290-F329 VanDerWaalsContact O-CZ 3.3Å; I290-F329 WeakPolarHBondContact O-CZ 3.4Å; L293-F329 HydrophobicContact CB-CE1 4.47Å; L293-F329 HydrophobicContact CD1-CD1 3.63Å; L293-F329 HydrophobicContact CD1-CD2 4.43Å; L293-F329 HydrophobicContact CD1-CE1 3.53Å; L293-F329 HydrophobicContact CD1-CE2 4.36Å; L293-F329 HydrophobicContact CD1-CG 4.09Å; L293-F329 HydrophobicContact CD1-CZ 3.9Å; L293-F329 HydrophobicContact CG-CD1 3.96Å; L293-F329 HydrophobicContact CG-CE1 3.51Å; L293-F329 HydrophobicContact CG-CZ 4.08Å; L324-F329 HydrophobicContact CB-CB 4.09Å; L324-F329 HydrophobicContact CD2-CB 4.47Å; L324-F329 HydrophobicContact CD2-CD2 4.33Å; L324-F329 HydrophobicContact CD2-CG 4.39Å; L324-F329 WeakPolarHBondContact O-CB 3.21Å; L324-F329 PolarHBondContact O-N 3.15Å; E325-F329 WeakPolarHBondContact CA-O 3.48Å; K327-F329 HydrophobicContact CB-CD2 4.27Å; K327-F329 VanDerWaalsContact O-CD2 3.31Å; K327-F329 WeakPolarHBondContact O-CD2 3.47Å; K327-F329 PolarHBondContact O-N 3.03Å; F329-W360 HydrophobicContact CB-CB 4.14Å; F329-W360 HydrophobicContact CD1-CB 3.92Å; F329-V361 CarbonylContact C-O 3.54Å; F329-V361 WeakPolarHBondContact CA-O 3.34Å; F329-N362 HydrophobicContact CD1-CB 4.02Å; F329-N362 HydrophobicContact CD2-CB 4.42Å; F329-N362 HydrophobicContact CE1-CB 3.65Å; F329-N362 HydrophobicContact CE2-CB 4.08Å; F329-N362 HydrophobicContact CG-CB 4.4Å; F329-N362 HydrophobicContact CZ-CB 3.7Å
330	R	98.2	Very high	96.3	Very high	78 Å²	78	42.5 Å²	42.5	29%	0.294	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.2	176.3	-62.3	-62.4	176.6	-167	-6.1	110.1	Q139 I140 E325 F332 W360 V361 T363	Q139-R330 HydrophobicContact CB-CB 4.35Å; I140-R330 HydrophobicContact CB-CB 4.02Å; I140-R330 HydrophobicContact CG2-CB 3.59Å; E325-R330 VanDerWaalsContact CG-NH1 3.33Å; E325-R330 IonicContact OE2-NH1 3.44Å; E325-R330 PolarHBondContact OE2-NH1 3.28Å; R330-F332 PolarHBondContact O-N 2.81Å; R330-W360 VanDerWaalsContact O-CA 3.29Å; R330-W360 WeakPolarHBondContact O-CA 3.38Å; R330-V361 PolarHBondContact N-O 3.24Å; R330-V361 PolarHBondContact O-N 2.94Å; R330-T363 HydrophobicContact CB-CG2 4.1Å; R330-T363 HydrophobicContact CG-CG2 3.58Å
331	L	98.6	Very high	96.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	123.3	175.5	-173.7	72.5	0	0	0	108.1	Q139 I140 H333 L358 S359 W360	Q139-L331 WeakPolarHBondContact CA-O 3.12Å; Q139-L331 WeakPolarHBondContact CB-O 3.45Å; Q139-L331 HydrophobicContact CG-CB 4.09Å; Q139-L331 PolarHBondContact N-O 3.37Å; I140-L331 PolarHBondContact N-O 2.87Å; L331-H333 WeakPolarHBondContact CD1-O 3.3Å; L331-L358 HydrophobicContact CD1-CB 3.93Å; L331-L358 HydrophobicContact CD1-CD2 4.35Å; L331-S359 WeakPolarHBondContact CD1-O 3.42Å; L331-W360 VanDerWaalsContact CA-CD1 3.45Å; L331-W360 HydrophobicContact CD1-CD2 3.91Å; L331-W360 HydrophobicContact CD1-CG 4.21Å; L331-W360 HydrophobicContact CD1-CZ2 3.93Å; L331-W360 VanDerWaalsContact N-CD1 3.29Å
332	F	97.7	Very high	95.9	Very high	12 Å²	12	48.4 Å²	48.4	5%	0.053	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-21.2	177.1	72.5	-94.2	0	0	0	112.8	I140 C142 M145 S162 C164 R330 S359 V361	I140-F332 HydrophobicContact CG2-CB 3.7Å; I140-F332 WeakPolarHBondContact O-CA 3.26Å; I140-F332 WeakPolarHBondContact O-CB 3.23Å; C142-F332 HydrophobicContact CB-CB 4.2Å; C142-F332 HydrophobicContact CB-CD2 3.67Å; C142-F332 HydrophobicContact CB-CE2 4.38Å; C142-F332 HydrophobicContact CB-CG 4.15Å; M145-F332 HydrophobicContact CG-CE2 4.31Å; M145-F332 HydrophobicContact SD-CD2 4.4Å; M145-F332 HydrophobicContact SD-CE2 4.02Å; S162-F332 WeakPolarHBondContact O-CZ 3.48Å; C164-F332 HydrophobicContact CB-CD1 4.26Å; C164-F332 HydrophobicContact CB-CD2 4.2Å; C164-F332 HydrophobicContact CB-CE1 3.95Å; C164-F332 HydrophobicContact CB-CE2 3.91Å; C164-F332 HydrophobicContact CB-CG 4.36Å; C164-F332 HydrophobicContact CB-CZ 3.77Å; R330-F332 PolarHBondContact O-N 2.81Å; F332-S359 WeakPolarHBondContact CD1-O 3.44Å; F332-S359 VanDerWaalsContact CE1-CB 3.4Å; F332-S359 PolarHBondContact N-O 3.28Å; F332-V361 HydrophobicContact CD1-CB 3.98Å; F332-V361 HydrophobicContact CD1-CG1 4.03Å; F332-V361 HydrophobicContact CE1-CB 4.28Å
333	H	96.9	Very high	95.8	Very high	39 Å²	39	49.3 Å²	49.3	18%	0.181	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.4	179.9	-173.5	72.6	0	0	0	111.6	M145 S162 L331 S359	M145-H333 HydrophobicContact SD-CB 3.95Å; S162-H333 PolarHBondContact OG-CD2 2.81Å; S162-H333 PolarHBondContact OG-NE2 3.37Å; L331-H333 WeakPolarHBondContact CD1-O 3.3Å; H333-S359 PolarHBondContact N-O 2.65Å; H333-S359 PolarHBondContact O-N 3.32Å
334	S	96.3	Very high	95.8	Very high	36 Å²	36	49 Å²	49	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	128.7	175.9	178.6	0	0	0	0	109.1	I135 T357 L358	I135-S334 WeakPolarHBondContact O-CB 3.44Å; I135-S334 PolarHBondContact O-OG 3.34Å; S334-T357 WeakPolarHBondContact CA-O 3.45Å; S334-L358 WeakPolarHBondContact OG-CD2 2.95Å
335	Y	95.4	Very high	95.7	Very high	74 Å²	74	49.1 Å²	49.1	29%	0.29	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.2	176.5	176.6	-99.1	0	0	0	109.3	K159 P160 D337 Y356 T357	K159-Y335 HydrophobicContact CG-CD1 4.02Å; K159-Y335 HydrophobicContact CG-CE1 3.93Å; P160-Y335 HydrophobicContact CG-CD1 4.14Å; P160-Y335 HydrophobicContact CG-CD2 3.64Å; P160-Y335 HydrophobicContact CG-CE2 4.14Å; P160-Y335 HydrophobicContact CG-CG 3.63Å; Y335-D337 HydrophobicContact CD1-CB 4.44Å; Y335-D337 HydrophobicContact CE1-CB 3.95Å; Y335-Y356 CarbonylContact O-C 3.48Å; Y335-Y356 VanDerWaalsContact O-CA 3.28Å; Y335-Y356 WeakPolarHBondContact O-CA 3.11Å; Y335-T357 PolarHBondContact N-O 2.94Å; Y335-T357 PolarHBondContact O-N 3.16Å
336	K	94.9	Very high	95.6	Very high	58 Å²	58	55.5 Å²	55.5	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	114.7	172.3	-179.3	-178.4	175.1	-168.3	0	108.9	L338 N351 Y356	K336-L338 HydrophobicContact CD-CD2 3.85Å; K336-L338 HydrophobicContact CG-CD2 4.05Å; K336-L338 PolarHBondContact O-N 3.42Å; K336-N351 WeakPolarHBondContact CE-O 3.35Å; K336-N351 PolarHBondContact NZ-O 3.07Å; K336-N351 PolarHBondContact NZ-OD1 2.78Å; K336-N351 VanDerWaalsContact NZ-OD1 3.11Å; K336-Y356 HydrophobicContact CB-CD1 3.87Å; K336-Y356 HydrophobicContact CB-CE1 3.53Å; K336-Y356 HydrophobicContact CD-CE1 4.08Å; K336-Y356 HydrophobicContact CG-CD1 4.21Å; K336-Y356 HydrophobicContact CG-CE1 3.54Å
337	D	92.5	Very high	95.5	Very high	10 Å²	10	53.4 Å²	53.4	5%	0.053	27%	0.265	C	S	.	.			trans	-79.6	106.1	179.1	-169.8	-14.3	0	0	0	110.6	Y335 S339 K340 S353 C355	Y335-D337 HydrophobicContact CD1-CB 4.44Å; Y335-D337 HydrophobicContact CE1-CB 3.95Å; D337-S339 VanDerWaalsContact C-N 3.31Å; D337-S339 WeakPolarHBondContact OD1-CA 3.37Å; D337-S339 VanDerWaalsContact OD1-CB 3.28Å; D337-S339 WeakPolarHBondContact OD1-CB 2.94Å; D337-S339 PolarHBondContact OD1-N 3.37Å; D337-S339 PolarHBondContact OD1-OG 3.47Å; D337-S339 PolarHBondContact OD2-OG 3.24Å; D337-K340 HydrophobicContact CB-CG 4.02Å; D337-K340 VanDerWaalsContact CG-CG 3.5Å; D337-K340 VanDerWaalsContact OD2-CG 3.25Å; D337-K340 WeakPolarHBondContact OD2-CG 3.27Å; D337-S353 VanDerWaalsContact O-CB 3.29Å; D337-S353 WeakPolarHBondContact O-CB 3.31Å; D337-S353 PolarHBondContact O-OG 3.4Å; D337-C355 HydrophobicContact CB-CB 4.41Å; D337-C355 PolarHBondContact N-O 2.96Å
338	L	92.9	Very high	95.5	Very high	124 Å²	124	57.2 Å²	57.2	65%	0.649	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-12.4	178.7	-60.5	-179.6	0	0	0	113.4	K336 K340	K336-L338 HydrophobicContact CD-CD2 3.85Å; K336-L338 HydrophobicContact CG-CD2 4.05Å; K336-L338 PolarHBondContact O-N 3.42Å; L338-K340 VanDerWaalsContact C-N 3.27Å
339	S	91.2	Very high	95.3	Very high	103 Å²	103	58 Å²	58	72%	0.72	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-19.5	176.4	77.2	0	0	0	0	112.6	D337	D337-S339 VanDerWaalsContact C-N 3.31Å; D337-S339 WeakPolarHBondContact OD1-CA 3.37Å; D337-S339 VanDerWaalsContact OD1-CB 3.28Å; D337-S339 WeakPolarHBondContact OD1-CB 2.94Å; D337-S339 PolarHBondContact OD1-N 3.37Å; D337-S339 PolarHBondContact OD1-OG 3.47Å; D337-S339 PolarHBondContact OD2-OG 3.24Å
340	K	92.3	Very high	95	Very high	80 Å²	80	60.1 Å²	60.1	35%	0.348	30%	0.301	S	S	.	.	S	Bend	trans	-89	157.6	-179.6	-59.4	-79.2	-174.1	164.1	0	110.8	D337 L338 Q342 S354 C355	D337-K340 HydrophobicContact CB-CG 4.02Å; D337-K340 VanDerWaalsContact CG-CG 3.5Å; D337-K340 VanDerWaalsContact OD2-CG 3.25Å; D337-K340 WeakPolarHBondContact OD2-CG 3.27Å; L338-K340 VanDerWaalsContact C-N 3.27Å; K340-Q342 PolarHBondContact O-N 3.3Å; K340-Q342 PolarHBondContact O-NE2 3.11Å; K340-S354 WeakPolarHBondContact CB-OG 3.49Å; K340-C355 HydrophobicContact CB-CB 4.14Å; K340-C355 HydrophobicContact CG-CB 3.88Å
341	P	94.4	Very high	94.8	Very high	78 Å²	78	62 Å²	62	51%	0.506	32%	0.317	S	S	.	.			trans	-53	140.9	176.3	-26.6	34.3	0	0	0	112	L343 S354	P341-L343 HydrophobicContact CB-CD1 3.88Å; P341-L343 HydrophobicContact CB-CG 3.94Å; P341-L343 PolarHBondContact O-N 2.59Å; P341-S354 WeakPolarHBondContact CD-OG 3.48Å; P341-S354 WeakPolarHBondContact O-CB 3.18Å; P341-S354 PolarHBondContact O-N 2.99Å; P341-S354 PolarHBondContact O-OG 2.85Å
342	Q	94.9	Very high	94.5	Very high	47 Å²	47	62 Å²	62	22%	0.22	32%	0.317	C	S	.	.			trans	-84.9	65.3	176.8	-57.7	-58.4	-70.9	0	0	110.3	K340 A352	K340-Q342 PolarHBondContact O-N 3.3Å; K340-Q342 PolarHBondContact O-NE2 3.11Å; Q342-A352 CarbonylContact C-O 3.57Å; Q342-A352 WeakPolarHBondContact CA-O 3.42Å
343	L	95.9	Very high	94.5	Very high	59 Å²	59	61.4 Å²	61.4	31%	0.309	31%	0.314	S	S	.	.			trans	-117.8	130.1	-175	-65.9	175.3	0	0	0	111.5	H300 P341 K347 D348 A352 S354	H300-L343 HydrophobicContact CB-CB 4.13Å; P341-L343 HydrophobicContact CB-CD1 3.88Å; P341-L343 HydrophobicContact CB-CG 3.94Å; P341-L343 PolarHBondContact O-N 2.59Å; L343-K347 WeakPolarHBondContact CA-O 3.36Å; L343-D348 HydrophobicContact CD2-CB 4.4Å; L343-A352 PolarHBondContact N-O 3.47Å; L343-S354 VanDerWaalsContact O-CA 3.26Å; L343-S354 WeakPolarHBondContact O-CA 3.17Å
344	F	96.9	Very high	94.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-119.1	113.2	171.7	-168.7	-90.7	0	0	0	109.2	L124 A128 F131 L132 L299 V314 W317 K346 K347 I349 F350 A352	L124-F344 HydrophobicContact CD1-CE1 4.12Å; A128-F344 HydrophobicContact CB-CE1 3.89Å; A128-F344 HydrophobicContact CB-CZ 4.01Å; F131-F344 HydrophobicContact CD1-CE2 4.17Å; F131-F344 HydrophobicContact CD1-CZ 4.42Å; F131-F344 HydrophobicContact CE1-CE2 4.33Å; L132-F344 HydrophobicContact CD2-CD2 4.34Å; L132-F344 HydrophobicContact CD2-CE2 4.09Å; L132-F344 HydrophobicContact CG-CE2 4.36Å; L299-F344 HydrophobicContact CB-CD2 4.16Å; L299-F344 HydrophobicContact CB-CE2 4.5Å; L299-F344 HydrophobicContact CD1-CD2 4.12Å; L299-F344 HydrophobicContact CD1-CE2 4.09Å; V314-F344 HydrophobicContact CG1-CZ 4.21Å; V314-F344 HydrophobicContact CG2-CE1 3.57Å; V314-F344 HydrophobicContact CG2-CZ 3.54Å; W317-F344 HydrophobicContact CZ3-CE2 4.11Å; W317-F344 AromaticContact CZ3-CZ 3.93Å; W317-F344 HydrophobicContact CZ3-CZ 3.93Å; F344-K346 VanDerWaalsContact C-N 3.28Å; F344-K346 PolarHBondContact O-N 3.18Å; F344-K347 PolarHBondContact N-O 3.41Å; F344-K347 WeakPolarHBondContact O-CB 3.12Å; F344-K347 PolarHBondContact O-N 3.24Å; F344-I349 HydrophobicContact CB-CG1 4.28Å; F344-F350 HydrophobicContact CD1-CD2 4.05Å; F344-F350 HydrophobicContact CD1-CE2 4.09Å; F344-F350 HydrophobicContact CE1-CE2 4.37Å; F344-F350 HydrophobicContact CG-CD2 4.27Å; F344-A352 HydrophobicContact CB-CB 4.14Å; F344-A352 HydrophobicContact CD2-CB 3.99Å; F344-A352 HydrophobicContact CG-CB 4.45Å
345	L	96.3	Very high	94.3	Very high	5 Å²	5	58.1 Å²	58.1	3%	0.026	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	49.3	-175	-63.7	176.2	0	0	0	112.7	L124 L299 H300 P302 D310 V313 V314 W317 K347	L124-L345 HydrophobicContact CD1-CD1 4.26Å; L299-L345 PolarHBondContact O-N 3.31Å; H300-L345 CarbonylContact O-C 3.56Å; P302-L345 HydrophobicContact CG-CD2 3.91Å; D310-L345 HydrophobicContact CB-CD1 3.72Å; V313-L345 HydrophobicContact CG1-CD1 4.43Å; V313-L345 HydrophobicContact CG1-CD2 4.03Å; V314-L345 HydrophobicContact CG2-CD1 3.73Å; W317-L345 HydrophobicContact CH2-CD1 4.45Å; W317-L345 HydrophobicContact CH2-CD2 3.35Å; W317-L345 HydrophobicContact CH2-CG 3.88Å; W317-L345 HydrophobicContact CZ2-CD2 3.89Å; W317-L345 HydrophobicContact CZ3-CD2 4.17Å; W317-L345 HydrophobicContact CZ3-CG 4.26Å; L345-K347 PolarHBondContact O-N 3.16Å; L345-K347 PolarHBondContact O-NZ 3.35Å
346	K	94.4	Very high	94.4	Very high	161 Å²	161	55 Å²	55	70%	0.7	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	13.6	-178.1	-51.9	-179.2	-179.5	177	0	115.2	H300 F344	H300-K346 WeakPolarHBondContact O-CG 3.39Å; H300-K346 PolarHBondContact O-N 3.42Å; F344-K346 VanDerWaalsContact C-N 3.28Å; F344-K346 PolarHBondContact O-N 3.18Å
347	K	94.8	Very high	94.5	Very high	73 Å²	73	52.2 Å²	52.2	32%	0.317	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-114.5	140.2	178.9	-58.7	175.7	-164.6	72.5	0	109.7	L124 D310 L343 F344 L345 I349	L124-K347 HydrophobicContact CD2-CD 4.44Å; D310-K347 VanDerWaalsContact CG-NZ 3.3Å; D310-K347 IonicContact OD1-NZ 2.82Å; D310-K347 WeakPolarHBondContact OD2-CE 3.47Å; D310-K347 IonicContact OD2-NZ 2.72Å; D310-K347 PolarHBondContact OD2-NZ 3.42Å; L343-K347 WeakPolarHBondContact CA-O 3.36Å; F344-K347 PolarHBondContact N-O 3.41Å; F344-K347 WeakPolarHBondContact O-CB 3.12Å; F344-K347 PolarHBondContact O-N 3.24Å; L345-K347 PolarHBondContact O-N 3.16Å; L345-K347 PolarHBondContact O-NZ 3.35Å; K347-I349 HydrophobicContact CB-CD1 3.7Å; K347-I349 HydrophobicContact CB-CG1 3.75Å; K347-I349 HydrophobicContact CB-CG2 4.29Å; K347-I349 HydrophobicContact CD-CD1 3.85Å; K347-I349 HydrophobicContact CG-CD1 4.42Å; K347-I349 PolarHBondContact O-N 3.36Å
348	D	94.7	Very high	94.7	Very high	130 Å²	130	51.7 Å²	51.7	70%	0.695	27%	0.269	S	S	*	.			trans	-85.3	82.8	171.7	-175.5	3.1	0	0	0	108.9	L343	L343-D348 HydrophobicContact CD2-CB 4.4Å
349	I	92.8	Very high	95	Very high	52 Å²	52	45.8 Å²	45.8	27%	0.267	24%	0.238	S	C	.	.			trans	-142.6	159.8	-175.4	55.6	179.8	0	0	0	110.5	L124 F344 K347 N351 A352	L124-I349 HydrophobicContact CD2-CD1 4.05Å; F344-I349 HydrophobicContact CB-CG1 4.28Å; K347-I349 HydrophobicContact CB-CD1 3.7Å; K347-I349 HydrophobicContact CB-CG1 3.75Å; K347-I349 HydrophobicContact CB-CG2 4.29Å; K347-I349 HydrophobicContact CD-CD1 3.85Å; K347-I349 HydrophobicContact CG-CD1 4.42Å; K347-I349 PolarHBondContact O-N 3.36Å; I349-N351 PolarHBondContact O-N 3.43Å; I349-A352 PolarHBondContact O-N 2.98Å
350	F	93	Very high	95.3	Very high	43 Å²	43	41 Å²	41	19%	0.189	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	7.1	176.7	-45.3	-58.7	0	0	0	116.6	L124 D125 A128 L132 F344 A352	L124-F350 HydrophobicContact CG-CE2 4.38Å; L124-F350 HydrophobicContact CG-CZ 4.45Å; D125-F350 HydrophobicContact CB-CE1 4.39Å; D125-F350 HydrophobicContact CB-CZ 4.48Å; D125-F350 WeakPolarHBondContact OD1-CE1 3.43Å; D125-F350 WeakPolarHBondContact OD1-CZ 3.49Å; A128-F350 HydrophobicContact CB-CD2 3.72Å; A128-F350 HydrophobicContact CB-CE1 4.32Å; A128-F350 HydrophobicContact CB-CE2 3.32Å; A128-F350 HydrophobicContact CB-CG 4.37Å; A128-F350 HydrophobicContact CB-CZ 3.68Å; L132-F350 HydrophobicContact CD1-CB 3.53Å; L132-F350 HydrophobicContact CD1-CD2 4.29Å; L132-F350 HydrophobicContact CD1-CG 4.08Å; F344-F350 HydrophobicContact CD1-CD2 4.05Å; F344-F350 HydrophobicContact CD1-CE2 4.09Å; F344-F350 HydrophobicContact CE1-CE2 4.37Å; F344-F350 HydrophobicContact CG-CD2 4.27Å; F350-A352 HydrophobicContact CB-CB 4.43Å; F350-A352 PolarHBondContact O-N 3.47Å
351	N	93	Very high	95.6	Very high	117 Å²	117	37.2 Å²	37.2	63%	0.626	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	42.9	-171.8	-174.9	15.2	0	0	0	110.8	K336 I349	K336-N351 WeakPolarHBondContact CE-O 3.35Å; K336-N351 PolarHBondContact NZ-O 3.07Å; K336-N351 PolarHBondContact NZ-OD1 2.78Å; K336-N351 VanDerWaalsContact NZ-OD1 3.11Å; I349-N351 PolarHBondContact O-N 3.43Å
352	A	94.1	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.			trans	-95.5	136.7	179.6	0	0	0	0	0	109.8	L132 Q342 L343 F344 I349 F350 Y356	L132-A352 HydrophobicContact CD1-CB 4.02Å; L132-A352 HydrophobicContact CD2-CB 3.86Å; Q342-A352 CarbonylContact C-O 3.57Å; Q342-A352 WeakPolarHBondContact CA-O 3.42Å; L343-A352 PolarHBondContact N-O 3.47Å; F344-A352 HydrophobicContact CB-CB 4.14Å; F344-A352 HydrophobicContact CD2-CB 3.99Å; F344-A352 HydrophobicContact CG-CB 4.45Å; I349-A352 PolarHBondContact O-N 2.98Å; F350-A352 HydrophobicContact CB-CB 4.43Å; F350-A352 PolarHBondContact O-N 3.47Å; A352-Y356 WeakPolarHBondContact CA-OH 3.46Å
353	S	95.7	Very high	95.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.			trans	-68.6	151.3	166.7	-176.3	0	0	0	0	110.2	D337 C355 Y356	D337-S353 VanDerWaalsContact O-CB 3.29Å; D337-S353 WeakPolarHBondContact O-CB 3.31Å; D337-S353 PolarHBondContact O-OG 3.4Å; S353-C355 WeakPolarHBondContact CB-O 3.5Å; S353-C355 PolarHBondContact O-N 3.42Å; S353-C355 PolarHBondContact OG-N 3.18Å; S353-C355 VanDerWaalsContact OG-N 3.12Å; S353-C355 PolarHBondContact OG-O 3.15Å; S353-C355 VanDerWaalsContact OG-O 3.08Å; S353-Y356 PolarHBondContact N-OH 3.29Å; S353-Y356 VanDerWaalsContact O-CE2 3.23Å; S353-Y356 WeakPolarHBondContact O-CE2 3.46Å
354	S	95.9	Very high	95.7	Very high	6 Å²	6	40 Å²	40	4%	0.042	19%	0.189	C	C	.	.	S	Bend	trans	-68.1	-10.9	166.3	52	0	0	0	0	113.3	H298 L299 K340 P341 L343	H298-S354 CarbonylContact C-O 3.18Å; H298-S354 WeakPolarHBondContact CA-O 3.3Å; L299-S354 PolarHBondContact N-O 3.05Å; K340-S354 WeakPolarHBondContact CB-OG 3.49Å; P341-S354 WeakPolarHBondContact CD-OG 3.48Å; P341-S354 WeakPolarHBondContact O-CB 3.18Å; P341-S354 PolarHBondContact O-N 2.99Å; P341-S354 PolarHBondContact O-OG 2.85Å; L343-S354 VanDerWaalsContact O-CA 3.26Å; L343-S354 WeakPolarHBondContact O-CA 3.17Å
355	C	95.1	Very high	95.4	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.007	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	133.5	-175.1	176	0	0	0	0	111.9	E296 I297 D337 K340 S353	E296-C355 WeakPolarHBondContact CG-SG 3.43Å; E296-C355 PolarHBondContact OE1-SG 3.48Å; E296-C355 PolarHBondContact OE2-SG 3.42Å; I297-C355 WeakPolarHBondContact O-CA 3.09Å; D337-C355 HydrophobicContact CB-CB 4.41Å; D337-C355 PolarHBondContact N-O 2.96Å; K340-C355 HydrophobicContact CB-CB 4.14Å; K340-C355 HydrophobicContact CG-CB 3.88Å; S353-C355 WeakPolarHBondContact CB-O 3.5Å; S353-C355 PolarHBondContact O-N 3.42Å; S353-C355 PolarHBondContact OG-N 3.18Å; S353-C355 VanDerWaalsContact OG-N 3.12Å; S353-C355 PolarHBondContact OG-O 3.15Å; S353-C355 VanDerWaalsContact OG-O 3.08Å
356	Y	96.4	Very high	94.5	Very high	7 Å²	7	49.8 Å²	49.8	3%	0.027	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.6	172	-68.1	-106.2	0	0	0	109.9	I135 E296 I297 L299 Y335 K336 A352 S353	I135-Y356 HydrophobicContact CD1-CD1 4Å; I135-Y356 HydrophobicContact CD1-CD2 3.96Å; I135-Y356 HydrophobicContact CD1-CE1 4.14Å; I135-Y356 HydrophobicContact CD1-CE2 4.09Å; I135-Y356 HydrophobicContact CD1-CG 3.92Å; E296-Y356 CarbonylContact C-O 3.29Å; E296-Y356 WeakPolarHBondContact CA-O 3.3Å; I297-Y356 WeakPolarHBondContact CG1-O 3.33Å; I297-Y356 PolarHBondContact N-O 3.06Å; I297-Y356 PolarHBondContact O-N 3.36Å; I297-Y356 VanDerWaalsContact O-N 3.07Å; L299-Y356 HydrophobicContact CD1-CD2 3.58Å; L299-Y356 HydrophobicContact CD1-CE2 3.54Å; L299-Y356 HydrophobicContact CG-CD2 4.36Å; Y335-Y356 CarbonylContact O-C 3.48Å; Y335-Y356 VanDerWaalsContact O-CA 3.28Å; Y335-Y356 WeakPolarHBondContact O-CA 3.11Å; K336-Y356 HydrophobicContact CB-CD1 3.87Å; K336-Y356 HydrophobicContact CB-CE1 3.53Å; K336-Y356 HydrophobicContact CD-CE1 4.08Å; K336-Y356 HydrophobicContact CG-CD1 4.21Å; K336-Y356 HydrophobicContact CG-CE1 3.54Å; A352-Y356 WeakPolarHBondContact CA-OH 3.46Å; S353-Y356 PolarHBondContact N-OH 3.29Å; S353-Y356 VanDerWaalsContact O-CE2 3.23Å; S353-Y356 WeakPolarHBondContact O-CE2 3.46Å
357	T	96.1	Very high	94.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121	167.5	-55.7	0	0	0	0	109.4	K159 W161 I294 F295 S334 Y335	K159-T357 WeakPolarHBondContact CD-OG1 3.46Å; K159-T357 WeakPolarHBondContact CE-OG1 3.35Å; K159-T357 PolarHBondContact NZ-OG1 3.35Å; W161-T357 HydrophobicContact CE3-CG2 4.11Å; W161-T357 HydrophobicContact CZ3-CG2 4.22Å; I294-T357 HydrophobicContact CG2-CG2 3.8Å; F295-T357 WeakPolarHBondContact O-CA 3.41Å; S334-T357 WeakPolarHBondContact CA-O 3.45Å; Y335-T357 PolarHBondContact N-O 2.94Å; Y335-T357 PolarHBondContact O-N 3.16Å
358	L	97.8	Very high	94.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.1	-174.7	-59.3	-175.2	0	0	0	109.6	I135 I294 F295 I297 L331 S334 W360	I135-L358 HydrophobicContact CB-CD1 3.96Å; I135-L358 HydrophobicContact CB-CD2 4.06Å; I135-L358 HydrophobicContact CG2-CD1 3.72Å; I294-L358 CarbonylContact C-O 3.6Å; I294-L358 VanDerWaalsContact CA-O 3.32Å; I294-L358 WeakPolarHBondContact CA-O 3.4Å; F295-L358 PolarHBondContact N-O 3.13Å; F295-L358 PolarHBondContact O-N 3.42Å; I297-L358 HydrophobicContact CD1-CD1 3.4Å; I297-L358 VanDerWaalsContact CD1-CD1 3.4Å; I297-L358 HydrophobicContact CD1-CG 4.15Å; I297-L358 HydrophobicContact CG1-CD1 3.89Å; I297-L358 HydrophobicContact CG1-CG 4.17Å; I297-L358 HydrophobicContact CG2-CD1 4.44Å; L331-L358 HydrophobicContact CD1-CB 3.93Å; L331-L358 HydrophobicContact CD1-CD2 4.35Å; S334-L358 WeakPolarHBondContact OG-CD2 2.95Å; L358-W360 HydrophobicContact CB-CE3 4.14Å; L358-W360 HydrophobicContact CB-CH2 3.16Å; L358-W360 HydrophobicContact CB-CZ2 3.72Å; L358-W360 HydrophobicContact CB-CZ3 3.39Å; L358-W360 HydrophobicContact CD1-CH2 3.46Å; L358-W360 VanDerWaalsContact CD1-CH2 3.46Å; L358-W360 HydrophobicContact CD1-CZ2 3.64Å; L358-W360 HydrophobicContact CD1-CZ3 4.49Å; L358-W360 HydrophobicContact CG-CH2 3.94Å; L358-W360 HydrophobicContact CG-CZ2 4.34Å; L358-W360 VanDerWaalsContact O-CZ3 3.23Å; L358-W360 WeakPolarHBondContact O-CZ3 3.39Å
359	S	98.1	Very high	94.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.1	178.8	-51.9	0	0	0	0	111.3	S162 L293 L331 F332 H333	S162-S359 WeakPolarHBondContact O-CB 3.48Å; S162-S359 PolarHBondContact O-OG 3.36Å; L293-S359 CarbonylContact O-C 3.59Å; L293-S359 WeakPolarHBondContact O-CA 3.31Å; L331-S359 WeakPolarHBondContact CD1-O 3.42Å; F332-S359 WeakPolarHBondContact CD1-O 3.44Å; F332-S359 VanDerWaalsContact CE1-CB 3.4Å; F332-S359 PolarHBondContact N-O 3.28Å; H333-S359 PolarHBondContact N-O 2.65Å; H333-S359 PolarHBondContact O-N 3.32Å
360	W	98.5	Very high	94.6	Very high	2 Å²	2	37 Å²	37	1%	0.008	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	147.8	175.3	-60.3	-101.5	0	0	0	111.4	Q292 L293 F295 L321 L324 F329 R330 L331 L358	Q292-W360 WeakPolarHBondContact CA-O 3.46Å; L293-W360 HydrophobicContact CB-CB 4.39Å; L293-W360 HydrophobicContact CB-CE3 4.09Å; L293-W360 PolarHBondContact N-O 3.13Å; L293-W360 PolarHBondContact O-N 3.3Å; F295-W360 HydrophobicContact CB-CZ3 4.02Å; F295-W360 HydrophobicContact CG-CZ3 4.4Å; L321-W360 HydrophobicContact CD2-CH2 4.22Å; L321-W360 HydrophobicContact CD2-CZ2 3.73Å; L324-W360 HydrophobicContact CD1-CD2 4.23Å; L324-W360 HydrophobicContact CD1-CZ2 4.23Å; F329-W360 HydrophobicContact CB-CB 4.14Å; F329-W360 HydrophobicContact CD1-CB 3.92Å; R330-W360 VanDerWaalsContact O-CA 3.29Å; R330-W360 WeakPolarHBondContact O-CA 3.38Å; L331-W360 VanDerWaalsContact CA-CD1 3.45Å; L331-W360 HydrophobicContact CD1-CD2 3.91Å; L331-W360 HydrophobicContact CD1-CG 4.21Å; L331-W360 HydrophobicContact CD1-CZ2 3.93Å; L331-W360 VanDerWaalsContact N-CD1 3.29Å; L358-W360 HydrophobicContact CB-CE3 4.14Å; L358-W360 HydrophobicContact CB-CH2 3.16Å; L358-W360 HydrophobicContact CB-CZ2 3.72Å; L358-W360 HydrophobicContact CB-CZ3 3.39Å; L358-W360 HydrophobicContact CD1-CH2 3.46Å; L358-W360 VanDerWaalsContact CD1-CH2 3.46Å; L358-W360 HydrophobicContact CD1-CZ2 3.64Å; L358-W360 HydrophobicContact CD1-CZ3 4.49Å; L358-W360 HydrophobicContact CG-CH2 3.94Å; L358-W360 HydrophobicContact CG-CZ2 4.34Å; L358-W360 VanDerWaalsContact O-CZ3 3.23Å; L358-W360 WeakPolarHBondContact O-CZ3 3.39Å
361	V	98.1	Very high	94.7	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.6	171.8	63.6	0	0	0	0	110.3	I140 F169 Q292 F329 R330 F332 T363	I140-V361 HydrophobicContact CG2-CG1 3.97Å; F169-V361 HydrophobicContact CB-CG2 3.68Å; F169-V361 HydrophobicContact CD1-CG1 4.47Å; F169-V361 HydrophobicContact CD1-CG2 3.54Å; F169-V361 HydrophobicContact CD2-CG1 4.42Å; F169-V361 HydrophobicContact CD2-CG2 3.7Å; F169-V361 HydrophobicContact CE1-CG1 4.12Å; F169-V361 HydrophobicContact CE1-CG2 4.03Å; F169-V361 HydrophobicContact CE2-CG1 4.05Å; F169-V361 HydrophobicContact CE2-CG2 4.16Å; F169-V361 HydrophobicContact CG-CG2 3.35Å; F169-V361 HydrophobicContact CZ-CG1 3.89Å; F169-V361 HydrophobicContact CZ-CG2 4.32Å; Q292-V361 HydrophobicContact CG-CB 4.36Å; Q292-V361 HydrophobicContact CG-CG2 4.05Å; F329-V361 CarbonylContact C-O 3.54Å; F329-V361 WeakPolarHBondContact CA-O 3.34Å; R330-V361 PolarHBondContact N-O 3.24Å; R330-V361 PolarHBondContact O-N 2.94Å; F332-V361 HydrophobicContact CD1-CB 3.98Å; F332-V361 HydrophobicContact CD1-CG1 4.03Å; F332-V361 HydrophobicContact CE1-CB 4.28Å; V361-T363 PolarHBondContact O-N 3.17Å
362	N	97.7	Very high	94.8	Very high	10 Å²	10	31.3 Å²	31.3	5%	0.053	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	110.9	171.3	-177.2	-17.6	0	0	0	109.3	I290 G291 F329 R364 W365	I290-N362 PolarHBondContact O-ND2 3.13Å; G291-N362 WeakPolarHBondContact O-CB 3.33Å; G291-N362 PolarHBondContact O-N 3.26Å; F329-N362 HydrophobicContact CD1-CB 4.02Å; F329-N362 HydrophobicContact CD2-CB 4.42Å; F329-N362 HydrophobicContact CE1-CB 3.65Å; F329-N362 HydrophobicContact CE2-CB 4.08Å; F329-N362 HydrophobicContact CG-CB 4.4Å; F329-N362 HydrophobicContact CZ-CB 3.7Å; N362-R364 PolarHBondContact O-N 3.09Å; N362-R364 VanDerWaalsContact O-N 3.17Å; N362-R364 PolarHBondContact OD1-N 3.44Å; N362-W365 HydrophobicContact CB-CB 4.09Å; N362-W365 WeakPolarHBondContact O-CB 3.5Å; N362-W365 PolarHBondContact O-N 3.35Å; N362-W365 VanDerWaalsContact O-N 3.09Å; N362-W365 PolarHBondContact OD1-N 3.36Å
363	T	96.4	Very high	94.9	Very high	55 Å²	55	33.5 Å²	33.5	34%	0.337	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8.4	-176.4	57.4	0	0	0	0	114	I140 F169 D328 R330 V361	I140-T363 HydrophobicContact CD1-CG2 3.99Å; F169-T363 HydrophobicContact CE1-CG2 4.24Å; D328-T363 PolarHBondContact O-N 3.03Å; D328-T363 PolarHBondContact O-OG1 3.13Å; R330-T363 HydrophobicContact CB-CG2 4.1Å; R330-T363 HydrophobicContact CG-CG2 3.58Å; V361-T363 PolarHBondContact O-N 3.17Å
364	R	93.7	Very high	94.8	Very high	176 Å²	176	36.1 Å²	36.1	66%	0.664	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	2.7	173.1	-66.8	-165.1	175.1	153.2	-8.4	113.7	D328 N362 K366	D328-R364 HydrophobicContact CB-CB 4.44Å; D328-R364 HydrophobicContact CB-CG 3.94Å; D328-R364 IonicContact OD1-CZ 2.7Å; D328-R364 IonicContact OD1-NE 3.82Å; D328-R364 PolarHBondContact OD1-NE 3.13Å; D328-R364 IonicContact OD1-NH1 3.24Å; D328-R364 IonicContact OD1-NH2 2.86Å; D328-R364 WeakPolarHBondContact OD2-CD 3.5Å; D328-R364 IonicContact OD2-CZ 3.2Å; D328-R364 IonicContact OD2-NE 3.51Å; D328-R364 PolarHBondContact OD2-NE 3.07Å; D328-R364 IonicContact OD2-NH1 3.85Å; D328-R364 PolarHBondContact OD2-NH1 3.07Å; N362-R364 PolarHBondContact O-N 3.09Å; N362-R364 VanDerWaalsContact O-N 3.17Å; N362-R364 PolarHBondContact OD1-N 3.44Å; R364-K366 PolarHBondContact O-N 3.08Å
365	W	91.6	Very high	94.7	Very high	17 Å²	17	38.6 Å²	38.6	6%	0.064	17%	0.168	C	C	.	.			trans	-63.2	127.7	178.5	-162.7	-114.3	0	0	0	110.7	K262 I263 D264 R289 I290 G291 N362	K262-W365 HydrophobicContact CB-CH2 3.91Å; K262-W365 HydrophobicContact CB-CZ2 4.18Å; K262-W365 HydrophobicContact CD-CH2 3.86Å; K262-W365 HydrophobicContact CD-CZ2 4.07Å; K262-W365 HydrophobicContact CG-CH2 3.81Å; K262-W365 HydrophobicContact CG-CZ2 4.35Å; I263-W365 WeakPolarHBondContact O-CZ2 3.44Å; D264-W365 PolarHBondContact OD1-NE1 3.46Å; R289-W365 VanDerWaalsContact C-CH2 3.41Å; R289-W365 VanDerWaalsContact C-CZ3 3.48Å; R289-W365 VanDerWaalsContact O-CH2 3.25Å; R289-W365 WeakPolarHBondContact O-CH2 3.37Å; I290-W365 VanDerWaalsContact C-CZ3 3.44Å; G291-W365 VanDerWaalsContact CA-CE2 3.47Å; N362-W365 HydrophobicContact CB-CB 4.09Å; N362-W365 WeakPolarHBondContact O-CB 3.5Å; N362-W365 PolarHBondContact O-N 3.35Å; N362-W365 VanDerWaalsContact O-N 3.09Å; N362-W365 PolarHBondContact OD1-N 3.36Å
366	K	76.9	Confident	94.7	Very high	194 Å²	194	42 Å²	42	84%	0.843	18%	0.182	S	C	*	.			trans	-133.1	0	177.9	-66.1	-173.1	-176.1	-176.8	0	110.2	N170 K262 R364	N170-K366 PolarHBondContact ND2-OXT 3.23Å; K262-K366 PolarHBondContact NZ-O 3.34Å; R364-K366 PolarHBondContact O-N 3.08Å

Retrieved 366 of 366 residues in 99.1 ms (Link to these results)

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