A0A077Z214_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z214, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 596 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	42.7	Very low	42.6	Very low	224 Å²	224	137 Å²	137	100%	1.103	80%	0.803	S	S	*	*				0	-24.4	0	-98.1	-178.5	173.3	0	0	114.6
2	L	36.7	Very low	43.5	Very low	166 Å²	166	134.3 Å²	134.3	87%	0.869	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-80.4	-12.7	172.3	-113.8	89.1	0	0	0	115.1
3	F	36.3	Very low	43.8	Very low	200 Å²	200	132.5 Å²	132.5	88%	0.877	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-93	-0.7	-176.2	-97.4	-89.4	0	0	0	115.3
4	L	45	Very low	43.9	Very low	156 Å²	156	136.6 Å²	136.6	82%	0.817	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-92.2	1.9	179.1	-78.7	159.7	0	0	0	113.6
5	G	40.9	Very low	44.4	Very low	68 Å²	68	132.7 Å²	132.7	70%	0.701	75%	0.753	S	S	*	*	S	Bend	trans	-101.1	-4.6	-173.1	0	0	0	0	0	117
6	L	41.1	Very low	44.9	Very low	148 Å²	148	131.3 Å²	131.3	78%	0.775	74%	0.742	S	S	*	*	S	Bend	trans	-111	1.7	-172.2	-79.1	159.9	0	0	0	114.8	G8	L6-G8 PolarHBondContact O-N 3.18Å
7	S	43.7	Very low	45.4	Very low	117 Å²	117	133 Å²	133	82%	0.818	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-3.7	178.4	178.9	0	0	0	0	114.7
8	G	42.6	Very low	46	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	2.4	-168.5	0	0	0	0	0	117.1	L6	L6-G8 PolarHBondContact O-N 3.18Å
9	K	46.8	Very low	46.5	Very low	171 Å²	171	133.7 Å²	133.7	74%	0.743	73%	0.734	S	S	*	*	S	Bend	trans	-119.3	3.7	-172	-68.9	-171.7	177.6	-178.2	0	115.7	S11	K9-S11 VanDerWaalsContact C-N 3.27Å; K9-S11 PolarHBondContact O-N 3.32Å
10	A	44.6	Very low	47.1	Very low	78 Å²	78	129.2 Å²	129.2	65%	0.645	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-73	-15.4	-179.8	0	0	0	0	0	114.1	V12	A10-V12 VanDerWaalsContact C-N 3.29Å; A10-V12 PolarHBondContact O-N 2.77Å
11	S	48.7	Very low	47.4	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-80.9	1.2	-177.3	-51.1	0	0	0	0	115.2	K9	K9-S11 VanDerWaalsContact C-N 3.27Å; K9-S11 PolarHBondContact O-N 3.32Å
12	V	52.8	Low	48.1	Very low	104 Å²	104	125.8 Å²	125.8	63%	0.63	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-103.2	-13.7	-178.7	-174.1	0	0	0	0	112.5	A10 P15	A10-V12 VanDerWaalsContact C-N 3.29Å; A10-V12 PolarHBondContact O-N 2.77Å; V12-P15 WeakPolarHBondContact O-CD 2.83Å
13	L	47.8	Very low	49	Very low	111 Å²	111	120.5 Å²	120.5	58%	0.581	68%	0.675	S	S	*	*	S	Bend	trans	-92.7	-17.6	-176.8	-86.9	146.4	0	0	0	114.3	L16 F17	L13-L16 PolarHBondContact O-N 3.2Å; L13-F17 PolarHBondContact O-N 3.3Å
14	Y	45.4	Very low	50	Low	191 Å²	191	120.8 Å²	120.8	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-65.3	-38.6	177.5	-136.6	-95.6	0	0	0	114.5
15	P	50.8	Low	51	Low	78 Å²	78	116.1 Å²	116.1	51%	0.506	66%	0.66	S	S	.	*	H	α-helix	trans	-77.8	-17.6	176.8	27.4	-30.5	0	0	0	113.8	V12 L19	V12-P15 WeakPolarHBondContact O-CD 2.83Å; P15-L19 PolarHBondContact O-N 3.32Å
16	L	52.6	Low	52.5	Low	110 Å²	110	115.8 Å²	115.8	58%	0.576	66%	0.656	S	S	*	*	H	α-helix	trans	-74	-34.3	173.8	-107.7	106.8	0	0	0	112.2	L13 H18 L19 V20	L13-L16 PolarHBondContact O-N 3.2Å; L16-H18 VanDerWaalsContact C-N 3.32Å; L16-H18 PolarHBondContact O-N 3.41Å; L16-L19 PolarHBondContact O-N 3.07Å; L16-V20 WeakPolarHBondContact O-CG2 2.91Å; L16-V20 PolarHBondContact O-N 2.87Å
17	F	53.6	Low	54	Low	160 Å²	160	117 Å²	117	70%	0.702	66%	0.658	S	S	*	*	H	α-helix	trans	-68.5	-31.4	175.9	-103.3	-90	0	0	0	112.8	L13	L13-F17 PolarHBondContact O-N 3.3Å
18	H	56.4	Low	55.4	Low	144 Å²	144	115.5 Å²	115.5	67%	0.667	64%	0.64	S	S	*	*	H	α-helix	trans	-74.3	-28.4	176.7	-118.9	-72	0	0	0	113.2	L16	L16-H18 VanDerWaalsContact C-N 3.32Å; L16-H18 PolarHBondContact O-N 3.41Å
19	L	55.2	Low	56.7	Low	135 Å²	135	117.4 Å²	117.4	71%	0.707	63%	0.629	S	S	*	*	H	α-helix	trans	-76.7	-29.4	176.6	-121.3	91.1	0	0	0	113	P15 L16 C21 Q22	P15-L19 PolarHBondContact O-N 3.32Å; L16-L19 PolarHBondContact O-N 3.07Å; L19-C21 VanDerWaalsContact C-N 3.28Å; L19-C21 PolarHBondContact O-N 3.37Å; L19-Q22 PolarHBondContact O-N 3.12Å
20	V	58.1	Low	57.9	Low	43 Å²	43	111.7 Å²	111.7	26%	0.261	61%	0.613	S	S	.	*	H	α-helix	trans	-74	-20	-179.2	173.9	0	0	0	0	112.3	L16 Q22	L16-V20 WeakPolarHBondContact O-CG2 2.91Å; L16-V20 PolarHBondContact O-N 2.87Å; V20-Q22 VanDerWaalsContact C-N 3.32Å; V20-Q22 PolarHBondContact O-N 3.38Å
21	C	53.3	Low	59.4	Low	111 Å²	111	110.2 Å²	110.2	75%	0.75	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-2	177.2	-69.5	0	0	0	0	114.8	L19	L19-C21 VanDerWaalsContact C-N 3.28Å; L19-C21 PolarHBondContact O-N 3.37Å
22	Q	57.3	Low	60.7	Low	172 Å²	172	108.1 Å²	108.1	80%	0.804	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	2	179.4	-95.8	-179.1	-13.4	0	0	114.6	L19 V20	L19-Q22 PolarHBondContact O-N 3.12Å; V20-Q22 VanDerWaalsContact C-N 3.32Å; V20-Q22 PolarHBondContact O-N 3.38Å
23	S	56.3	Low	61.8	Low	55 Å²	55	111.7 Å²	111.7	39%	0.385	59%	0.586	S	S	.	*			trans	-93.2	110.2	-179.1	-170.8	0	0	0	0	111.5	S25	S23-S25 PolarHBondContact O-N 3.13Å; S23-S25 PolarHBondContact OG-OG 3.35Å
24	E	56.8	Low	63.4	Low	205 Å²	205	111.9 Å²	111.9	96%	0.958	59%	0.587	S	S	*	*			trans	-72.1	4.6	173.7	-68.9	-173.8	150.1	0	0	113.8	G26	E24-G26 PolarHBondContact O-N 3.42Å
25	S	66.2	Low	65.1	Low	59 Å²	59	108.4 Å²	108.4	41%	0.413	58%	0.581	S	S	.	*			trans	-91.1	105.8	-179.2	70.2	0	0	0	0	111.5	S23 Q27 L28	S23-S25 PolarHBondContact O-N 3.13Å; S23-S25 PolarHBondContact OG-OG 3.35Å; S25-Q27 PolarHBondContact O-N 3.15Å; S25-L28 PolarHBondContact O-N 3.46Å; S25-L28 VanDerWaalsContact O-N 3.09Å
26	G	71.8	Confident	66.5	Low	61 Å²	61	106.5 Å²	106.5	63%	0.629	58%	0.576	S	S	*	*	H	α-helix	trans	-57.4	-17.5	-178	0	0	0	0	0	115.6	E24 A30	E24-G26 PolarHBondContact O-N 3.42Å; G26-A30 PolarHBondContact O-N 2.8Å
27	Q	73.6	Confident	67.7	Low	174 Å²	174	104.2 Å²	104.2	81%	0.813	57%	0.572	S	S	*	*	H	α-helix	trans	-73.8	-35.1	176.4	-69.8	-174.3	-5.9	0	0	113	S25 F29 A31	S25-Q27 PolarHBondContact O-N 3.15Å; Q27-F29 VanDerWaalsContact C-N 3.33Å; Q27-A31 PolarHBondContact O-N 3.24Å
28	L	72.4	Confident	69.1	Low	85 Å²	85	102.7 Å²	102.7	45%	0.445	57%	0.569	S	S	.	*	H	α-helix	trans	-69.4	-36.6	179.1	-153.1	89.5	0	0	0	110.8	S25 A31 V32	S25-L28 PolarHBondContact O-N 3.46Å; S25-L28 VanDerWaalsContact O-N 3.09Å; L28-A31 PolarHBondContact O-N 3.42Å; L28-V32 VanDerWaalsContact O-CG2 3.3Å; L28-V32 WeakPolarHBondContact O-CG2 3.28Å; L28-V32 PolarHBondContact O-N 2.96Å
29	F	70.4	Confident	70.3	Confident	109 Å²	109	105 Å²	105	48%	0.478	57%	0.572	S	S	.	*	H	α-helix	trans	-67.9	-37.4	180	-151.9	-98.3	0	0	0	112.5	Q27 R33	Q27-F29 VanDerWaalsContact C-N 3.33Å; F29-R33 HydrophobicContact CD1-CG 4.45Å; F29-R33 HydrophobicContact CE1-CG 4.47Å; F29-R33 WeakPolarHBondContact O-CB 3.34Å; F29-R33 WeakPolarHBondContact O-CG 2.97Å; F29-R33 PolarHBondContact O-N 3.24Å
30	A	73	Confident	71.4	Confident	50 Å²	50	104.8 Å²	104.8	41%	0.413	57%	0.566	S	S	.	*	H	α-helix	trans	-66	-43.2	174.5	0	0	0	0	0	111.9	G26 R33 L34	G26-A30 PolarHBondContact O-N 2.8Å; A30-R33 PolarHBondContact O-N 2.83Å; A30-L34 PolarHBondContact O-N 3.08Å
31	A	75.9	Confident	72.3	Confident	48 Å²	48	109.1 Å²	109.1	40%	0.397	58%	0.583	S	S	.	*	H	α-helix	trans	-65	-42.5	177.9	0	0	0	0	0	112.3	Q27 L28 L34 L35	Q27-A31 PolarHBondContact O-N 3.24Å; L28-A31 PolarHBondContact O-N 3.42Å; A31-L34 PolarHBondContact O-N 3.17Å; A31-L35 WeakPolarHBondContact O-CB 3.37Å; A31-L35 WeakPolarHBondContact O-CG 3.35Å; A31-L35 PolarHBondContact O-N 3.02Å
32	V	75.5	Confident	73.6	Confident	66 Å²	66	106.4 Å²	106.4	40%	0.4	57%	0.568	S	S	.	*	H	α-helix	trans	-66.1	-38.1	176.7	173.6	0	0	0	0	111.4	L28 G36	L28-V32 VanDerWaalsContact O-CG2 3.3Å; L28-V32 WeakPolarHBondContact O-CG2 3.28Å; L28-V32 PolarHBondContact O-N 2.96Å; V32-G36 PolarHBondContact O-N 3.41Å
33	R	76	Confident	74.7	Confident	179 Å²	179	100.3 Å²	100.3	68%	0.675	54%	0.544	S	S	*	.	H	α-helix	trans	-64.5	-43	173.6	-83.9	-172.6	168	-179.6	-1.2	112.8	F29 A30 G36 A37	F29-R33 HydrophobicContact CD1-CG 4.45Å; F29-R33 HydrophobicContact CE1-CG 4.47Å; F29-R33 WeakPolarHBondContact O-CB 3.34Å; F29-R33 WeakPolarHBondContact O-CG 2.97Å; F29-R33 PolarHBondContact O-N 3.24Å; A30-R33 PolarHBondContact O-N 2.83Å; R33-G36 PolarHBondContact O-N 3.03Å; R33-A37 WeakPolarHBondContact O-CB 3.43Å; R33-A37 PolarHBondContact O-N 2.84Å
34	L	80	Confident	75.9	Confident	115 Å²	115	101.2 Å²	101.2	60%	0.602	54%	0.544	S	S	*	.	H	α-helix	trans	-63.7	-45.8	176.8	-93.3	154.6	0	0	0	111.7	A30 A31 G36 A37 M38	A30-L34 PolarHBondContact O-N 3.08Å; A31-L34 PolarHBondContact O-N 3.17Å; L34-G36 PolarHBondContact O-N 3.02Å; L34-A37 PolarHBondContact O-N 3.44Å; L34-M38 WeakPolarHBondContact O-CB 3.41Å; L34-M38 VanDerWaalsContact O-CG 3.31Å; L34-M38 WeakPolarHBondContact O-CG 3.43Å; L34-M38 PolarHBondContact O-N 3.41Å
35	L	81.2	Confident	77	Confident	117 Å²	117	93.8 Å²	93.8	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-65.1	-38.7	177.4	-73.8	166.5	0	0	0	112	A31 W39	A31-L35 WeakPolarHBondContact O-CB 3.37Å; A31-L35 WeakPolarHBondContact O-CG 3.35Å; A31-L35 PolarHBondContact O-N 3.02Å; L35-W39 WeakPolarHBondContact O-CB 3.45Å; L35-W39 PolarHBondContact O-N 3.48Å
36	G	81.4	Confident	77.8	Confident	39 Å²	39	95.3 Å²	95.3	40%	0.402	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-43.8	174.6	0	0	0	0	0	112.8	V32 R33 L34 W39 F40	V32-G36 PolarHBondContact O-N 3.41Å; R33-G36 PolarHBondContact O-N 3.03Å; L34-G36 PolarHBondContact O-N 3.02Å; G36-W39 PolarHBondContact O-N 3.04Å; G36-F40 WeakPolarHBondContact O-CB 3.47Å; G36-F40 PolarHBondContact O-N 3.4Å
37	A	78.2	Confident	78.1	Confident	61 Å²	61	98.9 Å²	98.9	50%	0.504	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-42.8	176.8	0	0	0	0	0	112	R33 L34 F40 H41	R33-A37 WeakPolarHBondContact O-CB 3.43Å; R33-A37 PolarHBondContact O-N 2.84Å; L34-A37 PolarHBondContact O-N 3.44Å; A37-F40 PolarHBondContact O-N 3.45Å; A37-H41 WeakPolarHBondContact O-CB 3.47Å; A37-H41 PolarHBondContact O-N 2.62Å
38	M	81.1	Confident	78.3	Confident	129 Å²	129	95.3 Å²	95.3	64%	0.635	51%	0.508	S	S	*	.	H	α-helix	trans	-63.5	-42.2	176.1	-72.9	-179.5	69.9	0	0	112	L34 A42	L34-M38 WeakPolarHBondContact O-CB 3.41Å; L34-M38 VanDerWaalsContact O-CG 3.31Å; L34-M38 WeakPolarHBondContact O-CG 3.43Å; L34-M38 PolarHBondContact O-N 3.41Å; M38-A42 WeakPolarHBondContact O-CB 3.25Å; M38-A42 PolarHBondContact O-N 2.9Å
39	W	83.1	Confident	78.6	Confident	191 Å²	191	99.4 Å²	99.4	72%	0.723	52%	0.518	S	S	*	.	H	α-helix	trans	-68.5	-39.5	178.9	-170.5	81	0	0	0	112.4	L35 G36 S43	L35-W39 WeakPolarHBondContact O-CB 3.45Å; L35-W39 PolarHBondContact O-N 3.48Å; G36-W39 PolarHBondContact O-N 3.04Å; W39-S43 WeakPolarHBondContact O-CB 3.36Å; W39-S43 PolarHBondContact O-N 3.47Å; W39-S43 PolarHBondContact O-OG 2.97Å
40	F	77	Confident	78.6	Confident	132 Å²	132	98.2 Å²	98.2	58%	0.579	52%	0.52	S	S	*	.	H	α-helix	trans	-65	-45.2	175.9	-172.7	-105.6	0	0	0	111.7	G36 A37 S43 I44	G36-F40 WeakPolarHBondContact O-CB 3.47Å; G36-F40 PolarHBondContact O-N 3.4Å; A37-F40 PolarHBondContact O-N 3.45Å; F40-S43 PolarHBondContact O-N 2.92Å; F40-I44 HydrophobicContact CD1-CD1 3.74Å; F40-I44 HydrophobicContact CE1-CD1 3.2Å; F40-I44 HydrophobicContact CE1-CG1 4.31Å; F40-I44 HydrophobicContact CE2-CD1 4.17Å; F40-I44 HydrophobicContact CG-CD1 4.44Å; F40-I44 HydrophobicContact CZ-CD1 3.46Å; F40-I44 VanDerWaalsContact CZ-CD1 3.46Å; F40-I44 HydrophobicContact CZ-CG1 4.36Å; F40-I44 WeakPolarHBondContact O-CG1 3.42Å; F40-I44 PolarHBondContact O-N 3.21Å
41	H	78.4	Confident	78.5	Confident	133 Å²	133	99.5 Å²	99.5	62%	0.616	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-45	177.3	-161.3	-62.2	0	0	0	111.4	A37 S43 I44 T45	A37-H41 WeakPolarHBondContact O-CB 3.47Å; A37-H41 PolarHBondContact O-N 2.62Å; H41-S43 VanDerWaalsContact C-N 3.31Å; H41-S43 PolarHBondContact O-N 3.3Å; H41-I44 PolarHBondContact O-N 2.86Å; H41-T45 PolarHBondContact ND1-OG1 3.43Å; H41-T45 WeakPolarHBondContact O-CB 3.48Å; H41-T45 PolarHBondContact O-N 2.92Å; H41-T45 PolarHBondContact O-OG1 2.92Å
42	A	81	Confident	78.2	Confident	54 Å²	54	106 Å²	106	45%	0.446	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-40	176.1	0	0	0	0	0	112.2	M38 T45 V46	M38-A42 WeakPolarHBondContact O-CB 3.25Å; M38-A42 PolarHBondContact O-N 2.9Å; A42-T45 PolarHBondContact O-N 3.25Å; A42-V46 VanDerWaalsContact O-CG2 3.31Å; A42-V46 WeakPolarHBondContact O-CG2 3.42Å; A42-V46 PolarHBondContact O-N 3.3Å
43	S	80.3	Confident	77.9	Confident	44 Å²	44	105.5 Å²	105.5	31%	0.308	54%	0.541	S	S	.	.	H	α-helix	trans	-67.5	-41.7	179.3	-59	0	0	0	0	112.4	W39 F40 H41 M47	W39-S43 WeakPolarHBondContact O-CB 3.36Å; W39-S43 PolarHBondContact O-N 3.47Å; W39-S43 PolarHBondContact O-OG 2.97Å; F40-S43 PolarHBondContact O-N 2.92Å; H41-S43 VanDerWaalsContact C-N 3.31Å; H41-S43 PolarHBondContact O-N 3.3Å; S43-M47 WeakPolarHBondContact O-CB 3.35Å; S43-M47 PolarHBondContact O-N 3.33Å
44	I	79.9	Confident	77.2	Confident	74 Å²	74	100.4 Å²	100.4	38%	0.379	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-44.4	174.8	-73	-179.2	0	0	0	110.9	F40 H41 V46 M47 L48	F40-I44 HydrophobicContact CD1-CD1 3.74Å; F40-I44 HydrophobicContact CE1-CD1 3.2Å; F40-I44 HydrophobicContact CE1-CG1 4.31Å; F40-I44 HydrophobicContact CE2-CD1 4.17Å; F40-I44 HydrophobicContact CG-CD1 4.44Å; F40-I44 HydrophobicContact CZ-CD1 3.46Å; F40-I44 VanDerWaalsContact CZ-CD1 3.46Å; F40-I44 HydrophobicContact CZ-CG1 4.36Å; F40-I44 WeakPolarHBondContact O-CG1 3.42Å; F40-I44 PolarHBondContact O-N 3.21Å; H41-I44 PolarHBondContact O-N 2.86Å; I44-V46 PolarHBondContact O-N 2.72Å; I44-M47 PolarHBondContact O-N 3.2Å; I44-L48 HydrophobicContact CG2-CD1 3.69Å; I44-L48 HydrophobicContact CG2-CG 4.3Å; I44-L48 WeakPolarHBondContact O-CB 3.37Å; I44-L48 WeakPolarHBondContact O-CG 3.16Å; I44-L48 PolarHBondContact O-N 2.82Å
45	T	81.4	Confident	76.2	Confident	49 Å²	49	98.7 Å²	98.7	30%	0.301	53%	0.527	S	S	.	.	H	α-helix	trans	-60.9	-44.6	178.6	-58.3	0	0	0	0	111.1	H41 A42 L48 Y49	H41-T45 PolarHBondContact ND1-OG1 3.43Å; H41-T45 WeakPolarHBondContact O-CB 3.48Å; H41-T45 PolarHBondContact O-N 2.92Å; H41-T45 PolarHBondContact O-OG1 2.92Å; A42-T45 PolarHBondContact O-N 3.25Å; T45-L48 PolarHBondContact O-N 2.9Å; T45-Y49 HydrophobicContact CG2-CD2 3.69Å; T45-Y49 HydrophobicContact CG2-CE2 3.74Å; T45-Y49 VanDerWaalsContact O-CD2 3.31Å; T45-Y49 WeakPolarHBondContact O-CD2 3.46Å; T45-Y49 PolarHBondContact O-N 2.9Å
46	V	82.3	Confident	74.5	Confident	92 Å²	92	95.1 Å²	95.1	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-44.2	176.3	172.3	0	0	0	0	111.5	A42 I44 L48 Y49 T50	A42-V46 VanDerWaalsContact O-CG2 3.31Å; A42-V46 WeakPolarHBondContact O-CG2 3.42Å; A42-V46 PolarHBondContact O-N 3.3Å; I44-V46 PolarHBondContact O-N 2.72Å; V46-L48 PolarHBondContact O-N 3.22Å; V46-Y49 PolarHBondContact O-N 2.99Å; V46-T50 WeakPolarHBondContact O-CB 3.39Å; V46-T50 PolarHBondContact O-N 3.26Å; V46-T50 PolarHBondContact O-OG1 3.31Å
47	M	78.9	Confident	73	Confident	135 Å²	135	98.8 Å²	98.8	67%	0.665	53%	0.533	S	S	*	.	H	α-helix	trans	-58.6	-46.8	175	-90.7	-72.8	-168.5	0	0	111.9	S43 I44 T50 V51	S43-M47 WeakPolarHBondContact O-CB 3.35Å; S43-M47 PolarHBondContact O-N 3.33Å; I44-M47 PolarHBondContact O-N 3.2Å; M47-T50 PolarHBondContact O-N 2.99Å; M47-V51 WeakPolarHBondContact O-CG2 3.35Å; M47-V51 PolarHBondContact O-N 3.16Å
48	L	77	Confident	71.4	Confident	100 Å²	100	99.7 Å²	99.7	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-63.5	-42.3	178	-75.8	169.1	0	0	0	112.2	I44 T45 V46 T50 V51 Y52	I44-L48 HydrophobicContact CG2-CD1 3.69Å; I44-L48 HydrophobicContact CG2-CG 4.3Å; I44-L48 WeakPolarHBondContact O-CB 3.37Å; I44-L48 WeakPolarHBondContact O-CG 3.16Å; I44-L48 PolarHBondContact O-N 2.82Å; T45-L48 PolarHBondContact O-N 2.9Å; V46-L48 PolarHBondContact O-N 3.22Å; L48-T50 VanDerWaalsContact C-N 3.32Å; L48-T50 PolarHBondContact O-N 3.5Å; L48-V51 PolarHBondContact O-N 3.43Å; L48-Y52 WeakPolarHBondContact O-CB 3.46Å; L48-Y52 PolarHBondContact O-N 3.33Å
49	Y	77.7	Confident	69.4	Low	170 Å²	170	100.1 Å²	100.1	67%	0.667	54%	0.544	S	S	*	.	H	α-helix	trans	-64.9	-35.4	174.1	-92.3	-74.5	0	0	0	112.4	T45 V46 Y52 A53	T45-Y49 HydrophobicContact CG2-CD2 3.69Å; T45-Y49 HydrophobicContact CG2-CE2 3.74Å; T45-Y49 VanDerWaalsContact O-CD2 3.31Å; T45-Y49 WeakPolarHBondContact O-CD2 3.46Å; T45-Y49 PolarHBondContact O-N 2.9Å; V46-Y49 PolarHBondContact O-N 2.99Å; Y49-Y52 PolarHBondContact O-N 3.41Å; Y49-A53 WeakPolarHBondContact O-CB 3.39Å; Y49-A53 PolarHBondContact O-N 3.05Å
50	T	72.1	Confident	67.1	Low	84 Å²	84	99 Å²	99	52%	0.515	55%	0.547	S	S	.	.	H	α-helix	trans	-71.2	-38.2	177.7	-41.3	0	0	0	0	110.8	V46 M47 L48 S54	V46-T50 WeakPolarHBondContact O-CB 3.39Å; V46-T50 PolarHBondContact O-N 3.26Å; V46-T50 PolarHBondContact O-OG1 3.31Å; M47-T50 PolarHBondContact O-N 2.99Å; L48-T50 VanDerWaalsContact C-N 3.32Å; L48-T50 PolarHBondContact O-N 3.5Å; T50-S54 VanDerWaalsContact O-CB 3.31Å; T50-S54 WeakPolarHBondContact O-CB 3.25Å; T50-S54 PolarHBondContact O-N 2.84Å; T50-S54 PolarHBondContact O-OG 2.93Å
51	V	70.2	Confident	65.4	Low	77 Å²	77	101.9 Å²	101.9	47%	0.467	56%	0.56	S	S	.	*	H	α-helix	trans	-66.5	-45.5	172.1	174	0	0	0	0	110.8	M47 L48 A53 S54 V55	M47-V51 WeakPolarHBondContact O-CG2 3.35Å; M47-V51 PolarHBondContact O-N 3.16Å; L48-V51 PolarHBondContact O-N 3.43Å; V51-A53 PolarHBondContact O-N 3.37Å; V51-S54 WeakPolarHBondContact CA-OG 3.34Å; V51-S54 PolarHBondContact O-N 3.42Å; V51-S54 PolarHBondContact O-OG 3.48Å; V51-V55 HydrophobicContact CG1-CG2 4.24Å; V51-V55 WeakPolarHBondContact O-CB 3.43Å; V51-V55 VanDerWaalsContact O-CG2 3.23Å; V51-V55 WeakPolarHBondContact O-CG2 3.43Å; V51-V55 PolarHBondContact O-N 3.18Å
52	Y	70.1	Confident	63.6	Low	185 Å²	185	101.1 Å²	101.1	73%	0.725	57%	0.566	S	S	*	*	H	α-helix	trans	-63.6	-39	175.6	-109.8	-87.9	0	0	0	112.8	L48 Y49 G56	L48-Y52 WeakPolarHBondContact O-CB 3.46Å; L48-Y52 PolarHBondContact O-N 3.33Å; Y49-Y52 PolarHBondContact O-N 3.41Å; Y52-G56 WeakPolarHBondContact O-CA 3.45Å; Y52-G56 PolarHBondContact O-N 2.95Å
53	A	67.8	Low	61.8	Low	56 Å²	56	101.6 Å²	101.6	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-70.2	-38.4	176.6	0	0	0	0	0	111.9	Y49 V51 V57	Y49-A53 WeakPolarHBondContact O-CB 3.39Å; Y49-A53 PolarHBondContact O-N 3.05Å; V51-A53 PolarHBondContact O-N 3.37Å; A53-V57 VanDerWaalsContact O-CB 3.31Å; A53-V57 WeakPolarHBondContact O-CB 3.37Å; A53-V57 WeakPolarHBondContact O-CG2 3.35Å; A53-V57 PolarHBondContact O-N 3.18Å
54	S	62.4	Low	60	Low	72 Å²	72	105.9 Å²	105.9	50%	0.503	59%	0.588	S	S	.	*	H	α-helix	trans	-73.3	-33.2	177.3	54.1	0	0	0	0	113.5	T50 V51	T50-S54 VanDerWaalsContact O-CB 3.31Å; T50-S54 WeakPolarHBondContact O-CB 3.25Å; T50-S54 PolarHBondContact O-N 2.84Å; T50-S54 PolarHBondContact O-OG 2.93Å; V51-S54 WeakPolarHBondContact CA-OG 3.34Å; V51-S54 PolarHBondContact O-N 3.42Å; V51-S54 PolarHBondContact O-OG 3.48Å
55	V	58.2	Low	58.3	Low	79 Å²	79	104.9 Å²	104.9	48%	0.479	60%	0.597	S	S	.	*	H	α-helix	trans	-79.6	-36.2	174.1	176.9	0	0	0	0	111.1	V51 A58 L59	V51-V55 HydrophobicContact CG1-CG2 4.24Å; V51-V55 WeakPolarHBondContact O-CB 3.43Å; V51-V55 VanDerWaalsContact O-CG2 3.23Å; V51-V55 WeakPolarHBondContact O-CG2 3.43Å; V51-V55 PolarHBondContact O-N 3.18Å; V55-A58 PolarHBondContact O-N 2.95Å; V55-L59 HydrophobicContact CG1-CD1 4.19Å
56	G	46.8	Very low	56.6	Low	42 Å²	42	106.5 Å²	106.5	43%	0.433	61%	0.607	S	S	.	*	H	α-helix	trans	-70.4	-33.3	179	0	0	0	0	0	114	Y52 A58	Y52-G56 WeakPolarHBondContact O-CA 3.45Å; Y52-G56 PolarHBondContact O-N 2.95Å; G56-A58 VanDerWaalsContact C-N 3.34Å
57	V	48.6	Very low	54.6	Low	115 Å²	115	108.1 Å²	108.1	70%	0.697	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-15.4	176.8	176.2	0	0	0	0	112.2	A53	A53-V57 VanDerWaalsContact O-CB 3.31Å; A53-V57 WeakPolarHBondContact O-CB 3.37Å; A53-V57 WeakPolarHBondContact O-CG2 3.35Å; A53-V57 PolarHBondContact O-N 3.18Å
58	A	45	Very low	53	Low	81 Å²	81	107 Å²	107	67%	0.669	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-3.3	176	0	0	0	0	0	114.2	V55 G56	V55-A58 PolarHBondContact O-N 2.95Å; G56-A58 VanDerWaalsContact C-N 3.34Å
59	L	38.4	Very low	51.7	Low	137 Å²	137	109.2 Å²	109.2	72%	0.717	61%	0.614	S	S	*	*			trans	-119.3	11.9	-175.1	-71.2	170.1	0	0	0	114.6	V55 K61	V55-L59 HydrophobicContact CG1-CD1 4.19Å; L59-K61 PolarHBondContact O-N 3.48Å
60	E	35.7	Very low	50.4	Low	168 Å²	168	106.7 Å²	106.7	79%	0.785	61%	0.611	S	S	*	*			trans	-85.8	81.9	169.3	-87.5	-168.9	145.2	0	0	111.7
61	K	41.9	Very low	49.4	Very low	192 Å²	192	106.7 Å²	106.7	84%	0.835	61%	0.608	S	S	*	*	S	Bend	trans	-178.6	149	146.5	-99	161.1	-172.2	-178.6	0	110.1	L59 A63	L59-K61 PolarHBondContact O-N 3.48Å; K61-A63 PolarHBondContact O-N 3.46Å
62	P	40.3	Very low	48.9	Very low	117 Å²	117	106.1 Å²	106.1	76%	0.76	61%	0.606	S	S	*	*				-84	106.3	-129	32.1	-35.1	0	0	0	113.9	I64	P62-I64 VanDerWaalsContact C-N 3.31Å; P62-I64 PolarHBondContact O-N 3.34Å
63	A	42.5	Very low	48.4	Very low	64 Å²	64	101.2 Å²	101.2	53%	0.529	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	22.9	173.8	0	0	0	0	0	114.1	K61 G65 T66 M67	K61-A63 PolarHBondContact O-N 3.46Å; A63-G65 PolarHBondContact O-N 3.48Å; A63-T66 PolarHBondContact O-N 2.89Å; A63-M67 PolarHBondContact O-N 3.34Å
64	I	43.2	Very low	47.9	Very low	134 Å²	134	104.1 Å²	104.1	69%	0.687	61%	0.605	S	S	*	*	H	α-helix	trans	-65.8	-23.7	176.4	-67.4	171.8	0	0	0	111.1	P62 N68	P62-I64 VanDerWaalsContact C-N 3.31Å; P62-I64 PolarHBondContact O-N 3.34Å; I64-N68 PolarHBondContact O-ND2 3.33Å; I64-N68 VanDerWaalsContact O-ND2 3.13Å
65	G	43.6	Very low	47.6	Very low	54 Å²	54	101.8 Å²	101.8	56%	0.557	59%	0.59	S	S	*	*	H	α-helix	trans	-73.2	-34.3	175.2	0	0	0	0	0	114.3	A63	A63-G65 PolarHBondContact O-N 3.48Å
66	T	45.4	Very low	47.6	Very low	83 Å²	83	101.2 Å²	101.2	51%	0.509	58%	0.584	S	S	.	*	H	α-helix	trans	-83.3	-32.7	-172	-12.3	0	0	0	0	112.4	A63 Q69 L70	A63-T66 PolarHBondContact O-N 2.89Å; T66-Q69 PolarHBondContact O-N 2.93Å; T66-L70 PolarHBondContact O-N 3.34Å
67	M	40.3	Very low	48.2	Very low	125 Å²	125	101.6 Å²	101.6	62%	0.616	58%	0.584	S	S	*	*	H	α-helix	trans	-71.9	-31.2	179.5	-156.6	155.3	155.6	0	0	112.3	A63 Q69 L70 I71	A63-M67 PolarHBondContact O-N 3.34Å; M67-Q69 VanDerWaalsContact C-N 3.26Å; M67-Q69 PolarHBondContact O-N 2.95Å; M67-L70 PolarHBondContact O-N 2.94Å; M67-I71 WeakPolarHBondContact O-CG1 3.32Å; M67-I71 PolarHBondContact O-N 3.48Å
68	N	45.3	Very low	48.6	Very low	111 Å²	111	99.6 Å²	99.6	59%	0.594	57%	0.572	S	S	*	*	H	α-helix	trans	-70.2	-19.4	172.5	-74.9	-30.3	0	0	0	113.6	I64 P72	I64-N68 PolarHBondContact O-ND2 3.33Å; I64-N68 VanDerWaalsContact O-ND2 3.13Å; N68-P72 WeakPolarHBondContact O-CD 3.41Å; N68-P72 WeakPolarHBondContact O-CG 3.03Å
69	Q	51.4	Low	49.2	Very low	147 Å²	147	97.6 Å²	97.6	69%	0.687	55%	0.549	S	S	*	.	H	α-helix	trans	-92.6	-27.8	172.9	-69.7	-173.7	-11.2	0	0	112.6	T66 M67 P72 S73	T66-Q69 PolarHBondContact O-N 2.93Å; M67-Q69 VanDerWaalsContact C-N 3.26Å; M67-Q69 PolarHBondContact O-N 2.95Å; Q69-P72 WeakPolarHBondContact O-CD 3.42Å; Q69-S73 WeakPolarHBondContact O-CB 3.34Å; Q69-S73 PolarHBondContact O-N 3.12Å
70	L	49.4	Very low	50.2	Low	117 Å²	117	94 Å²	94	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-72.2	-38.5	-179.2	-137.6	100.4	0	0	0	112.6	T66 M67 S73 L74	T66-L70 PolarHBondContact O-N 3.34Å; M67-L70 PolarHBondContact O-N 2.94Å; L70-S73 PolarHBondContact O-N 2.88Å; L70-L74 WeakPolarHBondContact O-CB 3.34Å; L70-L74 PolarHBondContact O-N 2.89Å
71	I	51.4	Low	51.2	Low	85 Å²	85	91.4 Å²	91.4	44%	0.436	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-48.6	-177.7	-66.1	166.2	0	0	0	111.9	M67 S73 L74 A75	M67-I71 WeakPolarHBondContact O-CG1 3.32Å; M67-I71 PolarHBondContact O-N 3.48Å; I71-S73 VanDerWaalsContact C-N 3.31Å; I71-S73 PolarHBondContact O-N 3.49Å; I71-L74 PolarHBondContact O-N 2.76Å; I71-A75 VanDerWaalsContact O-CB 3.3Å; I71-A75 WeakPolarHBondContact O-CB 3.33Å; I71-A75 PolarHBondContact O-N 2.89Å
72	P	59.9	Low	51.5	Low	65 Å²	65	87.9 Å²	87.9	42%	0.422	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-36.4	174.1	-21.3	31.4	0	0	0	113.1	N68 Q69 A75 N76	N68-P72 WeakPolarHBondContact O-CD 3.41Å; N68-P72 WeakPolarHBondContact O-CG 3.03Å; Q69-P72 WeakPolarHBondContact O-CD 3.42Å; P72-A75 PolarHBondContact O-N 3.09Å; P72-N76 WeakPolarHBondContact O-CB 3.48Å; P72-N76 PolarHBondContact O-N 2.87Å
73	S	58.9	Low	52.8	Low	82 Å²	82	87.7 Å²	87.7	57%	0.573	51%	0.508	S	S	*	.	H	α-helix	trans	-70.5	-40.5	-178.5	-159.1	0	0	0	0	112.1	Q69 L70 I71 A77	Q69-S73 WeakPolarHBondContact O-CB 3.34Å; Q69-S73 PolarHBondContact O-N 3.12Å; L70-S73 PolarHBondContact O-N 2.88Å; I71-S73 VanDerWaalsContact C-N 3.31Å; I71-S73 PolarHBondContact O-N 3.49Å; S73-A77 WeakPolarHBondContact O-CB 3.5Å; S73-A77 PolarHBondContact O-N 2.96Å
74	L	57.7	Low	53.2	Low	117 Å²	117	90 Å²	90	61%	0.613	52%	0.518	S	S	*	.	H	α-helix	trans	-68.1	-42.2	173.5	-170.8	72	0	0	0	111.5	L70 I71 A77 V78	L70-L74 WeakPolarHBondContact O-CB 3.34Å; L70-L74 PolarHBondContact O-N 2.89Å; I71-L74 PolarHBondContact O-N 2.76Å; L74-A77 PolarHBondContact O-N 2.88Å; L74-V78 WeakPolarHBondContact O-CG2 3.1Å; L74-V78 PolarHBondContact O-N 3.27Å
75	A	56.9	Low	53.6	Low	22 Å²	22	92 Å²	92	18%	0.182	52%	0.524	C	S	.	.	H	α-helix	trans	-60.9	-45.5	175.1	0	0	0	0	0	111.3	I71 P72 V78 I79	I71-A75 VanDerWaalsContact O-CB 3.3Å; I71-A75 WeakPolarHBondContact O-CB 3.33Å; I71-A75 PolarHBondContact O-N 2.89Å; P72-A75 PolarHBondContact O-N 3.09Å; A75-V78 PolarHBondContact O-N 2.91Å; A75-I79 WeakPolarHBondContact O-CB 3.34Å; A75-I79 WeakPolarHBondContact O-CD1 3.48Å; A75-I79 WeakPolarHBondContact O-CG1 3.2Å; A75-I79 PolarHBondContact O-N 3.12Å
76	N	58.1	Low	53.6	Low	67 Å²	67	93.7 Å²	93.7	36%	0.358	52%	0.52	S	S	.	.	H	α-helix	trans	-60.5	-46.1	173.3	-89.8	5.4	0	0	0	111.7	P72 V78 I79 S80 L88	P72-N76 WeakPolarHBondContact O-CB 3.48Å; P72-N76 PolarHBondContact O-N 2.87Å; N76-V78 VanDerWaalsContact C-N 3.3Å; N76-V78 PolarHBondContact O-N 3.27Å; N76-I79 PolarHBondContact O-N 2.98Å; N76-S80 WeakPolarHBondContact O-CB 3.19Å; N76-S80 PolarHBondContact O-N 3.35Å; N76-S80 PolarHBondContact O-OG 3.27Å; N76-L88 WeakPolarHBondContact OD1-CD1 3.39Å
77	A	58.8	Low	53.7	Low	51 Å²	51	99.2 Å²	99.2	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-59.4	-40.8	178.6	0	0	0	0	0	112.3	S73 L74 T81	S73-A77 WeakPolarHBondContact O-CB 3.5Å; S73-A77 PolarHBondContact O-N 2.96Å; L74-A77 PolarHBondContact O-N 2.88Å; A77-T81 WeakPolarHBondContact O-CB 3.43Å; A77-T81 PolarHBondContact O-N 3.22Å; A77-T81 PolarHBondContact O-OG1 2.81Å
78	V	57.2	Low	54	Low	73 Å²	73	96.2 Å²	96.2	44%	0.442	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-44	175.9	172.7	0	0	0	0	111.2	L74 A75 N76 T81 L82	L74-V78 WeakPolarHBondContact O-CG2 3.1Å; L74-V78 PolarHBondContact O-N 3.27Å; A75-V78 PolarHBondContact O-N 2.91Å; N76-V78 VanDerWaalsContact C-N 3.3Å; N76-V78 PolarHBondContact O-N 3.27Å; V78-T81 PolarHBondContact O-N 3.14Å; V78-L82 HydrophobicContact CG1-CD1 3.63Å; V78-L82 HydrophobicContact CG1-CG 4.34Å; V78-L82 WeakPolarHBondContact O-CB 3.09Å; V78-L82 VanDerWaalsContact O-CG 3.28Å; V78-L82 WeakPolarHBondContact O-CG 3.45Å; V78-L82 PolarHBondContact O-N 2.94Å
79	I	56.9	Low	53.9	Low	39 Å²	39	96.6 Å²	96.6	20%	0.2	53%	0.532	C	S	.	.	H	α-helix	trans	-63.3	-45.6	177.6	-68.8	164.8	0	0	0	110.9	A75 N76 T81 L82 F83 L88	A75-I79 WeakPolarHBondContact O-CB 3.34Å; A75-I79 WeakPolarHBondContact O-CD1 3.48Å; A75-I79 WeakPolarHBondContact O-CG1 3.2Å; A75-I79 PolarHBondContact O-N 3.12Å; N76-I79 PolarHBondContact O-N 2.98Å; I79-T81 VanDerWaalsContact C-N 3.28Å; I79-T81 PolarHBondContact O-N 2.96Å; I79-L82 PolarHBondContact O-N 3.42Å; I79-F83 HydrophobicContact CG2-CD2 4.45Å; I79-F83 WeakPolarHBondContact O-CA 3.42Å; I79-F83 WeakPolarHBondContact O-CB 3.36Å; I79-F83 PolarHBondContact O-N 2.87Å; I79-L88 HydrophobicContact CG2-CD1 4.18Å
80	S	60.7	Low	53.9	Low	60 Å²	60	96.7 Å²	96.7	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-30.8	177.8	-53.9	0	0	0	0	112.7	N76 P84	N76-S80 WeakPolarHBondContact O-CB 3.19Å; N76-S80 PolarHBondContact O-N 3.35Å; N76-S80 PolarHBondContact O-OG 3.27Å; S80-P84 WeakPolarHBondContact O-CA 3.28Å
81	T	56.2	Low	53.6	Low	115 Å²	115	100 Å²	100	71%	0.706	55%	0.549	S	S	*	.	H	α-helix	trans	-76.2	-39.9	176.4	-54.7	0	0	0	0	111.7	A77 V78 I79	A77-T81 WeakPolarHBondContact O-CB 3.43Å; A77-T81 PolarHBondContact O-N 3.22Å; A77-T81 PolarHBondContact O-OG1 2.81Å; V78-T81 PolarHBondContact O-N 3.14Å; I79-T81 VanDerWaalsContact C-N 3.28Å; I79-T81 PolarHBondContact O-N 2.96Å
82	L	46.9	Very low	53.2	Low	117 Å²	117	104.5 Å²	104.5	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-80.7	-27.1	-179.4	-68.4	173	0	0	0	112.9	V78 I79	V78-L82 HydrophobicContact CG1-CD1 3.63Å; V78-L82 HydrophobicContact CG1-CG 4.34Å; V78-L82 WeakPolarHBondContact O-CB 3.09Å; V78-L82 VanDerWaalsContact O-CG 3.28Å; V78-L82 WeakPolarHBondContact O-CG 3.45Å; V78-L82 PolarHBondContact O-N 2.94Å; I79-L82 PolarHBondContact O-N 3.42Å
83	F	68.6	Low	52.4	Low	114 Å²	114	109 Å²	109	50%	0.5	59%	0.591	S	S	.	*			trans	-137.9	72	-175.9	-53	-78	0	0	0	111	I79 Q85 L86	I79-F83 HydrophobicContact CG2-CD2 4.45Å; I79-F83 WeakPolarHBondContact O-CA 3.42Å; I79-F83 WeakPolarHBondContact O-CB 3.36Å; I79-F83 PolarHBondContact O-N 2.87Å; F83-Q85 PolarHBondContact O-N 3.43Å; F83-L86 HydrophobicContact CB-CB 3.98Å; F83-L86 HydrophobicContact CB-CD1 3.55Å; F83-L86 HydrophobicContact CB-CG 4.32Å; F83-L86 HydrophobicContact CD1-CD1 4.29Å; F83-L86 HydrophobicContact CD2-CD1 4.34Å; F83-L86 HydrophobicContact CG-CD1 3.82Å; F83-L86 PolarHBondContact O-N 3.18Å
84	P	51.1	Low	51.5	Low	112 Å²	112	111 Å²	111	73%	0.727	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-11.9	-176.1	23.5	-33.5	0	0	0	114.1	S80	S80-P84 WeakPolarHBondContact O-CA 3.28Å
85	Q	50.3	Low	50.8	Low	176 Å²	176	114.1 Å²	114.1	82%	0.822	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-7.4	177.3	-56	-149.6	15.2	0	0	114.3	F83 K87	F83-Q85 PolarHBondContact O-N 3.43Å; Q85-K87 PolarHBondContact O-N 2.79Å
86	L	43.8	Very low	50.5	Low	90 Å²	90	118.9 Å²	118.9	47%	0.471	64%	0.64	S	S	.	*			trans	-83.5	91.3	176.3	-104.4	149.2	0	0	0	109.2	F83 L88	F83-L86 HydrophobicContact CB-CB 3.98Å; F83-L86 HydrophobicContact CB-CD1 3.55Å; F83-L86 HydrophobicContact CB-CG 4.32Å; F83-L86 HydrophobicContact CD1-CD1 4.29Å; F83-L86 HydrophobicContact CD2-CD1 4.34Å; F83-L86 HydrophobicContact CG-CD1 3.82Å; F83-L86 PolarHBondContact O-N 3.18Å; L86-L88 PolarHBondContact O-N 2.88Å
87	K	47.1	Very low	49.8	Very low	198 Å²	198	123.4 Å²	123.4	86%	0.861	66%	0.664	S	S	*	*			trans	-69.8	107.9	166.7	-78.2	-171.3	174.6	-170.7	0	109.1	Q85	Q85-K87 PolarHBondContact O-N 2.79Å
88	L	47.8	Very low	48.9	Very low	62 Å²	62	124.3 Å²	124.3	33%	0.325	68%	0.679	S	S	.	*			trans	-73.5	147.2	174.6	-78	152.2	0	0	0	110.5	N76 I79 L86 N90	N76-L88 WeakPolarHBondContact OD1-CD1 3.39Å; I79-L88 HydrophobicContact CG2-CD1 4.18Å; L86-L88 PolarHBondContact O-N 2.88Å; L88-N90 PolarHBondContact O-N 3.13Å
89	P	42.8	Very low	48.1	Very low	119 Å²	119	132.7 Å²	132.7	77%	0.773	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	20.8	-167.7	-16.9	31.6	0	0	0	117.3
90	N	52	Low	47.4	Very low	150 Å²	150	135 Å²	135	80%	0.802	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	6.3	-175	-73.5	-14.8	0	0	0	114.8	L88	L88-N90 PolarHBondContact O-N 3.13Å
91	E	43.2	Very low	46.4	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.864	75%	0.747	S	S	*	*			trans	-111.4	73.8	168	-78.2	-177.6	157.1	0	0	109.4
92	M	41.9	Very low	45.9	Very low	181 Å²	181	142.6 Å²	142.6	89%	0.892	75%	0.754	S	S	*	*			trans	-120.7	119.3	156.9	-77.2	-164	-167.2	0	0	107.9
93	D	44.6	Very low	45.4	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	76%	0.764	S	S	*	*			trans	-53.3	132.9	175.1	-74.1	-50.2	0	0	0	111.2	E95	D93-E95 PolarHBondContact O-N 3.1Å
94	P	38.6	Very low	44.1	Very low	124 Å²	124	150.3 Å²	150.3	81%	0.805	79%	0.785	S	S	*	*			trans	-91.4	95.7	174	34.3	-25.7	0	0	0	108.4
95	E	43	Very low	43.4	Very low	183 Å²	183	148.7 Å²	148.7	86%	0.855	79%	0.788	S	S	*	*			trans	-150.4	133.6	160.7	-133.3	173.3	-174.8	0	0	113.7	D93	D93-E95 PolarHBondContact O-N 3.1Å
96	V	50	Low	42.6	Very low	121 Å²	121	151.7 Å²	151.7	73%	0.733	79%	0.794	S	S	*	*			trans	92.7	84.6	163	-161	0	0	0	0	117.9
97	D	44.1	Very low	42.2	Very low	162 Å²	162	156.6 Å²	156.6	87%	0.866	81%	0.814	S	S	*	*				54.7	117.9	129	-69.5	-30.7	0	0	0	121.7
98	G	41.1	Very low	41.7	Very low	71 Å²	71	156.5 Å²	156.5	73%	0.732	82%	0.817	S	S	*	*				121.7	100.5	117	0	0	0	0	0	118.2
99	R	39.5	Very low	41.2	Very low	248 Å²	248	157.9 Å²	157.9	94%	0.936	84%	0.837	S	S	*	*			trans	88.1	116.3	146.9	-69.5	-176.8	174.1	172.5	-0.4	120.6
100	A	41.4	Very low	40.9	Very low	89 Å²	89	160.7 Å²	160.7	74%	0.736	85%	0.845	S	S	*	*			trans	64.8	99.9	135.2	0	0	0	0	0	117.3
101	Q	40	Very low	40.3	Very low	177 Å²	177	160.3 Å²	160.3	83%	0.827	85%	0.848	S	S	*	*				63.6	98.8	93.8	-132.8	174.6	-1	0	0	111.7
102	D	45.4	Very low	40.2	Very low	157 Å²	157	163.1 Å²	163.1	84%	0.84	85%	0.851	S	S	*	*				-174.4	130.7	116.4	-80.4	-21	0	0	0	111.8
103	N	38	Very low	40.1	Very low	153 Å²	153	164.4 Å²	164.4	82%	0.818	86%	0.855	S	S	*	*			trans	-72.4	160.7	173.6	-92.9	-35.8	0	0	0	110.9
104	Y	40.4	Very low	39.6	Very low	240 Å²	240	160.4 Å²	160.4	94%	0.941	85%	0.851	S	S	*	*			trans	97.9	107.4	175.7	-68.5	-85.1	0	0	0	115.8
105	G	36.4	Very low	39.6	Very low	78 Å²	78	160.8 Å²	160.8	80%	0.804	85%	0.851	S	S	*	*			trans	171.9	36	168.7	0	0	0	0	0	118
106	Y	32.6	Very low	39.3	Very low	238 Å²	238	157.3 Å²	157.3	93%	0.933	84%	0.844	S	S	*	*	S	Bend	trans	-103.5	50.2	174.5	-136.5	-85.2	0	0	0	111.5
107	Q	37.3	Very low	38.7	Very low	194 Å²	194	161.6 Å²	161.6	91%	0.907	85%	0.853	S	S	*	*	S	Bend	trans	-166.7	22.9	171.8	-124	169.3	3.6	0	0	117.5
108	Q	36.3	Very low	38.5	Very low	195 Å²	195	158.3 Å²	158.3	91%	0.911	85%	0.849	S	S	*	*			trans	-148.6	48.3	-172.7	-136.8	174	29.6	0	0	117.1
109	A	35.8	Very low	38.2	Very low	92 Å²	92	163.9 Å²	163.9	76%	0.76	86%	0.855	S	S	*	*	S	Bend	trans	-151.2	94.2	164.7	0	0	0	0	0	110.8
110	L	38.4	Very low	38	Very low	178 Å²	178	160.9 Å²	160.9	93%	0.932	85%	0.852	S	S	*	*	S	Bend	trans	-180	15.9	147.5	-95.6	161.4	0	0	0	114.3
111	T	38.1	Very low	37.5	Very low	142 Å²	142	160.9 Å²	160.9	87%	0.871	85%	0.852	S	S	*	*			trans	-111.1	80.3	167.1	24.2	0	0	0	0	111.1
112	R	41	Very low	37.5	Very low	243 Å²	243	161.1 Å²	161.1	92%	0.917	85%	0.853	S	S	*	*			trans	-152	85.7	161.3	-77.1	-161.6	176.8	-179.7	-0.3	110.9
113	Q	40.1	Very low	36.8	Very low	208 Å²	208	158.6 Å²	158.6	97%	0.972	85%	0.848	S	S	*	*			trans	165.9	103.6	155.9	-94.9	173.7	21.1	0	0	104.8
114	G	33.5	Very low	36.9	Very low	75 Å²	75	161 Å²	161	77%	0.773	85%	0.851	S	S	*	*			cis	118	65.1	16.7	0	0	0	0	0	110.9
115	V	39.6	Very low	36.7	Very low	132 Å²	132	153 Å²	153	80%	0.8	84%	0.842	S	S	*	*			trans	-155.5	125.7	152.9	-164	0	0	0	0	109.6
116	P	36.1	Very low	36.6	Very low	111 Å²	111	160.1 Å²	160.1	72%	0.721	85%	0.846	S	S	*	*			trans	-105.5	142.7	172	35.8	-25.5	0	0	0	111.6
117	F	37.7	Very low	37.3	Very low	210 Å²	210	153.6 Å²	153.6	92%	0.921	83%	0.833	S	S	*	*			trans	-143.6	142.7	151.9	-94.1	-76	0	0	0	111.1
118	A	39.2	Very low	37.4	Very low	93 Å²	93	152 Å²	152	77%	0.769	83%	0.83	S	S	*	*			trans	-87.7	163.6	-155.5	0	0	0	0	0	115.2
119	H	35.1	Very low	37.4	Very low	188 Å²	188	147.9 Å²	147.9	87%	0.87	82%	0.822	S	S	*	*			trans	-46.2	143.1	168	-65.1	-81.5	0	0	0	115
120	Q	35.6	Very low	37.6	Very low	186 Å²	186	148.8 Å²	148.8	87%	0.869	82%	0.823	S	S	*	*				-163.2	126.4	118.5	-139.8	164.4	1.7	0	0	111.9
121	A	31.4	Very low	37.9	Very low	89 Å²	89	144.2 Å²	144.2	74%	0.736	82%	0.819	S	S	*	*			trans	-82.6	142.3	167	0	0	0	0	0	109.9
122	Q	39.3	Very low	37.9	Very low	182 Å²	182	144.7 Å²	144.7	85%	0.85	82%	0.816	S	S	*	*			trans	-168.3	130.7	140.4	-105.8	167.2	25.2	0	0	111.5
123	S	31.1	Very low	38	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	82%	0.818	S	S	*	*			trans	-78	144.5	172.7	161.3	0	0	0	0	110.9
124	F	39.6	Very low	38.1	Very low	203 Å²	203	140.2 Å²	140.2	89%	0.89	81%	0.807	S	S	*	*			trans	-165.1	125.9	144.1	-95	-71.3	0	0	0	111.7
125	G	36.3	Very low	38.4	Very low	73 Å²	73	144.5 Å²	144.5	75%	0.753	81%	0.806	S	S	*	*				75	105.3	126.6	0	0	0	0	0	122.1
126	Y	33.9	Very low	38.4	Very low	227 Å²	227	143.3 Å²	143.3	89%	0.89	80%	0.804	S	S	*	*			trans	-60.2	-169.4	152.3	-81.1	-80.8	0	0	0	114.1
127	P	47.9	Very low	38.5	Very low	100 Å²	100	146.5 Å²	146.5	65%	0.649	81%	0.81	S	S	*	*			cis	-135.5	179.9	-41.7	28.3	-7.2	0	0	0	113.5
128	L	40	Very low	38.6	Very low	161 Å²	161	147.2 Å²	147.2	84%	0.843	81%	0.806	S	S	*	*				140.7	145.4	129.4	-76.6	169.9	0	0	0	116.7
129	S	36.7	Very low	38.7	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	81%	0.807	S	S	*	*			trans	76.2	148.9	154.5	-105	0	0	0	0	119.5
130	S	39.3	Very low	38.7	Very low	112 Å²	112	145.3 Å²	145.3	78%	0.783	80%	0.803	S	S	*	*			cis	171.8	136.6	-21	-86.6	0	0	0	0	103.5
131	G	43.6	Very low	38.9	Very low	82 Å²	82	142.5 Å²	142.5	85%	0.845	80%	0.801	S	S	*	*			trans	-171.7	90.6	175.1	0	0	0	0	0	113.4
132	D	39.2	Very low	38.9	Very low	151 Å²	151	143.8 Å²	143.8	81%	0.807	80%	0.804	S	S	*	*			trans	-68.5	149.1	175.9	-69.2	-53.5	0	0	0	113.7
133	F	43.9	Very low	39	Very low	217 Å²	217	140 Å²	140	95%	0.952	81%	0.805	S	S	*	*			trans	-145.8	111.5	146.9	-118.2	-86.7	0	0	0	112.1
134	L	40.6	Very low	39.4	Very low	140 Å²	140	143.7 Å²	143.7	73%	0.733	81%	0.81	S	S	*	*			trans	-49.1	162.4	164.4	-74	170.4	0	0	0	112.8
135	Q	40.6	Very low	39.3	Very low	165 Å²	165	138.9 Å²	138.9	77%	0.771	80%	0.797	S	S	*	*			cis	171.4	168.4	15.4	160.8	175.5	42.9	0	0	110.4
136	S	40.4	Very low	39.4	Very low	107 Å²	107	144.4 Å²	144.4	75%	0.748	80%	0.801	S	S	*	*			trans	99.8	102.7	167.5	77.5	0	0	0	0	115.9
137	Q	37.4	Very low	39.5	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	79%	0.794	S	S	*	*				59.6	112.2	61.7	-75.4	-160.7	-1.6	0	0	116.3
138	R	40.1	Very low	39.1	Very low	225 Å²	225	147.2 Å²	147.2	85%	0.849	81%	0.808	S	S	*	*				168.4	108.4	121.1	-97	179.3	-176	-178.2	2	111.8
139	T	40.8	Very low	38.8	Very low	128 Å²	128	146.9 Å²	146.9	79%	0.785	81%	0.806	S	S	*	*				74.5	113.3	104.3	54.7	0	0	0	0	117.1
140	S	34.9	Very low	39.1	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	81%	0.805	S	S	*	*			trans	-66.9	165.9	157.2	-22.2	0	0	0	0	111.5
141	P	39.6	Very low	39.1	Very low	127 Å²	127	149.8 Å²	149.8	83%	0.825	81%	0.805	S	S	*	*				-153.8	-179.2	84.4	37.9	-15.8	0	0	0	117.3
142	S	32.5	Very low	38.7	Very low	115 Å²	115	152.3 Å²	152.3	80%	0.804	80%	0.804	S	S	*	*			trans	-57.9	154.3	-175.3	51.6	0	0	0	0	119.6
143	A	40.9	Very low	38.4	Very low	104 Å²	104	148.6 Å²	148.6	86%	0.86	80%	0.801	S	S	*	*			trans	-146.9	139.2	150.5	0	0	0	0	0	110.6
144	Q	39.4	Very low	37.8	Very low	180 Å²	180	147.3 Å²	147.3	84%	0.841	80%	0.798	S	S	*	*			trans	-94.1	178.7	-173.1	-67	168.7	-28.7	0	0	112.5
145	V	37.9	Very low	37.5	Very low	103 Å²	103	148.7 Å²	148.7	62%	0.624	81%	0.805	S	S	*	*			trans	83.8	111.3	147	-131.6	0	0	0	0	119
146	F	38.6	Very low	37.1	Very low	188 Å²	188	147.1 Å²	147.1	83%	0.825	81%	0.807	S	S	*	*				170.3	139.6	90.9	-111.1	-71.7	0	0	0	112.5
147	D	36.4	Very low	37	Very low	140 Å²	140	147.6 Å²	147.6	75%	0.749	81%	0.808	S	S	*	*			trans	-57.9	154.5	174.4	-62.5	-65.6	0	0	0	115.7
148	R	38.9	Very low	36.7	Very low	247 Å²	247	143.9 Å²	143.9	93%	0.932	80%	0.801	S	S	*	*				173.5	123.8	120.4	-94.4	172.8	-176.4	-164.2	1.6	113.6
149	L	33.4	Very low	36.6	Very low	153 Å²	153	141.2 Å²	141.2	80%	0.801	80%	0.798	S	S	*	*			trans	-74.3	157.4	151.6	-107.5	101.9	0	0	0	110
150	P	42.9	Very low	36.2	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	80%	0.799	S	S	*	*				-143.2	142.5	93	29.6	-9.4	0	0	0	113.6
151	E	39.6	Very low	36.3	Very low	165 Å²	165	142.5 Å²	142.5	77%	0.771	80%	0.801	S	S	*	*				56.5	115.2	93.3	-93	-160.7	143.3	0	0	118.1
152	V	34	Very low	36	Very low	135 Å²	135	148 Å²	148	82%	0.818	81%	0.805	S	S	*	*			trans	55.9	118.7	138.9	-168.9	0	0	0	0	120.1
153	G	34	Very low	36.2	Very low	74 Å²	74	151.6 Å²	151.6	76%	0.763	81%	0.807	S	S	*	*			trans	-166.5	96.1	157.6	0	0	0	0	0	111.7
154	Q	30.9	Very low	35.9	Very low	190 Å²	190	156.8 Å²	156.8	89%	0.888	80%	0.804	S	S	*	*			trans	-59.4	135.8	162.4	-75.7	171.2	-19	0	0	109.8
155	L	35.4	Very low	35.6	Very low	168 Å²	168	157 Å²	157	88%	0.88	81%	0.805	S	S	*	*			trans	-155.9	105.7	154.5	-100.7	160.1	0	0	0	109
156	V	32.1	Very low	35.4	Very low	132 Å²	132	160.1 Å²	160.1	80%	0.8	82%	0.815	S	S	*	*			trans	-75	141	157	172.6	0	0	0	0	107.3
157	P	38.2	Very low	35	Very low	118 Å²	118	158.5 Å²	158.5	77%	0.766	82%	0.815	S	S	*	*			trans	-130.3	124.5	132.9	12.8	7.5	0	0	0	111.3
158	S	30.9	Very low	35	Very low	100 Å²	100	159.4 Å²	159.4	70%	0.699	82%	0.819	S	S	*	*			trans	-66	137.7	150.8	63.2	0	0	0	0	108.7
159	E	36.5	Very low	34.7	Very low	169 Å²	169	151 Å²	151	79%	0.79	81%	0.809	S	S	*	*			trans	-175	118.9	133.5	-105.8	175.6	-178.9	0	0	111.8
160	N	34.1	Very low	34.8	Very low	151 Å²	151	151.3 Å²	151.3	81%	0.807	81%	0.81	S	S	*	*			trans	33	105.5	134.1	-69.5	-33.4	0	0	0	118.3
161	S	36.2	Very low	34.5	Very low	117 Å²	117	151 Å²	151	82%	0.818	81%	0.808	S	S	*	*			trans	-137.7	93.4	152.3	-67.9	0	0	0	0	109.8	F163	S161-F163 PolarHBondContact O-N 3.29Å
162	R	34.2	Very low	34.3	Very low	242 Å²	242	149.1 Å²	149.1	91%	0.913	81%	0.813	S	S	*	*			trans	-56.9	121.7	164.4	-72.1	174.9	176.3	172	-1.5	109.1
163	F	36.4	Very low	34.3	Very low	192 Å²	192	146 Å²	146	84%	0.842	80%	0.802	S	S	*	*			trans	-134.8	98.8	153.2	-102.5	-84.6	0	0	0	110.9	S161	S161-F163 PolarHBondContact O-N 3.29Å
164	R	33.7	Very low	34.3	Very low	213 Å²	213	150.2 Å²	150.2	80%	0.804	80%	0.799	S	S	*	*			trans	36.1	106.8	147.1	-65.3	-173.1	179.5	-171.5	0	118.3	M166	R164-M166 PolarHBondContact O-N 3.31Å
165	Q	33.4	Very low	34.7	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	80%	0.799	S	S	*	*			trans	-45.7	119.7	140.2	-76.1	170.5	-26.8	0	0	110
166	M	33.7	Very low	35	Very low	168 Å²	168	146.9 Å²	146.9	83%	0.828	80%	0.795	S	S	*	*			trans	-105.7	101	153.5	-83.3	-171.9	-84.4	0	0	107.5	R164 L168	R164-M166 PolarHBondContact O-N 3.31Å; M166-L168 PolarHBondContact O-N 2.73Å
167	N	31	Very low	34.8	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	80%	0.799	S	S	*	*			trans	-60.3	106.7	160	-86.1	-32.4	0	0	0	108
168	L	35.9	Very low	34.7	Very low	159 Å²	159	147.5 Å²	147.5	83%	0.832	80%	0.802	S	S	*	*			trans	-100.2	95.6	159.3	-84.7	159.1	0	0	0	106.9	M166 I170	M166-L168 PolarHBondContact O-N 2.73Å; L168-I170 PolarHBondContact O-N 3.36Å
169	G	32.1	Very low	35	Very low	71 Å²	71	148.4 Å²	148.4	73%	0.732	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-59.9	119.8	170.3	0	0	0	0	0	109.4	P171	G169-P171 WeakPolarHBondContact O-CD 3.42Å
170	I	35.4	Very low	35.2	Very low	158 Å²	158	144.5 Å²	144.5	81%	0.81	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-71.3	123	169	-60.7	174.2	0	0	0	106.9	L168 S172	L168-I170 PolarHBondContact O-N 3.36Å; I170-S172 PolarHBondContact O-N 2.9Å
171	P	36.2	Very low	36	Very low	109 Å²	109	143.3 Å²	143.3	71%	0.708	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-65.1	120.6	171.4	-15	28.8	0	0	0	109.5	G169 A173	G169-P171 WeakPolarHBondContact O-CD 3.42Å; P171-A173 PolarHBondContact O-N 3.43Å
172	S	35.1	Very low	37.3	Very low	127 Å²	127	142.1 Å²	142.1	89%	0.888	77%	0.769	S	S	*	*			trans	-64.3	84.1	163.2	49.5	0	0	0	0	109.5	I170	I170-S172 PolarHBondContact O-N 2.9Å
173	A	35.8	Very low	38.2	Very low	70 Å²	70	132.4 Å²	132.4	58%	0.579	74%	0.741	S	S	*	*			trans	-156	61.2	175.2	0	0	0	0	0	111.5	P171	P171-A173 PolarHBondContact O-N 3.43Å
174	F	33.2	Very low	38.9	Very low	162 Å²	162	129.8 Å²	129.8	71%	0.711	73%	0.731	S	S	*	*			trans	-143.4	62.1	158.9	-87.4	-74.5	0	0	0	109.3	M179	F174-M179 HydrophobicContact CE1-CE 3.9Å; F174-M179 HydrophobicContact CE1-CG 3.65Å; F174-M179 HydrophobicContact CE2-CE 4.01Å; F174-M179 HydrophobicContact CZ-CE 3.32Å; F174-M179 HydrophobicContact CZ-CG 3.88Å; F174-M179 HydrophobicContact CZ-SD 4.45Å
175	Q	38.2	Very low	40	Very low	190 Å²	190	122.3 Å²	122.3	89%	0.888	71%	0.711	S	S	*	*			trans	-107.8	131.9	152.3	-77.7	179	-4.9	0	0	105.7
176	A	41.7	Very low	41.5	Very low	97 Å²	97	120 Å²	120	80%	0.802	70%	0.698	S	S	*	*	S	Bend	trans	84.9	68.3	-176	0	0	0	0	0	117.2	Q178	A176-Q178 VanDerWaalsContact C-N 3.34Å; A176-Q178 PolarHBondContact O-N 3.47Å
177	G	29.5	Very low	42.7	Very low	84 Å²	84	118.3 Å²	118.3	87%	0.866	69%	0.686	S	S	*	*	S	Bend		57.9	5	118.4	0	0	0	0	0	123.4
178	Q	36.5	Very low	43.8	Very low	179 Å²	179	113.6 Å²	113.6	84%	0.836	67%	0.669	S	S	*	*			trans	-144.6	108.4	173.7	-72.8	-175.9	-16	0	0	111.4	A176	A176-Q178 VanDerWaalsContact C-N 3.34Å; A176-Q178 PolarHBondContact O-N 3.47Å
179	M	36.2	Very low	45.1	Very low	120 Å²	120	111.5 Å²	111.5	59%	0.591	66%	0.655	S	S	*	*			trans	-83.9	127.2	168.8	-108.6	-154.9	-177.6	0	0	110.1	F174 A183	F174-M179 HydrophobicContact CE1-CE 3.9Å; F174-M179 HydrophobicContact CE1-CG 3.65Å; F174-M179 HydrophobicContact CE2-CE 4.01Å; F174-M179 HydrophobicContact CZ-CE 3.32Å; F174-M179 HydrophobicContact CZ-CG 3.88Å; F174-M179 HydrophobicContact CZ-SD 4.45Å; M179-A183 HydrophobicContact SD-CB 4.49Å
180	P	41	Very low	46.5	Very low	87 Å²	87	110.6 Å²	110.6	57%	0.565	64%	0.638	S	S	*	*			trans	-70.3	134.6	171.2	-9	23.9	0	0	0	110	N182 A183	P180-N182 PolarHBondContact O-N 3.27Å; P180-A183 WeakPolarHBondContact O-CB 3.45Å; P180-A183 PolarHBondContact O-N 2.78Å
181	T	49.9	Very low	47.4	Very low	125 Å²	125	107.3 Å²	107.3	77%	0.767	62%	0.621	S	S	*	*	H	α-helix	trans	-49.1	-23.5	174.1	42	0	0	0	0	114.2	A183 S185	T181-A183 VanDerWaalsContact C-N 3.32Å; T181-A183 PolarHBondContact O-N 2.87Å; T181-S185 PolarHBondContact O-N 3.04Å
182	N	64.8	Low	48.6	Very low	92 Å²	92	106.9 Å²	106.9	49%	0.492	61%	0.605	S	S	.	*	H	α-helix	trans	-65.9	-30.8	176.1	-154.1	-24.2	0	0	0	112.7	P180 S185 K186	P180-N182 PolarHBondContact O-N 3.27Å; N182-S185 PolarHBondContact O-N 2.71Å; N182-S185 PolarHBondContact O-OG 3.35Å; N182-K186 WeakPolarHBondContact O-CG 3.19Å; N182-K186 PolarHBondContact O-N 2.94Å
183	A	52.7	Low	49.9	Very low	39 Å²	39	106.8 Å²	106.8	32%	0.322	59%	0.591	S	S	.	*	H	α-helix	trans	-69.4	-40.1	179.7	0	0	0	0	0	112.7	M179 P180 T181 K186 F187	M179-A183 HydrophobicContact SD-CB 4.49Å; P180-A183 WeakPolarHBondContact O-CB 3.45Å; P180-A183 PolarHBondContact O-N 2.78Å; T181-A183 VanDerWaalsContact C-N 3.32Å; T181-A183 PolarHBondContact O-N 2.87Å; A183-K186 PolarHBondContact O-N 3.39Å; A183-F187 WeakPolarHBondContact O-CB 3.34Å; A183-F187 PolarHBondContact O-N 2.95Å
184	Q	50.3	Low	51.1	Low	136 Å²	136	111.1 Å²	111.1	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-63.9	-42.8	173.9	-79.9	178.2	-15.7	0	0	111.5	K186 F187 A188	Q184-K186 VanDerWaalsContact C-N 3.35Å; Q184-K186 PolarHBondContact O-N 2.94Å; Q184-F187 PolarHBondContact O-N 2.68Å; Q184-A188 WeakPolarHBondContact O-CB 3.32Å; Q184-A188 PolarHBondContact O-N 3.34Å
185	S	56.9	Low	51.9	Low	56 Å²	56	106 Å²	106	39%	0.392	59%	0.593	S	S	.	*	H	α-helix	trans	-63.2	-40	177.6	77.9	0	0	0	0	112.5	T181 N182 A188 Q189	T181-S185 PolarHBondContact O-N 3.04Å; N182-S185 PolarHBondContact O-N 2.71Å; N182-S185 PolarHBondContact O-OG 3.35Å; S185-A188 PolarHBondContact O-N 2.95Å; S185-Q189 WeakPolarHBondContact O-CB 3.3Å; S185-Q189 PolarHBondContact O-N 3.31Å
186	K	65	Low	52.1	Low	135 Å²	135	100.3 Å²	100.3	59%	0.587	59%	0.585	S	S	*	*	H	α-helix	trans	-69.4	-36.5	175.9	-75.5	-176.1	179.2	-175.1	0	112.2	N182 A183 Q184 S190	N182-K186 WeakPolarHBondContact O-CG 3.19Å; N182-K186 PolarHBondContact O-N 2.94Å; A183-K186 PolarHBondContact O-N 3.39Å; Q184-K186 VanDerWaalsContact C-N 3.35Å; Q184-K186 PolarHBondContact O-N 2.94Å; K186-S190 WeakPolarHBondContact O-CB 3.39Å; K186-S190 PolarHBondContact O-N 2.91Å
187	F	59.2	Low	52.2	Low	133 Å²	133	101.1 Å²	101.1	58%	0.583	57%	0.567	S	S	*	*	H	α-helix	trans	-65.4	-46.8	174.4	-176	-111	0	0	0	111.2	A183 Q184 Q189 S190 L191	A183-F187 WeakPolarHBondContact O-CB 3.34Å; A183-F187 PolarHBondContact O-N 2.95Å; Q184-F187 PolarHBondContact O-N 2.68Å; F187-Q189 PolarHBondContact O-N 3.19Å; F187-S190 PolarHBondContact O-N 2.8Å; F187-S190 VanDerWaalsContact O-N 3.12Å; F187-S190 PolarHBondContact O-OG 2.97Å; F187-L191 HydrophobicContact CD1-CD1 3.91Å; F187-L191 HydrophobicContact CE1-CD1 3.46Å; F187-L191 VanDerWaalsContact CE1-CD1 3.46Å; F187-L191 HydrophobicContact CE1-CG 4.35Å; F187-L191 HydrophobicContact CZ-CD1 3.82Å; F187-L191 HydrophobicContact CZ-CG 4.31Å; F187-L191 PolarHBondContact O-N 2.93Å
188	A	54.6	Low	53	Low	57 Å²	57	103.3 Å²	103.3	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-61	-43	175	0	0	0	0	0	112.3	Q184 S185 S190 L191 W192	Q184-A188 WeakPolarHBondContact O-CB 3.32Å; Q184-A188 PolarHBondContact O-N 3.34Å; S185-A188 PolarHBondContact O-N 2.95Å; A188-S190 VanDerWaalsContact C-N 3.34Å; A188-S190 PolarHBondContact O-N 3.35Å; A188-L191 PolarHBondContact O-N 3.39Å; A188-W192 WeakPolarHBondContact O-CB 3.43Å; A188-W192 PolarHBondContact O-N 2.64Å
189	Q	62.9	Low	53.7	Low	115 Å²	115	97 Å²	97	54%	0.537	55%	0.552	S	S	.	*	H	α-helix	trans	-63	-37.8	172.3	-87.1	-178.7	-12	0	0	112.6	S185 F187 W192 H193	S185-Q189 WeakPolarHBondContact O-CB 3.3Å; S185-Q189 PolarHBondContact O-N 3.31Å; F187-Q189 PolarHBondContact O-N 3.19Å; Q189-W192 PolarHBondContact O-N 3.05Å; Q189-H193 PolarHBondContact O-CD2 3.29Å; Q189-H193 PolarHBondContact O-N 2.89Å
190	S	61.9	Low	54.1	Low	52 Å²	52	99 Å²	99	36%	0.364	56%	0.564	S	S	.	*	H	α-helix	trans	-65.6	-39.1	176.8	82.8	0	0	0	0	111.9	K186 F187 A188 H193 Q194	K186-S190 WeakPolarHBondContact O-CB 3.39Å; K186-S190 PolarHBondContact O-N 2.91Å; F187-S190 PolarHBondContact O-N 2.8Å; F187-S190 VanDerWaalsContact O-N 3.12Å; F187-S190 PolarHBondContact O-OG 2.97Å; A188-S190 VanDerWaalsContact C-N 3.34Å; A188-S190 PolarHBondContact O-N 3.35Å; S190-H193 PolarHBondContact O-N 3.34Å; S190-Q194 WeakPolarHBondContact O-CB 3.49Å; S190-Q194 PolarHBondContact O-N 2.91Å
191	L	53.3	Low	54	Low	88 Å²	88	99.6 Å²	99.6	46%	0.461	57%	0.568	S	S	.	*	H	α-helix	trans	-67.7	-40.7	174	-76.5	170.1	0	0	0	111.4	F187 A188 H193 Q194 G195	F187-L191 HydrophobicContact CD1-CD1 3.91Å; F187-L191 HydrophobicContact CE1-CD1 3.46Å; F187-L191 VanDerWaalsContact CE1-CD1 3.46Å; F187-L191 HydrophobicContact CE1-CG 4.35Å; F187-L191 HydrophobicContact CZ-CD1 3.82Å; F187-L191 HydrophobicContact CZ-CG 4.31Å; F187-L191 PolarHBondContact O-N 2.93Å; A188-L191 PolarHBondContact O-N 3.39Å; L191-H193 VanDerWaalsContact C-N 3.35Å; L191-H193 PolarHBondContact O-N 2.97Å; L191-Q194 PolarHBondContact O-N 3.32Å; L191-G195 PolarHBondContact O-N 2.9Å
192	W	60.9	Low	53.6	Low	100 Å²	100	100.2 Å²	100.2	38%	0.379	57%	0.572	S	S	.	*	H	α-helix	trans	-60.6	-42.7	175.8	-166.5	-96.1	0	0	0	112.1	A188 Q189 G195 G199	A188-W192 WeakPolarHBondContact O-CB 3.43Å; A188-W192 PolarHBondContact O-N 2.64Å; Q189-W192 PolarHBondContact O-N 3.05Å; W192-G195 PolarHBondContact O-N 3.2Å; W192-G199 PolarHBondContact NE1-O 3.43Å
193	H	64.1	Low	52.2	Low	125 Å²	125	101.3 Å²	101.3	58%	0.579	58%	0.584	S	S	*	*	H	α-helix	trans	-75.5	-29.4	177.3	-73.1	-53.2	0	0	0	113.8	Q189 S190 L191 G195 G196	Q189-H193 PolarHBondContact O-CD2 3.29Å; Q189-H193 PolarHBondContact O-N 2.89Å; S190-H193 PolarHBondContact O-N 3.34Å; L191-H193 VanDerWaalsContact C-N 3.35Å; L191-H193 PolarHBondContact O-N 2.97Å; H193-G195 PolarHBondContact O-N 3.34Å; H193-G196 PolarHBondContact O-N 2.85Å
194	Q	61.2	Low	51.4	Low	161 Å²	161	106.7 Å²	106.7	75%	0.752	61%	0.613	S	S	*	*	H	α-helix	trans	-64	-25.6	173	-88.8	-175.2	-12.3	0	0	112.9	S190 L191 G196	S190-Q194 WeakPolarHBondContact O-CB 3.49Å; S190-Q194 PolarHBondContact O-N 2.91Å; L191-Q194 PolarHBondContact O-N 3.32Å; Q194-G196 VanDerWaalsContact C-N 3.25Å; Q194-G196 PolarHBondContact O-N 3.5Å
195	G	49.3	Very low	50.4	Low	56 Å²	56	104.5 Å²	104.5	58%	0.577	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	8.9	176.4	0	0	0	0	0	115.9	L191 W192 H193 R197	L191-G195 PolarHBondContact O-N 2.9Å; W192-G195 PolarHBondContact O-N 3.2Å; H193-G195 PolarHBondContact O-N 3.34Å; G195-R197 PolarHBondContact O-N 2.96Å
196	G	41.5	Very low	49.3	Very low	70 Å²	70	110.7 Å²	110.7	72%	0.722	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.2	14.3	179.9	0	0	0	0	0	114.7	H193 Q194	H193-G196 PolarHBondContact O-N 2.85Å; Q194-G196 VanDerWaalsContact C-N 3.25Å; Q194-G196 PolarHBondContact O-N 3.5Å
197	R	43.7	Very low	47.6	Very low	114 Å²	114	112.7 Å²	112.7	43%	0.43	65%	0.65	S	S	.	*			trans	-89	125.8	-178.6	-63.5	-172.8	179.1	-150.4	1.6	110.9	G195	G195-R197 PolarHBondContact O-N 2.96Å
198	S	47.2	Very low	46.3	Very low	129 Å²	129	114.7 Å²	114.7	90%	0.902	66%	0.661	S	S	*	*			trans	-108.7	97.3	171.9	44.4	0	0	0	0	109.1
199	G	50.7	Low	45.4	Very low	47 Å²	47	119.5 Å²	119.5	49%	0.485	68%	0.679	S	S	.	*			trans	171.4	137.1	176.5	0	0	0	0	0	112	W192	W192-G199 PolarHBondContact NE1-O 3.43Å
200	L	46	Very low	44	Very low	162 Å²	162	120.7 Å²	120.7	85%	0.848	69%	0.688	S	S	*	*			trans	-81.8	133	169.8	-92.4	113.1	0	0	0	109.6
201	P	38.5	Very low	42.7	Very low	99 Å²	99	123.3 Å²	123.3	64%	0.643	70%	0.704	S	S	*	*			trans	-72.3	129.4	172.8	26.6	-30.4	0	0	0	111.7
202	T	40.7	Very low	41.9	Very low	139 Å²	139	125.5 Å²	125.5	85%	0.853	72%	0.724	S	S	*	*			trans	-107.7	131.2	171.3	25.4	0	0	0	0	111.2
203	P	36.1	Very low	40.8	Very low	115 Å²	115	124.4 Å²	124.4	75%	0.747	73%	0.732	S	S	*	*			trans	-105.2	111.2	178.2	33.9	-23.8	0	0	0	112.3
204	T	34.6	Very low	39.6	Very low	151 Å²	151	125 Å²	125	93%	0.926	74%	0.739	S	S	*	*			trans	163.7	125.2	143.9	35.1	0	0	0	0	111.9
205	A	30.7	Very low	38.4	Very low	91 Å²	91	125 Å²	125	75%	0.752	74%	0.737	S	S	*	*			trans	-150	135.1	156.1	0	0	0	0	0	110.6
206	Q	33.7	Very low	37.8	Very low	186 Å²	186	127.7 Å²	127.7	87%	0.869	75%	0.746	S	S	*	*			trans	-83.5	148.4	-168	-65.9	166	-27.3	0	0	113.2
207	F	29.5	Very low	37.7	Very low	177 Å²	177	133.4 Å²	133.4	78%	0.776	75%	0.746	S	S	*	*			trans	-104.9	27.7	-167.7	-86.4	-82.9	0	0	0	116.2	N209 L210	F207-N209 VanDerWaalsContact C-N 3.32Å; F207-N209 PolarHBondContact O-N 3Å; F207-L210 HydrophobicContact CD1-CD1 4.21Å; F207-L210 HydrophobicContact CE1-CD1 4.48Å
208	E	31.1	Very low	37	Very low	175 Å²	175	131.5 Å²	131.5	82%	0.818	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	11.1	-169.9	-71	-179.7	166	0	0	116.7
209	N	36.3	Very low	36.3	Very low	157 Å²	157	134.4 Å²	134.4	84%	0.84	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135	30.9	-171.2	-76.3	-45.2	0	0	0	116.8	F207	F207-N209 VanDerWaalsContact C-N 3.32Å; F207-N209 PolarHBondContact O-N 3Å
210	L	32.1	Very low	35.5	Very low	140 Å²	140	136.2 Å²	136.2	73%	0.733	76%	0.758	S	S	*	*			trans	-107.3	131.3	175.7	-68.3	173.3	0	0	0	113	F207	F207-L210 HydrophobicContact CD1-CD1 4.21Å; F207-L210 HydrophobicContact CE1-CD1 4.48Å
211	P	34.8	Very low	34.8	Very low	107 Å²	107	132.5 Å²	132.5	70%	0.695	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68	157	-175.7	27	-33.8	0	0	0	113.2	S213	P211-S213 PolarHBondContact O-N 2.82Å
212	P	37.9	Very low	34.5	Very low	135 Å²	135	134.8 Å²	134.8	88%	0.877	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.2	123.5	-173.2	25.4	-32.4	0	0	0	111.6
213	S	37.1	Very low	34.1	Very low	77 Å²	77	134.5 Å²	134.5	54%	0.538	74%	0.736	S	S	.	*	P	Polyproline II helix	trans	-80.8	147.9	178.9	41	0	0	0	0	113	P211 F215	P211-S213 PolarHBondContact O-N 2.82Å; S213-F215 PolarHBondContact O-N 3.04Å; S213-F215 WeakPolarHBondContact OG-CD2 3.43Å; S213-F215 WeakPolarHBondContact OG-CE2 3.41Å
214	D	39.3	Very low	33.7	Very low	138 Å²	138	134.2 Å²	134.2	74%	0.738	73%	0.733	S	S	*	*			trans	-62.5	46.3	176.6	-89.4	-37.9	0	0	0	114.8	S216	D214-S216 PolarHBondContact O-N 3.06Å
215	F	36	Very low	33.5	Very low	160 Å²	160	135.2 Å²	135.2	70%	0.702	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-68	-13.4	-179.9	-83.8	-67.7	0	0	0	114.4	S213 R217	S213-F215 PolarHBondContact O-N 3.04Å; S213-F215 WeakPolarHBondContact OG-CD2 3.43Å; S213-F215 WeakPolarHBondContact OG-CE2 3.41Å; F215-R217 VanDerWaalsContact C-N 3.27Å; F215-R217 PolarHBondContact O-N 2.89Å
216	S	36.6	Very low	33.5	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-76.9	-4.2	-176.3	50.3	0	0	0	0	114.9	D214	D214-S216 PolarHBondContact O-N 3.06Å
217	R	39.2	Very low	33.5	Very low	191 Å²	191	132.9 Å²	132.9	72%	0.721	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-109.3	4.5	-178.9	-69	-172.3	178.9	-167.8	1.4	116	F215 Y219	F215-R217 VanDerWaalsContact C-N 3.27Å; F215-R217 PolarHBondContact O-N 2.89Å; R217-Y219 VanDerWaalsContact C-N 3.32Å; R217-Y219 HydrophobicContact CB-CD2 3.81Å; R217-Y219 HydrophobicContact CB-CE2 3.98Å; R217-Y219 WeakPolarHBondContact O-CD2 3.45Å; R217-Y219 PolarHBondContact O-N 2.83Å
218	G	29.4	Very low	33.8	Very low	73 Å²	73	128.2 Å²	128.2	75%	0.753	70%	0.696	S	S	*	*			trans	70.4	18.6	170.9	0	0	0	0	0	116.3
219	Y	32.1	Very low	34.4	Very low	191 Å²	191	122.6 Å²	122.6	75%	0.749	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-93.4	129.5	173.9	-66	-79.8	0	0	0	110.9	R217	R217-Y219 VanDerWaalsContact C-N 3.32Å; R217-Y219 HydrophobicContact CB-CD2 3.81Å; R217-Y219 HydrophobicContact CB-CE2 3.98Å; R217-Y219 WeakPolarHBondContact O-CD2 3.45Å; R217-Y219 PolarHBondContact O-N 2.83Å
220	P	33.2	Very low	34.9	Very low	85 Å²	85	121.5 Å²	121.5	55%	0.552	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-68.7	145.3	166.6	27	-29.8	0	0	0	110.5
221	P	33	Very low	35.5	Very low	84 Å²	84	120.6 Å²	120.6	55%	0.545	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-67.1	132.2	-170	24.5	-32.5	0	0	0	113.3	F223	P221-F223 HydrophobicContact CB-CE2 4.05Å; P221-F223 HydrophobicContact CB-CZ 4.31Å; P221-F223 HydrophobicContact CG-CD2 4.5Å; P221-F223 HydrophobicContact CG-CE2 3.71Å; P221-F223 HydrophobicContact CG-CZ 4.16Å; P221-F223 PolarHBondContact O-N 3.32Å
222	L	30.5	Very low	35.9	Very low	146 Å²	146	122.3 Å²	122.3	76%	0.764	66%	0.658	S	S	*	*			trans	-69.3	112.8	167	-82.9	153.7	0	0	0	109.9
223	F	32.4	Very low	36.1	Very low	133 Å²	133	123.7 Å²	123.7	58%	0.583	66%	0.658	S	S	*	*			trans	-100	89.2	168.3	-69.9	-76	0	0	0	110.4	P221 L226	P221-F223 HydrophobicContact CB-CE2 4.05Å; P221-F223 HydrophobicContact CB-CZ 4.31Å; P221-F223 HydrophobicContact CG-CD2 4.5Å; P221-F223 HydrophobicContact CG-CE2 3.71Å; P221-F223 HydrophobicContact CG-CZ 4.16Å; P221-F223 PolarHBondContact O-N 3.32Å; F223-L226 HydrophobicContact CD1-CD1 4.02Å; F223-L226 HydrophobicContact CE1-CD1 4.38Å
224	T	28.3	Very low	36	Very low	109 Å²	109	124.4 Å²	124.4	67%	0.669	66%	0.655	S	S	*	*			trans	-88.6	136.6	145.5	44.6	0	0	0	0	106.2
225	H	30.3	Very low	35.9	Very low	172 Å²	172	125.4 Å²	125.4	80%	0.796	65%	0.653	S	S	*	*			trans	94.1	57.5	178.5	-51.4	-72.8	0	0	0	119.7
226	L	30.9	Very low	36.1	Very low	78 Å²	78	125.3 Å²	125.3	41%	0.408	65%	0.654	S	S	.	*			trans	-143.1	65.7	160.8	-69.6	173.9	0	0	0	113.1	F223 K231 L234	F223-L226 HydrophobicContact CD1-CD1 4.02Å; F223-L226 HydrophobicContact CE1-CD1 4.38Å; L226-K231 HydrophobicContact CD2-CB 4.34Å; L226-K231 HydrophobicContact CD2-CD 3.78Å; L226-L234 HydrophobicContact CD1-CD1 3.65Å; L226-L234 HydrophobicContact CD2-CD1 4.45Å
227	T	33.7	Very low	36.4	Very low	151 Å²	151	123.2 Å²	123.2	93%	0.926	63%	0.632	S	S	*	*			trans	-85.8	22.5	157	43.9	0	0	0	0	112	P229	T227-P229 WeakPolarHBondContact O-CD 3.4Å
228	N	36.3	Very low	36.6	Very low	78 Å²	78	116.2 Å²	116.2	42%	0.417	61%	0.612	S	S	.	*			trans	-100.8	106.6	178.7	-167.8	-19.1	0	0	0	110.6	D230 K231	N228-D230 PolarHBondContact O-N 2.89Å; N228-D230 VanDerWaalsContact O-N 3.13Å; N228-D230 PolarHBondContact OD1-N 3.49Å; N228-D230 VanDerWaalsContact OD1-N 3.12Å; N228-K231 PolarHBondContact O-N 3.42Å
229	P	43.7	Very low	37.3	Very low	57 Å²	57	119.2 Å²	119.2	37%	0.37	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.1	-5.6	-178	27.8	-34.3	0	0	0	114.6	T227 K231	T227-P229 WeakPolarHBondContact O-CD 3.4Å; P229-K231 VanDerWaalsContact C-N 3.33Å
230	D	46.4	Very low	38.1	Very low	135 Å²	135	114 Å²	114	72%	0.722	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	6.3	177.6	-61.9	-27.7	0	0	0	113.3	N228	N228-D230 PolarHBondContact O-N 2.89Å; N228-D230 VanDerWaalsContact O-N 3.13Å; N228-D230 PolarHBondContact OD1-N 3.49Å; N228-D230 VanDerWaalsContact OD1-N 3.12Å
231	K	45	Very low	38.7	Very low	121 Å²	121	111 Å²	111	53%	0.526	58%	0.581	S	S	.	*			trans	-119.1	37.9	-179.1	-65.3	-168	175.3	-173.6	0	113.8	L226 N228 P229 D233 L234	L226-K231 HydrophobicContact CD2-CB 4.34Å; L226-K231 HydrophobicContact CD2-CD 3.78Å; N228-K231 PolarHBondContact O-N 3.42Å; P229-K231 VanDerWaalsContact C-N 3.33Å; K231-D233 PolarHBondContact O-N 3.45Å; K231-D233 VanDerWaalsContact O-N 3.15Å; K231-L234 HydrophobicContact CB-CD1 4.4Å
232	Q	41.9	Very low	39.4	Very low	143 Å²	143	112.5 Å²	112.5	67%	0.668	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-68.4	-4	-176	-76.9	-177.9	-18.6	0	0	115.9	L234	Q232-L234 PolarHBondContact O-N 3.31Å
233	D	41.9	Very low	40.3	Very low	164 Å²	164	107.8 Å²	107.8	88%	0.877	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-89	12.7	178	-88.1	-22	0	0	0	115	K231	K231-D233 PolarHBondContact O-N 3.45Å; K231-D233 VanDerWaalsContact O-N 3.15Å
234	L	35	Very low	41.2	Very low	91 Å²	91	106.7 Å²	106.7	48%	0.476	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-92.5	6	179.9	-78.7	164.2	0	0	0	114.9	L226 K231 Q232 Q236	L226-L234 HydrophobicContact CD1-CD1 3.65Å; L226-L234 HydrophobicContact CD2-CD1 4.45Å; K231-L234 HydrophobicContact CB-CD1 4.4Å; Q232-L234 PolarHBondContact O-N 3.31Å; L234-Q236 PolarHBondContact O-N 2.75Å
235	F	38.2	Very low	42.2	Very low	159 Å²	159	112.4 Å²	112.4	70%	0.697	57%	0.569	S	S	*	*			trans	-79.8	58.3	170.2	-64.4	-76.8	0	0	0	111.8
236	Q	40.4	Very low	43.4	Very low	158 Å²	158	109.1 Å²	109.1	74%	0.738	56%	0.557	S	S	*	*			trans	-80.4	117.6	157.2	-78.2	-173.4	-0.5	0	0	107.9	L234	L234-Q236 PolarHBondContact O-N 2.75Å
237	Q	43.2	Very low	44.1	Very low	68 Å²	68	107.1 Å²	107.1	32%	0.318	55%	0.546	S	S	.	.			trans	-43.2	127.7	164	-155.3	179.5	37.4	0	0	107.6	N239 H242	Q237-N239 PolarHBondContact O-N 3.23Å; Q237-H242 PolarHBondContact OE1-CE1 3.37Å; Q237-H242 VanDerWaalsContact OE1-CE1 3.24Å; Q237-H242 PolarHBondContact OE1-ND1 3.05Å
238	P	43	Very low	44.6	Very low	45 Å²	45	103.2 Å²	103.2	29%	0.292	52%	0.524	S	S	.	.			trans	-57	125.8	-179.3	20.8	-30	0	0	0	108	S240 L241	P238-S240 PolarHBondContact O-N 2.77Å; P238-L241 HydrophobicContact CG-CD1 3.64Å; P238-L241 HydrophobicContact CG-CG 3.97Å; P238-L241 PolarHBondContact O-N 2.87Å
239	N	43.3	Very low	44.9	Very low	135 Å²	135	105.7 Å²	105.7	72%	0.722	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-51.6	-22.4	-177.5	-71.9	-28.5	0	0	0	112.4	Q237 L241 H242	Q237-N239 PolarHBondContact O-N 3.23Å; N239-L241 VanDerWaalsContact C-N 3.27Å; N239-L241 PolarHBondContact O-N 3.41Å; N239-H242 PolarHBondContact O-N 3.3Å
240	S	50	Low	44.7	Very low	81 Å²	81	105.4 Å²	105.4	57%	0.566	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-68.4	-13.9	174.6	61	0	0	0	0	115.6	P238	P238-S240 PolarHBondContact O-N 2.77Å
241	L	45.6	Very low	44.3	Very low	24 Å²	24	100.2 Å²	100.2	13%	0.126	51%	0.514	C	S	.	.	G	3₁₀ helix	trans	-98	-17.5	175.2	-68.8	177.7	0	0	0	112.7	P238 N239 G243 R244 L247	P238-L241 HydrophobicContact CG-CD1 3.64Å; P238-L241 HydrophobicContact CG-CG 3.97Å; P238-L241 PolarHBondContact O-N 2.87Å; N239-L241 VanDerWaalsContact C-N 3.27Å; N239-L241 PolarHBondContact O-N 3.41Å; L241-G243 PolarHBondContact O-N 2.9Å; L241-R244 PolarHBondContact O-N 2.91Å; L241-L247 HydrophobicContact CD2-CD1 4.04Å
242	H	46.8	Very low	44.3	Very low	114 Å²	114	96.1 Å²	96.1	53%	0.528	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	117.7	177.4	-126.1	67.9	0	0	0	109.5	Q237 N239	Q237-H242 PolarHBondContact OE1-CE1 3.37Å; Q237-H242 VanDerWaalsContact OE1-CE1 3.24Å; Q237-H242 PolarHBondContact OE1-ND1 3.05Å; N239-H242 PolarHBondContact O-N 3.3Å
243	G	50.1	Low	44.3	Very low	47 Å²	47	93.4 Å²	93.4	49%	0.485	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	5.6	178.6	0	0	0	0	0	116.6	L241 R245	L241-G243 PolarHBondContact O-N 2.9Å; G243-R245 PolarHBondContact O-N 3.33Å; G243-R245 VanDerWaalsContact O-N 3.08Å
244	R	50.3	Low	44.2	Very low	111 Å²	111	89 Å²	89	42%	0.419	46%	0.463	S	S	.	.			trans	-70.6	101.7	170.8	-84.3	-165.4	77.5	169.3	5	111	L241 D246 L247	L241-R244 PolarHBondContact O-N 2.91Å; R244-D246 VanDerWaalsContact C-N 3.26Å; R244-D246 VanDerWaalsContact CB-OD1 3.28Å; R244-D246 WeakPolarHBondContact CB-OD1 3.1Å; R244-D246 IonicContact CZ-OD1 3.34Å; R244-D246 IonicContact CZ-OD2 3.64Å; R244-D246 IonicContact NE-OD1 3.3Å; R244-D246 PolarHBondContact NE-OD1 3.49Å; R244-D246 IonicContact NE-OD2 2.9Å; R244-D246 PolarHBondContact NE-OD2 3.08Å; R244-D246 IonicContact NH2-OD1 2.62Å; R244-D246 IonicContact NH2-OD2 2.75Å; R244-D246 PolarHBondContact NH2-OD2 2.91Å; R244-L247 HydrophobicContact CB-CD1 4.1Å; R244-L247 HydrophobicContact CB-CG 4.22Å
245	R	50.8	Low	44.6	Very low	228 Å²	228	89.8 Å²	89.8	86%	0.86	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.2	176.8	-62.6	-175.3	-178.9	-176.4	-0.8	113.7	G243	G243-R245 PolarHBondContact O-N 3.33Å; G243-R245 VanDerWaalsContact O-N 3.08Å
246	D	55.1	Low	44.6	Very low	104 Å²	104	84 Å²	84	56%	0.556	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-4.1	-177.5	65.1	-43.3	0	0	0	113.3	R244	R244-D246 VanDerWaalsContact C-N 3.26Å; R244-D246 VanDerWaalsContact CB-OD1 3.28Å; R244-D246 WeakPolarHBondContact CB-OD1 3.1Å; R244-D246 IonicContact CZ-OD1 3.34Å; R244-D246 IonicContact CZ-OD2 3.64Å; R244-D246 IonicContact NE-OD1 3.3Å; R244-D246 PolarHBondContact NE-OD1 3.49Å; R244-D246 IonicContact NE-OD2 2.9Å; R244-D246 PolarHBondContact NE-OD2 3.08Å; R244-D246 IonicContact NH2-OD1 2.62Å; R244-D246 IonicContact NH2-OD2 2.75Å; R244-D246 PolarHBondContact NH2-OD2 2.91Å
247	L	45.3	Very low	44.4	Very low	35 Å²	35	83 Å²	83	18%	0.183	44%	0.44	C	S	.	.	S	Bend	trans	-89	133.5	172.9	-62.2	177.2	0	0	0	110	L241 R244 Y251	L241-L247 HydrophobicContact CD2-CD1 4.04Å; R244-L247 HydrophobicContact CB-CD1 4.1Å; R244-L247 HydrophobicContact CB-CG 4.22Å; L247-Y251 HydrophobicContact CB-CD2 4.46Å; L247-Y251 HydrophobicContact CB-CG 4.35Å; L247-Y251 HydrophobicContact CD1-CD1 4.16Å; L247-Y251 HydrophobicContact CD1-CD2 4.31Å; L247-Y251 HydrophobicContact CD1-CE1 4.25Å; L247-Y251 HydrophobicContact CD1-CE2 4.35Å; L247-Y251 HydrophobicContact CD1-CG 4.2Å; L247-Y251 HydrophobicContact CD2-CD2 3.88Å; L247-Y251 HydrophobicContact CD2-CE2 3.92Å; L247-Y251 HydrophobicContact CD2-CG 4.49Å; L247-Y251 HydrophobicContact CG-CD2 4.44Å
248	P	44	Very low	44	Very low	69 Å²	69	85.5 Å²	85.5	45%	0.448	47%	0.465	S	S	.	.			trans	-62.2	150.5	176	22.6	-29.3	0	0	0	110.8	S250 Y251	P248-S250 PolarHBondContact O-N 3.48Å; P248-Y251 WeakPolarHBondContact O-CB 3.49Å; P248-Y251 PolarHBondContact O-N 3.22Å
249	P	42.9	Very low	43.6	Very low	130 Å²	130	87.2 Å²	87.2	84%	0.844	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-21	-179.3	-26.6	34	0	0	0	115
250	S	40	Very low	43	Very low	51 Å²	51	83.3 Å²	83.3	36%	0.357	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	18.5	179.1	58.4	0	0	0	0	114	P248 V252	P248-S250 PolarHBondContact O-N 3.48Å; S250-V252 PolarHBondContact O-N 3.34Å; S250-V252 VanDerWaalsContact O-N 3.12Å
251	Y	37.6	Very low	42.2	Very low	27 Å²	27	86.8 Å²	86.8	11%	0.106	48%	0.483	C	S	.	.			trans	-67.1	109.9	177.2	-178.1	-91.4	0	0	0	110.8	L247 P248 Y253 V262 I584	L247-Y251 HydrophobicContact CB-CD2 4.46Å; L247-Y251 HydrophobicContact CB-CG 4.35Å; L247-Y251 HydrophobicContact CD1-CD1 4.16Å; L247-Y251 HydrophobicContact CD1-CD2 4.31Å; L247-Y251 HydrophobicContact CD1-CE1 4.25Å; L247-Y251 HydrophobicContact CD1-CE2 4.35Å; L247-Y251 HydrophobicContact CD1-CG 4.2Å; L247-Y251 HydrophobicContact CD2-CD2 3.88Å; L247-Y251 HydrophobicContact CD2-CE2 3.92Å; L247-Y251 HydrophobicContact CD2-CG 4.49Å; L247-Y251 HydrophobicContact CG-CD2 4.44Å; P248-Y251 WeakPolarHBondContact O-CB 3.49Å; P248-Y251 PolarHBondContact O-N 3.22Å; Y251-Y253 HydrophobicContact CE1-CD2 4.15Å; Y251-V262 HydrophobicContact CD1-CB 4.39Å; Y251-V262 HydrophobicContact CD1-CG2 4.34Å; Y251-I584 HydrophobicContact CD2-CG2 4.02Å; Y251-I584 HydrophobicContact CE2-CD1 4.16Å; Y251-I584 HydrophobicContact CE2-CG2 3.41Å; Y251-I584 VanDerWaalsContact CE2-CG2 3.41Å
252	V	45.1	Very low	41.7	Very low	34 Å²	34	87.1 Å²	87.1	21%	0.206	49%	0.486	C	S	.	.			trans	-101.9	119.3	169.8	-178.3	0	0	0	0	107.7	S250 P254 A587	S250-V252 PolarHBondContact O-N 3.34Å; S250-V252 VanDerWaalsContact O-N 3.12Å; V252-P254 WeakPolarHBondContact O-CD 3.33Å; V252-A587 HydrophobicContact CB-CB 3.87Å; V252-A587 HydrophobicContact CG1-CB 3.99Å; V252-A587 HydrophobicContact CG2-CB 4.26Å
253	Y	41.2	Very low	41.2	Very low	86 Å²	86	89.3 Å²	89.3	34%	0.337	50%	0.497	S	S	.	.			trans	-67.3	121.2	173.3	-168.8	-114.5	0	0	0	108.1	Y251 F255 A256	Y251-Y253 HydrophobicContact CE1-CD2 4.15Å; Y253-F255 HydrophobicContact CD1-CB 3.9Å; Y253-F255 HydrophobicContact CD1-CD2 4.1Å; Y253-F255 HydrophobicContact CE1-CB 3.71Å; Y253-F255 AromaticContact CE1-CD2 3.56Å; Y253-F255 HydrophobicContact CE1-CD2 3.56Å; Y253-F255 HydrophobicContact CE1-CG 4.11Å; Y253-F255 HydrophobicContact CE2-CD2 4.29Å; Y253-F255 AromaticContact CZ-CD2 3.65Å; Y253-F255 PolarHBondContact O-N 3.39Å; Y253-A256 WeakPolarHBondContact O-CB 2.94Å; Y253-A256 PolarHBondContact O-N 3.03Å
254	P	39.6	Very low	40.5	Very low	72 Å²	72	91.6 Å²	91.6	47%	0.468	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-8.2	-170.4	23.2	-32.4	0	0	0	114.3	V252	V252-P254 WeakPolarHBondContact O-CD 3.33Å
255	F	43.7	Very low	39.6	Very low	107 Å²	107	87.3 Å²	87.3	47%	0.469	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	8.9	177.2	-48	-75.6	0	0	0	113.3	Y253 K574	Y253-F255 HydrophobicContact CD1-CB 3.9Å; Y253-F255 HydrophobicContact CD1-CD2 4.1Å; Y253-F255 HydrophobicContact CE1-CB 3.71Å; Y253-F255 AromaticContact CE1-CD2 3.56Å; Y253-F255 HydrophobicContact CE1-CD2 3.56Å; Y253-F255 HydrophobicContact CE1-CG 4.11Å; Y253-F255 HydrophobicContact CE2-CD2 4.29Å; Y253-F255 AromaticContact CZ-CD2 3.65Å; Y253-F255 PolarHBondContact O-N 3.39Å; F255-K574 HydrophobicContact CE1-CB 4.24Å; F255-K574 HydrophobicContact CE1-CD 4.31Å; F255-K574 HydrophobicContact CZ-CB 3.82Å; F255-K574 HydrophobicContact CZ-CD 4.1Å; F255-K574 HydrophobicContact CZ-CG 3.93Å
256	A	39.4	Very low	39	Very low	37 Å²	37	83.8 Å²	83.8	31%	0.306	49%	0.49	S	S	.	.	S	Bend	trans	-82.5	141.8	174	0	0	0	0	0	109.7	Y253 S260	Y253-A256 WeakPolarHBondContact O-CB 2.94Å; Y253-A256 PolarHBondContact O-N 3.03Å; A256-S260 VanDerWaalsContact CB-CB 3.49Å
257	E	36.2	Very low	38	Very low	138 Å²	138	83.6 Å²	83.6	65%	0.645	49%	0.494	S	S	*	.			trans	-56	142.7	174.3	-70	-174.9	166.4	0	0	110	G259 S260	E257-G259 PolarHBondContact O-N 2.91Å; E257-G259 VanDerWaalsContact O-N 3.09Å; E257-S260 WeakPolarHBondContact O-CB 3.37Å; E257-S260 PolarHBondContact O-N 3Å; E257-S260 PolarHBondContact O-OG 3.26Å
258	S	33.8	Very low	37.5	Very low	120 Å²	120	87.1 Å²	87.1	84%	0.839	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.9	119.1	176.5	-67.5	0	0	0	0	111.2
259	G	34.7	Very low	36.7	Very low	81 Å²	81	88.6 Å²	88.6	84%	0.835	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.1	-5.5	-176	0	0	0	0	0	115.3	E257 M261	E257-G259 PolarHBondContact O-N 2.91Å; E257-G259 VanDerWaalsContact O-N 3.09Å; G259-M261 PolarHBondContact O-N 2.89Å
260	S	31.1	Very low	36.1	Very low	54 Å²	54	89.6 Å²	89.6	38%	0.378	53%	0.533	S	S	.	.			trans	-84.5	96.5	176.9	-58.1	0	0	0	0	110.9	A256 E257	A256-S260 VanDerWaalsContact CB-CB 3.49Å; E257-S260 WeakPolarHBondContact O-CB 3.37Å; E257-S260 PolarHBondContact O-N 3Å; E257-S260 PolarHBondContact O-OG 3.26Å
261	M	33	Very low	35.4	Very low	154 Å²	154	95.9 Å²	95.9	76%	0.759	56%	0.562	S	S	*	*			trans	-81.6	133.6	168.2	-73	-168.7	-75.9	0	0	110.5	G259 Q263	G259-M261 PolarHBondContact O-N 2.89Å; M261-Q263 PolarHBondContact O-N 3.31Å; M261-Q263 VanDerWaalsContact O-N 3.14Å
262	V	35	Very low	34.8	Very low	31 Å²	31	103.8 Å²	103.8	19%	0.188	59%	0.593	C	S	.	*			trans	-77.4	95.6	166.7	178.3	0	0	0	0	106.8	Y251	Y251-V262 HydrophobicContact CD1-CB 4.39Å; Y251-V262 HydrophobicContact CD1-CG2 4.34Å
263	Q	37	Very low	34	Very low	160 Å²	160	107.2 Å²	107.2	75%	0.748	62%	0.618	S	S	*	*			trans	-64.7	129.9	167.7	-99.6	-178.3	-16.9	0	0	108.9	M261 G265	M261-Q263 PolarHBondContact O-N 3.31Å; M261-Q263 VanDerWaalsContact O-N 3.14Å; Q263-G265 PolarHBondContact O-N 3.17Å
264	P	34.9	Very low	33.4	Very low	95 Å²	95	111.5 Å²	111.5	62%	0.617	65%	0.646	S	S	*	*			trans	-63.2	110.5	170.2	23.5	-29.7	0	0	0	108.6	I266	P264-I266 PolarHBondContact O-N 3.5Å; P264-I266 VanDerWaalsContact O-N 3.17Å
265	G	31.5	Very low	33	Very low	21 Å²	21	110.7 Å²	110.7	22%	0.216	65%	0.651	C	S	.	*			trans	-62.4	114.2	178.2	0	0	0	0	0	111	Q263	Q263-G265 PolarHBondContact O-N 3.17Å
266	I	37.4	Very low	32.7	Very low	154 Å²	154	114.4 Å²	114.4	79%	0.79	67%	0.67	S	S	*	*			trans	-85.1	123.1	166.5	-57.9	174.4	0	0	0	107	P264	P264-I266 PolarHBondContact O-N 3.5Å; P264-I266 VanDerWaalsContact O-N 3.17Å
267	P	34	Very low	32.9	Very low	99 Å²	99	116.7 Å²	116.7	64%	0.643	68%	0.682	S	S	*	*			trans	-73.4	132.9	172.3	29.5	-29.7	0	0	0	109.8
268	S	35.6	Very low	34.2	Very low	110 Å²	110	113 Å²	113	77%	0.769	67%	0.671	S	S	*	*	S	Bend	trans	73.5	109.4	166.3	66.4	0	0	0	0	119.4
269	A	27.3	Very low	35.7	Very low	99 Å²	99	116.4 Å²	116.4	82%	0.818	67%	0.671	S	S	*	*			trans	44.6	77.4	135.3	0	0	0	0	0	118.8
270	E	29.5	Very low	37	Very low	152 Å²	152	118.3 Å²	118.3	71%	0.71	66%	0.658	S	S	*	*			trans	-170.8	114.7	137.9	-104.4	165.9	-159.4	0	0	108.4	Y272	E270-Y272 HydrophobicContact CB-CD2 4.18Å; E270-Y272 HydrophobicContact CB-CE2 3.89Å; E270-Y272 PolarHBondContact O-N 3.14Å
271	L	25.5	Very low	38.2	Very low	182 Å²	182	119.5 Å²	119.5	95%	0.953	66%	0.663	S	S	*	*			trans	-66.7	98.4	177.4	-84.4	150.9	0	0	0	109.5
272	Y	26.2	Very low	39.4	Very low	194 Å²	194	116 Å²	116	76%	0.761	65%	0.65	S	S	*	*			trans	-101.7	93.2	161.1	-73.5	-79.9	0	0	0	109.1	E270 L274	E270-Y272 HydrophobicContact CB-CD2 4.18Å; E270-Y272 HydrophobicContact CB-CE2 3.89Å; E270-Y272 PolarHBondContact O-N 3.14Å; Y272-L274 PolarHBondContact O-N 3.02Å
273	S	27.1	Very low	40.9	Very low	105 Å²	105	118 Å²	118	73%	0.734	67%	0.665	S	S	*	*			trans	-55	133.3	155.1	-174.3	0	0	0	0	107.3	G275	S273-G275 PolarHBondContact O-N 2.81Å
274	L	28.9	Very low	42.4	Very low	176 Å²	176	116.3 Å²	116.3	92%	0.921	66%	0.656	S	S	*	*			trans	-62	85.8	160.4	-75.7	163.9	0	0	0	106.4	Y272	Y272-L274 PolarHBondContact O-N 3.02Å
275	G	30.8	Very low	43.3	Very low	55 Å²	55	114.1 Å²	114.1	57%	0.567	65%	0.645	S	S	*	*			trans	-58.3	148.1	174.8	0	0	0	0	0	109.1	S273	S273-G275 PolarHBondContact O-N 2.81Å
276	E	38.4	Very low	44.7	Very low	186 Å²	186	115.8 Å²	115.8	87%	0.869	66%	0.657	S	S	*	*			trans	-45.5	135.2	172.5	-69.7	-170.1	153.8	0	0	109.7	S278	E276-S278 PolarHBondContact O-N 3.49Å
277	P	43.2	Very low	46	Very low	85 Å²	85	115.2 Å²	115.2	55%	0.552	65%	0.649	S	S	*	*			trans	-53.9	130.3	177	23.1	-32.5	0	0	0	108.4	T281 V282	P277-T281 HydrophobicContact CB-CG2 4.36Å; P277-V282 HydrophobicContact CB-CG2 3.92Å; P277-V282 HydrophobicContact CG-CG2 3.8Å
278	S	63.7	Low	47	Very low	61 Å²	61	116.8 Å²	116.8	43%	0.427	65%	0.649	S	S	.	*			trans	-52.7	148.7	179.2	78.4	0	0	0	0	110	E276 E280 T281 V282	E276-S278 PolarHBondContact O-N 3.49Å; S278-E280 PolarHBondContact O-N 3.36Å; S278-E280 PolarHBondContact OG-N 2.9Å; S278-T281 WeakPolarHBondContact O-CA 3.47Å; S278-T281 WeakPolarHBondContact O-CB 3.2Å; S278-T281 PolarHBondContact O-N 3.02Å; S278-T281 PolarHBondContact OG-N 2.82Å; S278-T281 PolarHBondContact OG-OG1 3.46Å; S278-V282 PolarHBondContact O-N 2.98Å
279	K	64.4	Low	47.7	Very low	190 Å²	190	117.3 Å²	117.3	83%	0.826	64%	0.643	S	S	*	*	H	α-helix	trans	-49.3	-32	172.6	-89.2	-175.5	175.7	178.3	0	111.9	S283	K279-S283 WeakPolarHBondContact O-CB 3.32Å; K279-S283 PolarHBondContact O-N 2.02Å
280	E	62.3	Low	48.8	Very low	122 Å²	122	116.1 Å²	116.1	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-70	-41.1	176.9	-159.8	-170.9	149.9	0	0	112.6	S278 S283 K284	S278-E280 PolarHBondContact O-N 3.36Å; S278-E280 PolarHBondContact OG-N 2.9Å; E280-S283 PolarHBondContact O-N 2.61Å; E280-K284 WeakPolarHBondContact O-CB 3.33Å; E280-K284 PolarHBondContact O-N 3.45Å; E280-K284 IonicContact OE1-NZ 3.09Å; E280-K284 PolarHBondContact OE1-NZ 3.18Å
281	T	56	Low	49.8	Very low	78 Å²	78	115.3 Å²	115.3	48%	0.479	63%	0.628	S	S	.	*	H	α-helix	trans	-63.6	-45.3	176.3	-50	0	0	0	0	111	P277 S278 S283 K284 A285	P277-T281 HydrophobicContact CB-CG2 4.36Å; S278-T281 WeakPolarHBondContact O-CA 3.47Å; S278-T281 WeakPolarHBondContact O-CB 3.2Å; S278-T281 PolarHBondContact O-N 3.02Å; S278-T281 PolarHBondContact OG-N 2.82Å; S278-T281 PolarHBondContact OG-OG1 3.46Å; T281-S283 VanDerWaalsContact C-N 3.35Å; T281-K284 PolarHBondContact O-N 3.05Å; T281-A285 WeakPolarHBondContact O-CB 3.36Å; T281-A285 PolarHBondContact O-N 2.86Å
282	V	59.5	Low	50.7	Low	80 Å²	80	113 Å²	113	49%	0.485	62%	0.615	S	S	.	*	H	α-helix	trans	-63.8	-41.8	175.5	-179.6	0	0	0	0	110.7	P277 S278 A285 A286	P277-V282 HydrophobicContact CB-CG2 3.92Å; P277-V282 HydrophobicContact CG-CG2 3.8Å; S278-V282 PolarHBondContact O-N 2.98Å; V282-A285 PolarHBondContact O-N 3.14Å; V282-A286 VanDerWaalsContact O-CB 3.31Å; V282-A286 WeakPolarHBondContact O-CB 3.44Å; V282-A286 PolarHBondContact O-N 3.21Å
283	S	66.4	Low	51.5	Low	73 Å²	73	106.6 Å²	106.6	51%	0.51	60%	0.599	S	S	.	*	H	α-helix	trans	-65.4	-42.1	177.5	-178.1	0	0	0	0	112.7	K279 E280 T281 A286 K287	K279-S283 WeakPolarHBondContact O-CB 3.32Å; K279-S283 PolarHBondContact O-N 2.02Å; E280-S283 PolarHBondContact O-N 2.61Å; T281-S283 VanDerWaalsContact C-N 3.35Å; S283-A286 PolarHBondContact O-N 3.17Å; S283-K287 VanDerWaalsContact O-CB 3.28Å; S283-K287 WeakPolarHBondContact O-CB 2.92Å; S283-K287 PolarHBondContact O-N 3.15Å
284	K	67.5	Low	52.3	Low	126 Å²	126	107.3 Å²	107.3	55%	0.548	60%	0.601	S	S	.	*	H	α-helix	trans	-65.7	-41.5	175.9	-90.1	171	173.4	155.6	0	112.1	E280 T281 K287 M288	E280-K284 WeakPolarHBondContact O-CB 3.33Å; E280-K284 PolarHBondContact O-N 3.45Å; E280-K284 IonicContact OE1-NZ 3.09Å; E280-K284 PolarHBondContact OE1-NZ 3.18Å; T281-K284 PolarHBondContact O-N 3.05Å; K284-K287 PolarHBondContact O-N 3.44Å; K284-M288 PolarHBondContact O-N 3.38Å
285	A	55.2	Low	53.3	Low	49 Å²	49	106.5 Å²	106.5	41%	0.405	60%	0.598	S	S	.	*	H	α-helix	trans	-64.4	-44.7	175.1	0	0	0	0	0	111.6	T281 V282 K287 M288 L289	T281-A285 WeakPolarHBondContact O-CB 3.36Å; T281-A285 PolarHBondContact O-N 2.86Å; V282-A285 PolarHBondContact O-N 3.14Å; A285-K287 VanDerWaalsContact C-N 3.32Å; A285-K287 PolarHBondContact O-N 2.72Å; A285-M288 PolarHBondContact O-N 3.4Å; A285-L289 WeakPolarHBondContact O-CB 2.99Å; A285-L289 WeakPolarHBondContact O-CG 3.35Å; A285-L289 PolarHBondContact O-N 3.31Å
286	A	60.4	Low	53.9	Low	56 Å²	56	108.6 Å²	108.6	46%	0.463	60%	0.599	S	S	.	*	H	α-helix	trans	-61.8	-39.2	174.1	0	0	0	0	0	112	V282 S283 L289 S290	V282-A286 VanDerWaalsContact O-CB 3.31Å; V282-A286 WeakPolarHBondContact O-CB 3.44Å; V282-A286 PolarHBondContact O-N 3.21Å; S283-A286 PolarHBondContact O-N 3.17Å; A286-L289 PolarHBondContact O-N 2.82Å; A286-S290 WeakPolarHBondContact O-CB 3.21Å; A286-S290 PolarHBondContact O-N 3.12Å; A286-S290 PolarHBondContact O-OG 2.8Å
287	K	65.3	Low	54	Low	142 Å²	142	109 Å²	109	62%	0.617	60%	0.601	S	S	*	*	H	α-helix	trans	-65.8	-42.3	175.3	-166.3	172.8	-176.7	177	0	111.5	S283 K284 A285 S290 L291	S283-K287 VanDerWaalsContact O-CB 3.28Å; S283-K287 WeakPolarHBondContact O-CB 2.92Å; S283-K287 PolarHBondContact O-N 3.15Å; K284-K287 PolarHBondContact O-N 3.44Å; A285-K287 VanDerWaalsContact C-N 3.32Å; A285-K287 PolarHBondContact O-N 2.72Å; K287-S290 WeakPolarHBondContact CA-OG 3.26Å; K287-S290 PolarHBondContact O-N 2.95Å; K287-S290 PolarHBondContact O-OG 2.89Å; K287-L291 VanDerWaalsContact O-CG 3.29Å; K287-L291 WeakPolarHBondContact O-CG 3.33Å; K287-L291 PolarHBondContact O-N 3.47Å
288	M	54.3	Low	54	Low	132 Å²	132	112.8 Å²	112.8	65%	0.65	61%	0.611	S	S	*	*	H	α-helix	trans	-63.5	-43.6	173.4	-85	-179.4	149.9	0	0	112.2	K284 A285 S290 L291 I292	K284-M288 PolarHBondContact O-N 3.38Å; A285-M288 PolarHBondContact O-N 3.4Å; M288-S290 VanDerWaalsContact C-N 3.32Å; M288-S290 PolarHBondContact O-N 2.96Å; M288-L291 WeakPolarHBondContact O-CB 2.97Å; M288-L291 PolarHBondContact O-N 2.9Å; M288-L291 VanDerWaalsContact O-N 3.14Å; M288-I292 WeakPolarHBondContact O-CD1 2.91Å; M288-I292 WeakPolarHBondContact O-CG1 3.36Å; M288-I292 PolarHBondContact O-N 3.13Å
289	L	49	Very low	52.7	Low	121 Å²	121	119.5 Å²	119.5	63%	0.634	64%	0.635	S	S	*	*	H	α-helix	trans	-64.1	-37.1	176.2	-75.9	163.1	0	0	0	112	A285 A286 L291 I292 S293	A285-L289 WeakPolarHBondContact O-CB 2.99Å; A285-L289 WeakPolarHBondContact O-CG 3.35Å; A285-L289 PolarHBondContact O-N 3.31Å; A286-L289 PolarHBondContact O-N 2.82Å; L289-L291 PolarHBondContact O-N 2.99Å; L289-I292 PolarHBondContact O-N 3.07Å; L289-S293 PolarHBondContact O-N 3Å; L289-S293 VanDerWaalsContact O-N 3.14Å
290	S	51.9	Low	51.4	Low	73 Å²	73	121.2 Å²	121.2	51%	0.51	64%	0.637	S	S	.	*	H	α-helix	trans	-67.5	-23.1	174.9	73.6	0	0	0	0	113.8	A286 K287 M288	A286-S290 WeakPolarHBondContact O-CB 3.21Å; A286-S290 PolarHBondContact O-N 3.12Å; A286-S290 PolarHBondContact O-OG 2.8Å; K287-S290 WeakPolarHBondContact CA-OG 3.26Å; K287-S290 PolarHBondContact O-N 2.95Å; K287-S290 PolarHBondContact O-OG 2.89Å; M288-S290 VanDerWaalsContact C-N 3.32Å; M288-S290 PolarHBondContact O-N 2.96Å
291	L	49.8	Very low	50.1	Low	135 Å²	135	122.7 Å²	122.7	71%	0.707	65%	0.654	S	S	*	*	H	α-helix	trans	-82.2	-25	175.7	-70.1	165.7	0	0	0	112.5	K287 M288 L289	K287-L291 VanDerWaalsContact O-CG 3.29Å; K287-L291 WeakPolarHBondContact O-CG 3.33Å; K287-L291 PolarHBondContact O-N 3.47Å; M288-L291 WeakPolarHBondContact O-CB 2.97Å; M288-L291 PolarHBondContact O-N 2.9Å; M288-L291 VanDerWaalsContact O-N 3.14Å; L289-L291 PolarHBondContact O-N 2.99Å
292	I	44.7	Very low	49.3	Very low	134 Å²	134	123 Å²	123	69%	0.687	67%	0.665	S	S	*	*	H	α-helix	trans	-93.7	-18	-176.8	-59	163.1	0	0	0	111.3	M288 L289	M288-I292 WeakPolarHBondContact O-CD1 2.91Å; M288-I292 WeakPolarHBondContact O-CG1 3.36Å; M288-I292 PolarHBondContact O-N 3.13Å; L289-I292 PolarHBondContact O-N 3.07Å
293	S	41.9	Very low	48.3	Very low	59 Å²	59	125 Å²	125	41%	0.413	68%	0.682	S	S	.	*			trans	-140.6	96	175.3	-87.1	0	0	0	0	111.6	L289 N295	L289-S293 PolarHBondContact O-N 3Å; L289-S293 VanDerWaalsContact O-N 3.14Å; S293-N295 PolarHBondContact O-N 3.43Å
294	P	44.6	Very low	47.8	Very low	121 Å²	121	126.1 Å²	126.1	79%	0.786	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-3.2	176.3	25.8	-32	0	0	0	113.8
295	N	50.5	Low	48	Very low	158 Å²	158	123.5 Å²	123.5	85%	0.845	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	8	-174.3	-83	-17.1	0	0	0	115.7	S293 H297	S293-N295 PolarHBondContact O-N 3.43Å; N295-H297 PolarHBondContact O-N 2.85Å
296	V	42.6	Very low	48.7	Very low	100 Å²	100	126 Å²	126	61%	0.606	69%	0.689	S	S	*	*			trans	-101.8	77.2	177.2	-172.5	0	0	0	0	110.4
297	H	40.5	Very low	49.1	Very low	193 Å²	193	129.9 Å²	129.9	89%	0.894	70%	0.698	S	S	*	*			trans	-91.7	94.2	158.1	-105.3	-5.5	0	0	0	108.8	N295 Q299	N295-H297 PolarHBondContact O-N 2.85Å; H297-Q299 PolarHBondContact O-N 3.45Å
298	H	44.5	Very low	48.7	Very low	166 Å²	166	127.5 Å²	127.5	77%	0.769	69%	0.691	S	S	*	*			trans	-79.7	111.8	162.1	-93.5	1.8	0	0	0	109.6	R300	H298-R300 VanDerWaalsContact C-N 3.26Å; H298-R300 PolarHBondContact O-N 2.9Å
299	Q	35.5	Very low	49.2	Very low	201 Å²	201	125.1 Å²	125.1	94%	0.939	68%	0.681	S	S	*	*			trans	-60.5	92.1	153.5	-82.3	179.5	-19.7	0	0	108.5	H297	H297-Q299 PolarHBondContact O-N 3.45Å
300	R	37.4	Very low	50.2	Low	227 Å²	227	125 Å²	125	86%	0.857	68%	0.677	S	S	*	*			trans	-124.2	108.5	154.3	-116.8	-176.2	-169.1	177.3	5.3	106.8	H298 A302	H298-R300 VanDerWaalsContact C-N 3.26Å; H298-R300 PolarHBondContact O-N 2.9Å; R300-A302 PolarHBondContact O-N 2.85Å
301	T	35.2	Very low	50.6	Low	152 Å²	152	124.1 Å²	124.1	93%	0.933	67%	0.674	S	S	*	*			trans	-61.4	83.8	168.9	33.1	0	0	0	0	109.3
302	A	38.6	Very low	51	Low	86 Å²	86	121.9 Å²	121.9	71%	0.711	67%	0.666	S	S	*	*			trans	-77	118.3	159.4	0	0	0	0	0	107.1	R300 L304	R300-A302 PolarHBondContact O-N 2.85Å; A302-L304 PolarHBondContact O-N 3.32Å
303	S	39	Very low	52	Low	121 Å²	121	121.1 Å²	121.1	85%	0.846	66%	0.659	S	S	*	*			trans	-56.9	109.1	172.6	48.4	0	0	0	0	109.4
304	L	55	Low	53.1	Low	97 Å²	97	123.6 Å²	123.6	51%	0.508	67%	0.668	S	S	.	*			trans	-61	135.2	169.7	-74.6	157.3	0	0	0	108.7	A302 L308 L309	A302-L304 PolarHBondContact O-N 3.32Å; L304-L308 HydrophobicContact CD2-CB 4.11Å; L304-L308 HydrophobicContact CD2-CD2 3.32Å; L304-L308 HydrophobicContact CD2-CG 4.2Å; L304-L309 HydrophobicContact CB-CD1 4.08Å; L304-L309 HydrophobicContact CD1-CD1 4.25Å
305	T	73.4	Confident	53.1	Low	70 Å²	70	121.9 Å²	121.9	43%	0.429	66%	0.664	S	S	.	*			trans	-61.7	150.7	173	57.9	0	0	0	0	109.7	E307 L308 L309	T305-E307 PolarHBondContact O-N 3.31Å; T305-E307 VanDerWaalsContact O-N 3.1Å; T305-L308 PolarHBondContact O-N 3.5Å; T305-L309 PolarHBondContact O-N 3.13Å
306	P	69.4	Low	52.6	Low	103 Å²	103	118.1 Å²	118.1	67%	0.669	66%	0.655	S	S	*	*	H	α-helix	trans	-52.8	-33.8	178.1	-23.6	32.2	0	0	0	112.6	L309 Q310	P306-L309 PolarHBondContact O-N 2.95Å; P306-Q310 VanDerWaalsContact O-CB 3.26Å; P306-Q310 WeakPolarHBondContact O-CB 3.5Å; P306-Q310 PolarHBondContact O-N 3.31Å
307	E	68.4	Low	52.3	Low	137 Å²	137	121.5 Å²	121.5	64%	0.64	66%	0.661	S	S	*	*	H	α-helix	trans	-69.9	-33.3	177	-59.2	103	177.6	0	0	113.5	T305 A311	T305-E307 PolarHBondContact O-N 3.31Å; T305-E307 VanDerWaalsContact O-N 3.1Å; E307-A311 VanDerWaalsContact O-CB 3.3Å; E307-A311 WeakPolarHBondContact O-CB 3.43Å; E307-A311 PolarHBondContact O-N 3.46Å
308	L	56.1	Low	52.1	Low	92 Å²	92	119.8 Å²	119.8	48%	0.482	66%	0.659	S	S	.	*	H	α-helix	trans	-79	-33.2	176.8	-141.7	82	0	0	0	111.2	L304 T305 Q310 A311 V312	L304-L308 HydrophobicContact CD2-CB 4.11Å; L304-L308 HydrophobicContact CD2-CD2 3.32Å; L304-L308 HydrophobicContact CD2-CG 4.2Å; T305-L308 PolarHBondContact O-N 3.5Å; L308-Q310 VanDerWaalsContact C-N 3.35Å; L308-A311 PolarHBondContact O-N 3.31Å; L308-V312 WeakPolarHBondContact O-CB 3.37Å; L308-V312 WeakPolarHBondContact O-CG2 3.39Å; L308-V312 PolarHBondContact O-N 3.11Å
309	L	66.1	Low	51.8	Low	82 Å²	82	117.1 Å²	117.1	43%	0.429	66%	0.659	S	S	.	*	H	α-helix	trans	-61.9	-46	171.5	-149.7	92	0	0	0	110.2	L304 T305 P306 A311 V312 E313	L304-L309 HydrophobicContact CB-CD1 4.08Å; L304-L309 HydrophobicContact CD1-CD1 4.25Å; T305-L309 PolarHBondContact O-N 3.13Å; P306-L309 PolarHBondContact O-N 2.95Å; L309-A311 PolarHBondContact O-N 2.82Å; L309-V312 PolarHBondContact O-N 2.91Å; L309-E313 WeakPolarHBondContact O-CB 3.45Å; L309-E313 VanDerWaalsContact O-CG 3.3Å; L309-E313 WeakPolarHBondContact O-CG 3.18Å; L309-E313 PolarHBondContact O-N 3.3Å
310	Q	69.4	Low	51.7	Low	118 Å²	118	114.1 Å²	114.1	55%	0.551	66%	0.655	S	S	*	*	H	α-helix	trans	-68.1	-34.1	177.3	-166.4	171.3	27.6	0	0	112.4	P306 L308 N314	P306-Q310 VanDerWaalsContact O-CB 3.26Å; P306-Q310 WeakPolarHBondContact O-CB 3.5Å; P306-Q310 PolarHBondContact O-N 3.31Å; L308-Q310 VanDerWaalsContact C-N 3.35Å; Q310-N314 WeakPolarHBondContact O-CB 3.27Å; Q310-N314 PolarHBondContact O-N 2.75Å; Q310-N314 PolarHBondContact O-ND2 3.47Å
311	A	60.3	Low	51.8	Low	54 Å²	54	110.8 Å²	110.8	45%	0.446	65%	0.653	S	S	.	*	H	α-helix	trans	-70.3	-35.6	174.2	0	0	0	0	0	112.9	E307 L308 L309 A315	E307-A311 VanDerWaalsContact O-CB 3.3Å; E307-A311 WeakPolarHBondContact O-CB 3.43Å; E307-A311 PolarHBondContact O-N 3.46Å; L308-A311 PolarHBondContact O-N 3.31Å; L309-A311 PolarHBondContact O-N 2.82Å; A311-A315 VanDerWaalsContact O-CB 3.29Å; A311-A315 WeakPolarHBondContact O-CB 3.37Å; A311-A315 PolarHBondContact O-N 3.49Å; A311-A315 VanDerWaalsContact O-N 3.1Å
312	V	59.3	Low	51.8	Low	89 Å²	89	113.1 Å²	113.1	54%	0.539	65%	0.65	S	S	.	*	H	α-helix	trans	-72.7	-39.6	175.1	170.8	0	0	0	0	111	L308 L309 A315 A316	L308-V312 WeakPolarHBondContact O-CB 3.37Å; L308-V312 WeakPolarHBondContact O-CG2 3.39Å; L308-V312 PolarHBondContact O-N 3.11Å; L309-V312 PolarHBondContact O-N 2.91Å; V312-A315 PolarHBondContact O-N 3Å; V312-A316 PolarHBondContact O-N 3.19Å
313	E	65.2	Low	51.6	Low	117 Å²	117	114.4 Å²	114.4	55%	0.547	65%	0.654	S	S	.	*	H	α-helix	trans	-67.6	-35.2	174.7	-75.1	175.7	168.7	0	0	112.2	L309	L309-E313 WeakPolarHBondContact O-CB 3.45Å; L309-E313 VanDerWaalsContact O-CG 3.3Å; L309-E313 WeakPolarHBondContact O-CG 3.18Å; L309-E313 PolarHBondContact O-N 3.3Å
314	N	63.7	Low	51.5	Low	112 Å²	112	115.7 Å²	115.7	60%	0.599	65%	0.651	S	S	*	*	H	α-helix	trans	-77.9	-21.4	176.8	-71.3	-23.1	0	0	0	113.6	Q310	Q310-N314 WeakPolarHBondContact O-CB 3.27Å; Q310-N314 PolarHBondContact O-N 2.75Å; Q310-N314 PolarHBondContact O-ND2 3.47Å
315	A	45.3	Very low	50.5	Low	85 Å²	85	120.5 Å²	120.5	70%	0.702	67%	0.668	S	S	*	*	H	α-helix	trans	-86.8	-9.3	177.3	0	0	0	0	0	113.7	A311 V312	A311-A315 VanDerWaalsContact O-CB 3.29Å; A311-A315 WeakPolarHBondContact O-CB 3.37Å; A311-A315 PolarHBondContact O-N 3.49Å; A311-A315 VanDerWaalsContact O-N 3.1Å; V312-A315 PolarHBondContact O-N 3Å
316	A	40.9	Very low	48.6	Very low	79 Å²	79	123 Å²	123	65%	0.653	69%	0.688	S	S	*	*			trans	-95.1	11.4	-175.6	0	0	0	0	0	114.8	V312	V312-A316 PolarHBondContact O-N 3.19Å
317	F	35.3	Very low	46.8	Very low	170 Å²	170	122.6 Å²	122.6	75%	0.746	69%	0.688	S	S	*	*			trans	-83.7	120.4	174.4	-94.4	-93.3	0	0	0	111.2
318	N	36.3	Very low	45.2	Very low	158 Å²	158	122.4 Å²	122.4	85%	0.845	70%	0.696	S	S	*	*	S	Bend	trans	92.5	67.9	179.1	-58.8	-26.6	0	0	0	117
319	S	38.8	Very low	44.3	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	71%	0.71	S	S	*	*				-170.1	120	117.1	59.1	0	0	0	0	111.4	L321	S319-L321 PolarHBondContact O-N 2.86Å; S319-L321 VanDerWaalsContact O-N 3.15Å
320	T	33.6	Very low	42.6	Very low	138 Å²	138	127.3 Å²	127.3	85%	0.847	73%	0.73	S	S	*	*			trans	-63.8	97	171.7	38.3	0	0	0	0	110.7
321	L	39.3	Very low	41	Very low	156 Å²	156	126.8 Å²	126.8	82%	0.817	74%	0.737	S	S	*	*			trans	-173.8	13.2	159.1	-107.6	150.5	0	0	0	116.9	S319	S319-L321 PolarHBondContact O-N 2.86Å; S319-L321 VanDerWaalsContact O-N 3.15Å
322	F	34.9	Very low	39.5	Very low	201 Å²	201	129.4 Å²	129.4	88%	0.882	75%	0.752	S	S	*	*			trans	-106.1	6.5	-168	-134.1	-95.9	0	0	0	116.8
323	S	33.2	Very low	38.1	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	77%	0.771	S	S	*	*	S	Bend	trans	-101.1	20.3	-175.9	75.8	0	0	0	0	115.7
324	L	37.4	Very low	36.5	Very low	148 Å²	148	132.4 Å²	132.4	78%	0.775	78%	0.78	S	S	*	*	S	Bend	trans	-129	5.5	-176.4	-87.9	165.5	0	0	0	116.1
325	F	34.9	Very low	34.9	Very low	198 Å²	198	131.7 Å²	131.7	87%	0.868	79%	0.79	S	S	*	*			trans	-111.2	27	179.9	-85.5	-84.5	0	0	0	114
326	S	32.7	Very low	34.3	Very low	122 Å²	122	132.4 Å²	132.4	85%	0.853	80%	0.795	S	S	*	*	S	Bend	trans	-92.1	11.3	177.3	-175.1	0	0	0	0	114.6
327	S	32.7	Very low	34	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	81%	0.806	S	S	*	*	S	Bend	trans	-159.3	143.9	177.5	56.4	0	0	0	0	109.9
328	V	34.7	Very low	34.3	Very low	133 Å²	133	134 Å²	134	81%	0.806	81%	0.808	S	S	*	*			trans	92.7	122.7	175.8	-155.3	0	0	0	0	113.9
329	I	35.6	Very low	34.5	Very low	151 Å²	151	135.3 Å²	135.3	77%	0.774	81%	0.809	S	S	*	*			trans	94.9	79.5	162.2	-36.2	179.1	0	0	0	118
330	C	32.3	Very low	35.1	Very low	127 Å²	127	137.9 Å²	137.9	86%	0.858	81%	0.809	S	S	*	*				-97.7	145.4	125.2	-86.7	0	0	0	0	106.3
331	P	34.6	Very low	36.2	Very low	107 Å²	107	135 Å²	135	70%	0.695	79%	0.788	S	S	*	*				-150.1	173.5	62.2	35.4	-12.9	0	0	0	116.7
332	S	29.1	Very low	37.2	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	78%	0.777	S	S	*	*			trans	60.7	107.3	159	61.5	0	0	0	0	118.9
333	L	30.2	Very low	38.6	Very low	182 Å²	182	131.3 Å²	131.3	95%	0.953	77%	0.769	S	S	*	*			trans	-134.5	108.7	145.4	-138.2	82.4	0	0	0	109.1
334	A	30	Very low	39.8	Very low	87 Å²	87	130.9 Å²	130.9	72%	0.719	76%	0.757	S	S	*	*			trans	-71.9	152.6	173	0	0	0	0	0	111
335	A	32.1	Very low	40.8	Very low	98 Å²	98	128.3 Å²	128.3	81%	0.81	74%	0.744	S	S	*	*			trans	29.1	93.9	148.3	0	0	0	0	0	117
336	A	32.7	Very low	42.3	Very low	100 Å²	100	126.9 Å²	126.9	83%	0.826	73%	0.733	S	S	*	*			trans	-110.4	97.6	149.8	0	0	0	0	0	107	A338	A336-A338 PolarHBondContact O-N 3.49Å
337	E	34	Very low	43.9	Very low	186 Å²	186	126.4 Å²	126.4	87%	0.869	72%	0.72	S	S	*	*			trans	-59.3	102.8	167.4	-67.2	-179.8	148.7	0	0	108	E339	E337-E339 PolarHBondContact O-N 2.95Å
338	A	40.8	Very low	45.5	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	72%	0.718	S	S	*	*			trans	-71.8	92.7	160	0	0	0	0	0	106.4	A336 Q340	A336-A338 PolarHBondContact O-N 3.49Å; A338-Q340 PolarHBondContact O-N 2.02Å
339	E	40.5	Very low	47.2	Very low	186 Å²	186	126.1 Å²	126.1	87%	0.869	70%	0.699	S	S	*	*			trans	-51.3	102.2	173.5	-160.5	177.3	-167.7	0	0	108.4	E337 D341	E337-E339 PolarHBondContact O-N 2.95Å; E339-D341 PolarHBondContact O-N 2.97Å; E339-D341 VanDerWaalsContact O-N 3.11Å
340	Q	52.3	Low	48.8	Very low	165 Å²	165	122.3 Å²	122.3	77%	0.771	68%	0.681	S	S	*	*			trans	-61.8	115.8	174.8	-87	-178.8	-22.1	0	0	107.7	A338 P342	A338-Q340 PolarHBondContact O-N 2.02Å; Q340-P342 WeakPolarHBondContact O-CD 3.39Å
341	D	56.5	Low	50.5	Low	76 Å²	76	119.9 Å²	119.9	41%	0.406	66%	0.657	S	S	.	*			trans	-54.6	113.2	177.5	-178.4	-7.4	0	0	0	109.1	E339 R343 L344 L345	E339-D341 PolarHBondContact O-N 2.97Å; E339-D341 VanDerWaalsContact O-N 3.11Å; D341-R343 PolarHBondContact O-N 2.95Å; D341-R343 WeakPolarHBondContact OD1-CB 3.4Å; D341-R343 VanDerWaalsContact OD1-CG 3.25Å; D341-R343 WeakPolarHBondContact OD1-CG 3.42Å; D341-R343 PolarHBondContact OD1-N 2.86Å; D341-L344 HydrophobicContact CB-CB 4.42Å; D341-L344 HydrophobicContact CB-CD1 4.43Å; D341-L344 WeakPolarHBondContact O-CB 3.46Å; D341-L344 PolarHBondContact O-N 2.85Å; D341-L345 PolarHBondContact O-N 2.85Å
342	P	60	Low	51.8	Low	89 Å²	89	116.6 Å²	116.6	58%	0.578	64%	0.639	S	S	*	*	H	α-helix	trans	-60.2	-17.2	-178	23.5	-33.3	0	0	0	112.4	Q340 R346	Q340-P342 WeakPolarHBondContact O-CD 3.39Å; P342-R346 VanDerWaalsContact O-CB 3.32Å; P342-R346 WeakPolarHBondContact O-CB 3.2Å; P342-R346 PolarHBondContact O-N 3.37Å; P342-R346 VanDerWaalsContact O-N 3.16Å
343	R	64.6	Low	53.6	Low	191 Å²	191	116.1 Å²	116.1	72%	0.721	62%	0.623	S	S	*	*	H	α-helix	trans	-71.4	-38	174.1	-59.5	173.3	175.7	-172	0	112.3	D341 R346 L347	D341-R343 PolarHBondContact O-N 2.95Å; D341-R343 WeakPolarHBondContact OD1-CB 3.4Å; D341-R343 VanDerWaalsContact OD1-CG 3.25Å; D341-R343 WeakPolarHBondContact OD1-CG 3.42Å; D341-R343 PolarHBondContact OD1-N 2.86Å; R343-R346 PolarHBondContact O-N 2.9Å; R343-L347 WeakPolarHBondContact O-CB 3.28Å; R343-L347 PolarHBondContact O-N 3.24Å
344	L	59	Low	55.5	Low	105 Å²	105	115.1 Å²	115.1	55%	0.55	61%	0.607	S	S	.	*	H	α-helix	trans	-69.2	-42.8	179.7	-111.5	152.4	0	0	0	111.2	D341 R346 L347 F348	D341-L344 HydrophobicContact CB-CB 4.42Å; D341-L344 HydrophobicContact CB-CD1 4.43Å; D341-L344 WeakPolarHBondContact O-CB 3.46Å; D341-L344 PolarHBondContact O-N 2.85Å; L344-R346 VanDerWaalsContact C-N 3.34Å; L344-R346 PolarHBondContact O-N 3.22Å; L344-L347 PolarHBondContact O-N 3.34Å; L344-F348 WeakPolarHBondContact O-CB 3.31Å; L344-F348 PolarHBondContact O-N 2.92Å
345	L	58.5	Low	57.1	Low	94 Å²	94	113.4 Å²	113.4	49%	0.492	59%	0.587	S	S	.	*	H	α-helix	trans	-63.1	-41	174	-175.5	63.4	0	0	0	111.5	D341 F348 L349	D341-L345 PolarHBondContact O-N 2.85Å; L345-F348 PolarHBondContact O-N 2.78Å; L345-L349 HydrophobicContact CG-CD1 4.24Å; L345-L349 VanDerWaalsContact O-CG 3.29Å; L345-L349 WeakPolarHBondContact O-CG 3.42Å; L345-L349 PolarHBondContact O-N 3.06Å
346	R	65.8	Low	58.5	Low	169 Å²	169	108.9 Å²	108.9	64%	0.638	55%	0.55	S	S	*	*	H	α-helix	trans	-65	-44.3	176.4	-170.1	172.8	-176.5	162.7	0.8	112.5	P342 R343 L344 F348 L349 D350	P342-R346 VanDerWaalsContact O-CB 3.32Å; P342-R346 WeakPolarHBondContact O-CB 3.2Å; P342-R346 PolarHBondContact O-N 3.37Å; P342-R346 VanDerWaalsContact O-N 3.16Å; R343-R346 PolarHBondContact O-N 2.9Å; L344-R346 VanDerWaalsContact C-N 3.34Å; L344-R346 PolarHBondContact O-N 3.22Å; R346-F348 VanDerWaalsContact C-N 3.34Å; R346-F348 PolarHBondContact O-N 2.87Å; R346-L349 PolarHBondContact O-N 2.68Å; R346-D350 WeakPolarHBondContact O-CB 3.3Å; R346-D350 PolarHBondContact O-N 3.15Å
347	L	66.8	Low	60.1	Low	112 Å²	112	108.3 Å²	108.3	59%	0.586	53%	0.53	S	S	*	.	H	α-helix	trans	-59.9	-42.6	175.1	-89.5	158	0	0	0	112.1	R343 L344 H351	R343-L347 WeakPolarHBondContact O-CB 3.28Å; R343-L347 PolarHBondContact O-N 3.24Å; L344-L347 PolarHBondContact O-N 3.34Å; L347-H351 WeakPolarHBondContact O-CB 3.37Å; L347-H351 PolarHBondContact O-N 3.02Å
348	F	65.2	Low	61.5	Low	140 Å²	140	105.5 Å²	105.5	61%	0.614	52%	0.521	S	S	*	.	H	α-helix	trans	-62.4	-47.3	175.8	177.4	-96.1	0	0	0	111.9	L344 L345 R346 H351 A352	L344-F348 WeakPolarHBondContact O-CB 3.31Å; L344-F348 PolarHBondContact O-N 2.92Å; L345-F348 PolarHBondContact O-N 2.78Å; R346-F348 VanDerWaalsContact C-N 3.34Å; R346-F348 PolarHBondContact O-N 2.87Å; F348-H351 PolarHBondContact O-N 3.2Å; F348-A352 WeakPolarHBondContact O-CB 3.36Å; F348-A352 PolarHBondContact O-N 3.24Å
349	L	70.7	Confident	62.6	Low	80 Å²	80	105.1 Å²	105.1	42%	0.419	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-40.3	178.9	-70.9	171.2	0	0	0	112.4	L345 R346 K353	L345-L349 HydrophobicContact CG-CD1 4.24Å; L345-L349 VanDerWaalsContact O-CG 3.29Å; L345-L349 WeakPolarHBondContact O-CG 3.42Å; L345-L349 PolarHBondContact O-N 3.06Å; R346-L349 PolarHBondContact O-N 2.68Å; L349-K353 WeakPolarHBondContact O-CB 3.31Å; L349-K353 PolarHBondContact O-N 3.04Å
350	D	69.4	Low	63.3	Low	71 Å²	71	99.2 Å²	99.2	38%	0.38	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-38.8	176.1	-80.9	-22.5	0	0	0	111.8	R346 R354	R346-D350 WeakPolarHBondContact O-CB 3.3Å; R346-D350 PolarHBondContact O-N 3.15Å; D350-R354 PolarHBondContact O-N 3.26Å
351	H	67.2	Low	62.8	Low	76 Å²	76	94.7 Å²	94.7	35%	0.352	49%	0.489	S	S	.	.	H	α-helix	trans	-69.4	-44.7	176.4	-171.4	55.7	0	0	0	111.9	L347 F348 K353 R354 V355	L347-H351 WeakPolarHBondContact O-CB 3.37Å; L347-H351 PolarHBondContact O-N 3.02Å; F348-H351 PolarHBondContact O-N 3.2Å; H351-K353 VanDerWaalsContact C-N 3.31Å; H351-K353 PolarHBondContact O-N 3.16Å; H351-R354 PolarHBondContact O-N 3.26Å; H351-R354 VanDerWaalsContact O-N 3.13Å; H351-V355 WeakPolarHBondContact O-CG2 3.4Å; H351-V355 PolarHBondContact O-N 2.93Å
352	A	62.5	Low	62.4	Low	39 Å²	39	95.1 Å²	95.1	32%	0.322	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-40.7	176	0	0	0	0	0	111.8	F348 G356	F348-A352 WeakPolarHBondContact O-CB 3.36Å; F348-A352 PolarHBondContact O-N 3.24Å; A352-G356 PolarHBondContact O-N 2.85Å
353	K	67.5	Low	61.6	Low	97 Å²	97	95 Å²	95	42%	0.422	49%	0.494	S	S	.	.	H	α-helix	trans	-58.1	-49.6	172.1	178.8	-174.6	174.6	-174	0	111.2	L349 H351 G356 Q357	L349-K353 WeakPolarHBondContact O-CB 3.31Å; L349-K353 PolarHBondContact O-N 3.04Å; H351-K353 VanDerWaalsContact C-N 3.31Å; H351-K353 PolarHBondContact O-N 3.16Å; K353-G356 PolarHBondContact O-N 3.29Å; K353-Q357 WeakPolarHBondContact O-CG 3.34Å; K353-Q357 PolarHBondContact O-N 2.75Å
354	R	69.3	Low	60.6	Low	162 Å²	162	92.7 Å²	92.7	61%	0.611	50%	0.496	S	S	*	.	H	α-helix	trans	-62.2	-48.3	-178.4	-162.2	-179.7	-68.4	175.6	-1.8	111.3	D350 H351 G356 Q357 D358	D350-R354 PolarHBondContact O-N 3.26Å; H351-R354 PolarHBondContact O-N 3.26Å; H351-R354 VanDerWaalsContact O-N 3.13Å; R354-G356 VanDerWaalsContact C-N 3.31Å; R354-G356 PolarHBondContact O-N 3.23Å; R354-Q357 PolarHBondContact O-N 3.09Å; R354-D358 WeakPolarHBondContact O-CB 3.3Å; R354-D358 PolarHBondContact O-N 3.31Å
355	V	64.5	Low	59.9	Low	50 Å²	50	96.3 Å²	96.3	30%	0.303	51%	0.51	S	S	.	.	H	α-helix	trans	-58.5	-42.5	176.2	173.1	0	0	0	0	111.4	H351 D358 T359	H351-V355 WeakPolarHBondContact O-CG2 3.4Å; H351-V355 PolarHBondContact O-N 2.93Å; V355-D358 PolarHBondContact O-N 2.95Å; V355-T359 HydrophobicContact CG1-CG2 4.3Å; V355-T359 WeakPolarHBondContact O-CB 3.36Å; V355-T359 VanDerWaalsContact O-CG2 3.25Å; V355-T359 WeakPolarHBondContact O-CG2 3.35Å; V355-T359 PolarHBondContact O-N 2.76Å; V355-T359 PolarHBondContact O-OG1 2.88Å
356	G	61.1	Low	59	Low	4 Å²	4	96.2 Å²	96.2	4%	0.041	51%	0.51	C	S	.	.	H	α-helix	trans	-75.2	-25	179.7	0	0	0	0	0	114.8	A352 K353 R354 T359 G360 A361 F362	A352-G356 PolarHBondContact O-N 2.85Å; K353-G356 PolarHBondContact O-N 3.29Å; R354-G356 VanDerWaalsContact C-N 3.31Å; R354-G356 PolarHBondContact O-N 3.23Å; G356-T359 WeakPolarHBondContact CA-OG1 3.43Å; G356-G360 CarbonylContact O-C 3.58Å; G356-G360 PolarHBondContact O-N 3.01Å; G356-A361 PolarHBondContact O-N 3.43Å; G356-F362 PolarHBondContact O-N 2.92Å
357	Q	66.5	Low	57.9	Low	87 Å²	87	91.9 Å²	91.9	41%	0.407	51%	0.51	S	S	.	.	H	α-helix	trans	-71.3	-44.8	167.8	-73.5	-178.6	-53.3	0	0	110.8	K353 R354 T359 G360	K353-Q357 WeakPolarHBondContact O-CG 3.34Å; K353-Q357 PolarHBondContact O-N 2.75Å; R354-Q357 PolarHBondContact O-N 3.09Å; Q357-T359 VanDerWaalsContact C-N 3.32Å; Q357-T359 PolarHBondContact O-N 3.41Å; Q357-G360 PolarHBondContact O-N 3.31Å
358	D	63.2	Low	56.7	Low	127 Å²	127	92.2 Å²	92.2	68%	0.679	51%	0.51	S	S	*	.	H	α-helix	trans	-68.5	-30.1	-178.5	-65.4	-18.8	0	0	0	112.6	R354 V355	R354-D358 WeakPolarHBondContact O-CB 3.3Å; R354-D358 PolarHBondContact O-N 3.31Å; V355-D358 PolarHBondContact O-N 2.95Å
359	T	63.6	Low	55.6	Low	87 Å²	87	91 Å²	91	53%	0.534	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-3.4	177.5	55.1	0	0	0	0	113.9	V355 G356 Q357 A361	V355-T359 HydrophobicContact CG1-CG2 4.3Å; V355-T359 WeakPolarHBondContact O-CB 3.36Å; V355-T359 VanDerWaalsContact O-CG2 3.25Å; V355-T359 WeakPolarHBondContact O-CG2 3.35Å; V355-T359 PolarHBondContact O-N 2.76Å; V355-T359 PolarHBondContact O-OG1 2.88Å; G356-T359 WeakPolarHBondContact CA-OG1 3.43Å; Q357-T359 VanDerWaalsContact C-N 3.32Å; Q357-T359 PolarHBondContact O-N 3.41Å; T359-A361 PolarHBondContact O-N 2.95Å; T359-A361 WeakPolarHBondContact OG1-CB 3.18Å
360	G	55.3	Low	54.3	Low	62 Å²	62	96 Å²	96	64%	0.639	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	8.2	-172.6	0	0	0	0	0	114.4	G356 Q357 F362	G356-G360 CarbonylContact O-C 3.58Å; G356-G360 PolarHBondContact O-N 3.01Å; Q357-G360 PolarHBondContact O-N 3.31Å; G360-F362 VanDerWaalsContact C-N 3.25Å; G360-F362 PolarHBondContact O-N 3.47Å
361	A	42	Very low	53.1	Low	70 Å²	70	97 Å²	97	58%	0.579	53%	0.533	S	S	*	.			trans	-69.3	-21.5	178.6	0	0	0	0	0	113	G356 T359	G356-A361 PolarHBondContact O-N 3.43Å; T359-A361 PolarHBondContact O-N 2.95Å; T359-A361 WeakPolarHBondContact OG1-CB 3.18Å
362	F	47.4	Very low	51.7	Low	85 Å²	85	95.8 Å²	95.8	37%	0.373	54%	0.536	S	S	.	.	S	Bend	trans	-118.1	112.1	171.8	-57.8	-48	0	0	0	110.7	G356 G360 L366	G356-F362 PolarHBondContact O-N 2.92Å; G360-F362 VanDerWaalsContact C-N 3.25Å; G360-F362 PolarHBondContact O-N 3.47Å; F362-L366 HydrophobicContact CD1-CD1 4.38Å
363	A	43	Very low	50.6	Low	87 Å²	87	97 Å²	97	72%	0.719	54%	0.541	S	S	*	.			trans	-64.3	147.5	161.2	0	0	0	0	0	109.6	Q365	A363-Q365 PolarHBondContact O-N 2.99Å
364	D	43.4	Very low	49.4	Very low	143 Å²	143	94.7 Å²	94.7	77%	0.765	54%	0.54	S	S	*	.	S	Bend	trans	-59.9	20.9	-155.8	-122.6	-10.2	0	0	0	119.2
365	Q	44.5	Very low	47.9	Very low	180 Å²	180	93 Å²	93	84%	0.841	54%	0.542	S	S	*	.			trans	-144.6	47	-173.1	-67.8	-170.4	-11.8	0	0	114.3	A363 A367	A363-Q365 PolarHBondContact O-N 2.99Å; Q365-A367 PolarHBondContact O-N 3.49Å
366	L	39.7	Very low	47	Very low	92 Å²	92	96 Å²	96	48%	0.482	56%	0.561	S	S	.	*			trans	-72.5	98.8	170.7	-141.8	82.4	0	0	0	110.8	F362 M368	F362-L366 HydrophobicContact CD1-CD1 4.38Å; L366-M368 HydrophobicContact CD2-CB 4.26Å; L366-M368 HydrophobicContact CD2-CE 3.18Å; L366-M368 HydrophobicContact CD2-CG 3.63Å; L366-M368 HydrophobicContact CD2-SD 4.01Å; L366-M368 HydrophobicContact CG-CE 4.46Å; L366-M368 HydrophobicContact CG-CG 3.97Å; L366-M368 PolarHBondContact O-N 3.4Å
367	A	42.8	Very low	46.3	Very low	78 Å²	78	103.4 Å²	103.4	65%	0.645	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-66.6	21.3	175.7	0	0	0	0	0	114.8	Q365 H369	Q365-A367 PolarHBondContact O-N 3.49Å; A367-H369 PolarHBondContact O-N 2.9Å
368	M	41.3	Very low	45.4	Very low	119 Å²	119	106.8 Å²	106.8	59%	0.586	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-67.2	-12.8	175.4	-71.7	-147.4	-72.5	0	0	113	L366	L366-M368 HydrophobicContact CD2-CB 4.26Å; L366-M368 HydrophobicContact CD2-CE 3.18Å; L366-M368 HydrophobicContact CD2-CG 3.63Å; L366-M368 HydrophobicContact CD2-SD 4.01Å; L366-M368 HydrophobicContact CG-CE 4.46Å; L366-M368 HydrophobicContact CG-CG 3.97Å; L366-M368 PolarHBondContact O-N 3.4Å
369	H	42	Very low	44.5	Very low	115 Å²	115	112.2 Å²	112.2	53%	0.532	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-79.4	-12.9	-178.5	-119.5	-75.7	0	0	0	115.3	A367 P373	A367-H369 PolarHBondContact O-N 2.9Å; H369-P373 VanDerWaalsContact O-CD 3.23Å; H369-P373 WeakPolarHBondContact O-CD 3.46Å; H369-P373 WeakPolarHBondContact O-CG 3.27Å
370	K	45.1	Very low	43.4	Very low	186 Å²	186	111.5 Å²	111.5	81%	0.809	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-27.6	179.9	-77.8	-172.7	176.7	-178.9	0	113.6
371	T	44	Very low	42.7	Very low	90 Å²	90	113.7 Å²	113.7	55%	0.552	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-29.1	-173.4	-0.8	0	0	0	0	113.5	L375	T371-L375 PolarHBondContact O-N 3.44Å
372	A	36.8	Very low	42.5	Very low	51 Å²	51	119.1 Å²	119.1	42%	0.421	65%	0.65	S	S	.	*	H	α-helix	trans	-70.6	-39	-178.1	0	0	0	0	0	114.5	V376	A372-V376 WeakPolarHBondContact O-CG2 3.1Å
373	P	40.5	Very low	42	Very low	65 Å²	65	124 Å²	124	42%	0.422	67%	0.674	S	S	.	*	H	α-helix	trans	-72.2	-28.2	176	-17	31.6	0	0	0	113.3	H369 V376 Q377	H369-P373 VanDerWaalsContact O-CD 3.23Å; H369-P373 WeakPolarHBondContact O-CD 3.46Å; H369-P373 WeakPolarHBondContact O-CG 3.27Å; P373-V376 PolarHBondContact O-N 2.88Å; P373-Q377 PolarHBondContact O-N 3.43Å; P373-Q377 VanDerWaalsContact O-N 3.12Å
374	A	40.7	Very low	41.8	Very low	49 Å²	49	126.7 Å²	126.7	41%	0.405	68%	0.682	S	S	.	*	H	α-helix	trans	-69.4	-37.2	-179.8	0	0	0	0	0	112.2	V376 Q378	A374-V376 VanDerWaalsContact C-N 3.32Å; A374-V376 PolarHBondContact O-N 3.42Å; A374-Q378 VanDerWaalsContact O-CB 3.3Å; A374-Q378 WeakPolarHBondContact O-CB 3.34Å; A374-Q378 PolarHBondContact O-N 2.86Å; A374-Q378 VanDerWaalsContact O-N 3.11Å
375	L	38.8	Very low	41.7	Very low	125 Å²	125	127.2 Å²	127.2	65%	0.654	68%	0.683	S	S	*	*	H	α-helix	trans	-72.4	-22.8	176.3	-81.2	158.8	0	0	0	113.6	T371	T371-L375 PolarHBondContact O-N 3.44Å
376	V	45.9	Very low	41.3	Very low	114 Å²	114	123.3 Å²	123.3	69%	0.691	68%	0.675	S	S	*	*	H	α-helix	trans	-85.9	-29.7	176.6	177.6	0	0	0	0	111.8	A372 P373 A374	A372-V376 WeakPolarHBondContact O-CG2 3.1Å; P373-V376 PolarHBondContact O-N 2.88Å; A374-V376 VanDerWaalsContact C-N 3.32Å; A374-V376 PolarHBondContact O-N 3.42Å
377	Q	46.7	Very low	41.1	Very low	159 Å²	159	124.3 Å²	124.3	74%	0.743	69%	0.69	S	S	*	*	H	α-helix	trans	-84.3	-26.7	176	-86.3	178.5	-16.1	0	0	114.1	P373 R379 G380	P373-Q377 PolarHBondContact O-N 3.43Å; P373-Q377 VanDerWaalsContact O-N 3.12Å; Q377-R379 VanDerWaalsContact C-N 3.29Å; Q377-R379 PolarHBondContact O-N 3.14Å; Q377-G380 PolarHBondContact O-N 3.44Å
378	Q	47.1	Very low	40.9	Very low	158 Å²	158	124.8 Å²	124.8	74%	0.738	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-9.4	-174.3	-152.4	173.3	8.4	0	0	114.3	A374	A374-Q378 VanDerWaalsContact O-CB 3.3Å; A374-Q378 WeakPolarHBondContact O-CB 3.34Å; A374-Q378 PolarHBondContact O-N 2.86Å; A374-Q378 VanDerWaalsContact O-N 3.11Å
379	R	43.5	Very low	40.7	Very low	241 Å²	241	124.5 Å²	124.5	91%	0.909	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-1.1	176.2	-103.7	-177	-173.5	178	2	115	Q377	Q377-R379 VanDerWaalsContact C-N 3.29Å; Q377-R379 PolarHBondContact O-N 3.14Å
380	G	41.7	Very low	40.6	Very low	73 Å²	73	124.4 Å²	124.4	75%	0.753	72%	0.716	S	S	*	*	S	Bend	trans	-110.6	8	-175.1	0	0	0	0	0	116.1	Q377	Q377-G380 PolarHBondContact O-N 3.44Å
381	S	39.2	Very low	40.2	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	71%	0.714	S	S	*	*			trans	-136.7	57.6	-172.4	-154.4	0	0	0	0	112.7
382	E	38.6	Very low	40.2	Very low	183 Å²	183	122.6 Å²	122.6	86%	0.855	73%	0.725	S	S	*	*			trans	-128.7	69.6	165.1	-75.7	-172.3	163.4	0	0	109.1
383	Q	37.6	Very low	40.4	Very low	189 Å²	189	127.2 Å²	127.2	88%	0.883	74%	0.742	S	S	*	*			trans	-166.6	131.9	156.1	-110.2	165.4	41	0	0	109.9
384	T	38.3	Very low	40.7	Very low	143 Å²	143	132.4 Å²	132.4	88%	0.877	76%	0.76	S	S	*	*			trans	111.4	121.1	165.5	-29.5	0	0	0	0	116
385	I	40.1	Very low	40.7	Very low	153 Å²	153	140.5 Å²	140.5	79%	0.785	78%	0.78	S	S	*	*			trans	-86.5	162.4	-167	-66.4	150.5	0	0	0	110.7
386	S	36.1	Very low	40.9	Very low	98 Å²	98	141.6 Å²	141.6	69%	0.685	79%	0.787	S	S	*	*			trans	82.5	103.4	152.8	57.4	0	0	0	0	121
387	S	35.8	Very low	40.5	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	79%	0.79	S	S	*	*				71.7	139.5	122.4	57	0	0	0	0	123.1
388	A	38.7	Very low	40.3	Very low	87 Å²	87	138.9 Å²	138.9	72%	0.719	80%	0.796	S	S	*	*			trans	93.2	101.6	148.7	0	0	0	0	0	118.6
389	S	37.2	Very low	40.1	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	80%	0.798	S	S	*	*			trans	43.2	113.6	132.7	62	0	0	0	0	119
390	S	40.4	Very low	40	Very low	113 Å²	113	130.6 Å²	130.6	79%	0.79	79%	0.787	S	S	*	*				-168	126.2	127.1	-173.7	0	0	0	0	110.5
391	S	35.5	Very low	40.3	Very low	109 Å²	109	133.6 Å²	133.6	76%	0.762	79%	0.79	S	S	*	*			trans	-64.5	125.8	170.5	50.1	0	0	0	0	111.7
392	V	44.4	Very low	40.5	Very low	128 Å²	128	136.6 Å²	136.6	78%	0.776	79%	0.793	S	S	*	*			trans	-137.4	114	155.1	179.2	0	0	0	0	108.6	E394	V392-E394 PolarHBondContact O-N 3.26Å
393	L	42	Very low	41	Very low	149 Å²	149	135.7 Å²	135.7	78%	0.78	79%	0.793	S	S	*	*			trans	-51.3	118.7	162.2	-98.3	78.9	0	0	0	109.3
394	E	46.3	Very low	42	Very low	173 Å²	173	129 Å²	129	81%	0.808	78%	0.775	S	S	*	*			trans	-122.8	106	146	-81.3	-152.5	152.9	0	0	110.1	V392	V392-E394 PolarHBondContact O-N 3.26Å
395	R	40.4	Very low	43.4	Very low	220 Å²	220	129.9 Å²	129.9	83%	0.83	78%	0.775	S	S	*	*			trans	-79.3	105.4	171.1	177.4	-169.4	-121.2	152.5	-2.8	106.4
396	N	42.6	Very low	44.8	Very low	148 Å²	148	127.6 Å²	127.6	79%	0.791	76%	0.763	S	S	*	*			trans	-151.2	101.1	165.4	-89.2	-32.9	0	0	0	112.1
397	G	38.4	Very low	46.9	Very low	74 Å²	74	131.6 Å²	131.6	76%	0.763	77%	0.771	S	S	*	*			trans	56.8	71.5	141.7	0	0	0	0	0	119.1	T399	G397-T399 VanDerWaalsContact C-N 3.35Å; G397-T399 PolarHBondContact O-N 3.27Å
398	V	41.7	Very low	49.3	Very low	142 Å²	142	128 Å²	128	86%	0.861	74%	0.742	S	S	*	*			trans	-71.9	94.9	156.7	-178.1	0	0	0	0	107.3	S400	V398-S400 VanDerWaalsContact C-N 3.28Å; V398-S400 PolarHBondContact O-N 2.98Å
399	T	43.1	Very low	51.8	Low	127 Å²	127	124.2 Å²	124.2	78%	0.779	71%	0.711	S	S	*	*			trans	-61.2	99.9	154.9	27.4	0	0	0	0	106.3	G397 V401	G397-T399 VanDerWaalsContact C-N 3.35Å; G397-T399 PolarHBondContact O-N 3.27Å; T399-V401 VanDerWaalsContact C-N 3.31Å; T399-V401 PolarHBondContact O-N 2.94Å
400	S	42	Very low	54.4	Low	97 Å²	97	124.1 Å²	124.1	68%	0.678	71%	0.71	S	S	*	*			trans	-56.1	102.7	163.5	56	0	0	0	0	106.4	V398 Q402	V398-S400 VanDerWaalsContact C-N 3.28Å; V398-S400 PolarHBondContact O-N 2.98Å; S400-Q402 VanDerWaalsContact C-N 3.28Å; S400-Q402 PolarHBondContact O-N 3.1Å
401	V	47.5	Very low	56.9	Low	136 Å²	136	120 Å²	120	82%	0.824	68%	0.678	S	S	*	*			trans	-55.4	105.5	160.5	177.6	0	0	0	0	103.5	T399 D403	T399-V401 VanDerWaalsContact C-N 3.31Å; T399-V401 PolarHBondContact O-N 2.94Å; V401-D403 PolarHBondContact O-N 2.7Å; V401-D403 VanDerWaalsContact O-N 3.15Å
402	Q	44.4	Very low	59.7	Low	172 Å²	172	114.9 Å²	114.9	80%	0.804	64%	0.643	S	S	*	*			trans	-51.4	127.2	171.4	-76.2	-175.3	1.2	0	0	105.8	S400 G404	S400-Q402 VanDerWaalsContact C-N 3.28Å; S400-Q402 PolarHBondContact O-N 3.1Å; Q402-G404 PolarHBondContact O-N 2.94Å
403	D	49.1	Very low	62.1	Low	163 Å²	163	112.1 Å²	112.1	87%	0.872	62%	0.623	S	S	*	*			trans	-62.5	75.9	173.5	-152.6	11.5	0	0	0	106.4	V401 D405	V401-D403 PolarHBondContact O-N 2.7Å; V401-D403 VanDerWaalsContact O-N 3.15Å; D403-D405 PolarHBondContact O-N 3.5Å
404	G	58.6	Low	64.5	Low	49 Å²	49	109.5 Å²	109.5	51%	0.505	61%	0.61	S	S	.	*			trans	-69.1	115.5	178.7	0	0	0	0	0	105.5	Q402 I406	Q402-G404 PolarHBondContact O-N 2.94Å; G404-I406 PolarHBondContact O-N 2.87Å
405	D	66.4	Low	66.6	Low	162 Å²	162	102.3 Å²	102.3	87%	0.866	58%	0.579	S	S	*	*			trans	-42.5	106.6	174	-69.6	-39.3	0	0	0	108.3	D403 E407	D403-D405 PolarHBondContact O-N 3.5Å; D405-E407 PolarHBondContact O-N 3.33Å
406	I	69.9	Low	69.1	Low	104 Å²	104	94.5 Å²	94.5	53%	0.533	55%	0.553	S	S	.	*			trans	-65.2	103.3	-179.6	-64.6	173.4	0	0	0	105.6	G404 L408 V503	G404-I406 PolarHBondContact O-N 2.87Å; I406-L408 PolarHBondContact O-N 3.5Å; I406-V503 HydrophobicContact CB-CG1 4.08Å; I406-V503 HydrophobicContact CD1-CG1 4.48Å; I406-V503 HydrophobicContact CD1-CG2 4.07Å; I406-V503 HydrophobicContact CG2-CG1 4.17Å
407	E	80.1	Confident	71.5	Confident	182 Å²	182	88 Å²	88	85%	0.85	52%	0.518	S	S	*	.			trans	-64.3	105.6	-179.8	-168.7	177.1	-178.5	0	0	108.5	D405	D405-E407 PolarHBondContact O-N 3.33Å
408	L	87.5	Confident	74	Confident	38 Å²	38	90.9 Å²	90.9	20%	0.199	51%	0.512	C	S	.	.			trans	-68.5	152.7	173.5	-74	160.7	0	0	0	109.6	I406 S410 V503 K508 A509 T542	I406-L408 PolarHBondContact O-N 3.5Å; L408-S410 PolarHBondContact O-N 2.92Å; L408-V503 HydrophobicContact CD1-CG1 4.41Å; L408-V503 HydrophobicContact CD2-CG1 4.19Å; L408-V503 HydrophobicContact CG-CG1 4.32Å; L408-K508 HydrophobicContact CD1-CB 4.12Å; L408-A509 HydrophobicContact CD1-CB 4.35Å; L408-A509 HydrophobicContact CD2-CB 3.9Å; L408-T542 HydrophobicContact CD2-CG2 4.09Å
409	C	90.8	Very high	76.4	Confident	8 Å²	8	86 Å²	86	5%	0.054	48%	0.479	C	S	.	.			trans	-55.9	134.3	175.2	-42.5	0	0	0	0	110.2	Q411 C412 T540 C548	C409-Q411 HydrophobicContact CB-CG 3.78Å; C409-Q411 PolarHBondContact O-N 3.06Å; C409-Q411 VanDerWaalsContact O-N 3.08Å; C409-C412 WeakPolarHBondContact CB-SG 3.09Å; C409-C412 PolarHBondContact N-SG 2.93Å; C409-C412 WeakPolarHBondContact O-CB 3.46Å; C409-C412 PolarHBondContact O-N 3.1Å; C409-C412 PolarHBondContact O-SG 3.4Å; C409-T540 HydrophobicContact CB-CG2 4.32Å; C409-C548 WeakPolarHBondContact CA-SG 3.3Å; C409-C548 HydrophobicContact CB-CB 3.54Å; C409-C548 WeakPolarHBondContact CB-SG 2.96Å; C409-C548 WeakPolarHBondContact SG-CA 3.13Å; C409-C548 WeakPolarHBondContact SG-CB 3.19Å; C409-C548 CovalentContact SG-SG 2.02Å; C409-C548 PolarHBondContact SG-SG 3Å
410	S	91.6	Very high	78.8	Confident	112 Å²	112	79.9 Å²	79.9	78%	0.783	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.8	178.7	54.3	0	0	0	0	112.8	L408 C412	L408-S410 PolarHBondContact O-N 2.92Å; S410-C412 VanDerWaalsContact C-N 3.34Å; S410-C412 PolarHBondContact O-N 2.82Å
411	Q	92.4	Very high	81	Confident	26 Å²	26	76.3 Å²	76.3	12%	0.121	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.4	175.9	64.1	-165.2	21.7	0	0	115.4	C409 I413 V524 C548 H551 E576	C409-Q411 HydrophobicContact CB-CG 3.78Å; C409-Q411 PolarHBondContact O-N 3.06Å; C409-Q411 VanDerWaalsContact O-N 3.08Å; Q411-I413 PolarHBondContact O-N 3.1Å; Q411-V524 HydrophobicContact CB-CG1 4.42Å; Q411-V524 HydrophobicContact CG-CB 4.34Å; Q411-V524 HydrophobicContact CG-CG1 3.68Å; Q411-C548 PolarHBondContact NE2-O 3.24Å; Q411-H551 PolarHBondContact NE2-CE1 2.81Å; Q411-H551 VanDerWaalsContact NE2-CE1 3.26Å; Q411-E576 PolarHBondContact OE1-OE2 3.44Å
412	C	94.6	Very high	82.9	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.014	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-68.7	125.7	-179.2	-57.6	0	0	0	0	111.1	C409 S410 K508 C522 L523	C409-C412 WeakPolarHBondContact CB-SG 3.09Å; C409-C412 PolarHBondContact N-SG 2.93Å; C409-C412 WeakPolarHBondContact O-CB 3.46Å; C409-C412 PolarHBondContact O-N 3.1Å; C409-C412 PolarHBondContact O-SG 3.4Å; S410-C412 VanDerWaalsContact C-N 3.34Å; S410-C412 PolarHBondContact O-N 2.82Å; C412-K508 HydrophobicContact CB-CB 3.98Å; C412-K508 HydrophobicContact CB-CD 4.18Å; C412-K508 HydrophobicContact CB-CG 4.45Å; C412-K508 WeakPolarHBondContact O-CD 3.36Å; C412-K508 VanDerWaalsContact O-CE 3.3Å; C412-K508 WeakPolarHBondContact O-CE 3.46Å; C412-K508 PolarHBondContact O-NZ 2.74Å; C412-C522 HydrophobicContact CB-CB 3.66Å; C412-C522 WeakPolarHBondContact CB-SG 3.45Å; C412-C522 WeakPolarHBondContact SG-CB 3.4Å; C412-C522 CovalentContact SG-SG 2.02Å; C412-C522 PolarHBondContact SG-SG 3.4Å; C412-L523 CarbonylContact C-O 3.55Å; C412-L523 WeakPolarHBondContact CA-O 3.08Å
413	I	94.4	Very high	85	Confident	71 Å²	71	62.6 Å²	62.6	36%	0.364	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-100.8	162.7	173.2	62.6	167.3	0	0	0	111	Q411 L523	Q411-I413 PolarHBondContact O-N 3.1Å; I413-L523 HydrophobicContact CD1-CD2 3.71Å; I413-L523 HydrophobicContact CD1-CG 3.95Å; I413-L523 HydrophobicContact CG1-CB 4.1Å; I413-L523 HydrophobicContact CG1-CD2 3.81Å; I413-L523 HydrophobicContact CG1-CG 3.79Å; I413-L523 WeakPolarHBondContact CG1-O 3.32Å; I413-L523 PolarHBondContact N-O 3.14Å
414	N	93.1	Very high	87	Confident	94 Å²	94	54.9 Å²	54.9	50%	0.503	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-68.7	135.2	176.4	-64.3	-13.1	0	0	0	109.6	H506 K508	N414-H506 PolarHBondContact OD1-O 3.09Å; N414-H506 VanDerWaalsContact OD1-O 3.1Å; N414-K508 WeakPolarHBondContact OD1-CE 3.33Å; N414-K508 WeakPolarHBondContact OD1-CG 3.49Å
415	S	91	Very high	88.3	Confident	22 Å²	22	52.7 Å²	52.7	15%	0.154	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-88.2	138.2	177.9	57.9	0	0	0	0	111.5	G507 L510	S415-G507 PolarHBondContact N-O 2.94Å; S415-G507 PolarHBondContact OG-O 3.46Å; S415-L510 WeakPolarHBondContact OG-CD2 3.13Å
416	D	92.3	Very high	89.3	Confident	56 Å²	56	45.5 Å²	45.5	30%	0.299	24%	0.241	S	C	.	.			trans	-103.1	97	165.9	-173.8	-18.3	0	0	0	107.6	E418 K419 M420 Y534	D416-E418 PolarHBondContact O-N 3.23Å; D416-E418 WeakPolarHBondContact OD1-CB 3.48Å; D416-E418 PolarHBondContact OD1-N 3.1Å; D416-E418 VanDerWaalsContact OD1-N 3.08Å; D416-K419 HydrophobicContact CB-CB 4.25Å; D416-K419 HydrophobicContact CB-CD 4.16Å; D416-K419 HydrophobicContact CB-CG 4.15Å; D416-K419 PolarHBondContact O-N 3.18Å; D416-K419 WeakPolarHBondContact OD2-CD 3.3Å; D416-K419 WeakPolarHBondContact OD2-CE 3.41Å; D416-K419 WeakPolarHBondContact OD2-CG 3.39Å; D416-M420 WeakPolarHBondContact O-CG 3.29Å; D416-M420 PolarHBondContact O-N 2.81Å; D416-Y534 HydrophobicContact CB-CE2 4.3Å; D416-Y534 WeakPolarHBondContact CB-OH 3.13Å
417	L	91.9	Very high	89.9	Confident	10 Å²	10	40.5 Å²	40.5	5%	0.052	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.6	-176.8	-65.4	-177	0	0	0	112.4	K419 M420 H472 S474 I497 Q499 L510	L417-K419 VanDerWaalsContact C-N 3.33Å; L417-M420 HydrophobicContact CD2-SD 4.1Å; L417-M420 PolarHBondContact O-N 3.06Å; L417-H472 VanDerWaalsContact CD1-CA 3.5Å; L417-S474 PolarHBondContact O-OG 2.73Å; L417-I497 HydrophobicContact CD2-CG2 4.11Å; L417-Q499 HydrophobicContact CD1-CB 4.07Å; L417-L510 HydrophobicContact CD2-CD2 3.99Å
418	E	91.4	Very high	90	Very high	136 Å²	136	33.7 Å²	33.7	64%	0.636	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-37.4	178.5	-57.3	-169.7	166.2	0	0	110.7	D416 M420 P469	D416-E418 PolarHBondContact O-N 3.23Å; D416-E418 WeakPolarHBondContact OD1-CB 3.48Å; D416-E418 PolarHBondContact OD1-N 3.1Å; D416-E418 VanDerWaalsContact OD1-N 3.08Å; E418-M420 VanDerWaalsContact C-N 3.29Å; E418-M420 PolarHBondContact O-N 3.35Å; E418-P469 HydrophobicContact CB-CG 4.06Å; E418-P469 HydrophobicContact CG-CB 4.24Å; E418-P469 HydrophobicContact CG-CG 3.83Å
419	K	93.1	Very high	89.6	Confident	38 Å²	38	31.9 Å²	31.9	17%	0.165	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-18.2	176.8	-65.2	-172.4	-176.4	-156	0	114	D416 L417 S529 G531 Y534 R556	D416-K419 HydrophobicContact CB-CB 4.25Å; D416-K419 HydrophobicContact CB-CD 4.16Å; D416-K419 HydrophobicContact CB-CG 4.15Å; D416-K419 PolarHBondContact O-N 3.18Å; D416-K419 WeakPolarHBondContact OD2-CD 3.3Å; D416-K419 WeakPolarHBondContact OD2-CE 3.41Å; D416-K419 WeakPolarHBondContact OD2-CG 3.39Å; L417-K419 VanDerWaalsContact C-N 3.33Å; K419-S529 PolarHBondContact NZ-O 3.31Å; K419-G531 VanDerWaalsContact CE-O 3.29Å; K419-G531 WeakPolarHBondContact CE-O 3.44Å; K419-G531 PolarHBondContact NZ-O 3.41Å; K419-Y534 HydrophobicContact CB-CD1 4.22Å; K419-Y534 HydrophobicContact CB-CD2 3.51Å; K419-Y534 HydrophobicContact CB-CE1 4.2Å; K419-Y534 HydrophobicContact CB-CE2 3.48Å; K419-Y534 VanDerWaalsContact CB-CE2 3.48Å; K419-Y534 HydrophobicContact CB-CG 3.89Å; K419-Y534 HydrophobicContact CD-CD1 4.15Å; K419-Y534 HydrophobicContact CD-CE1 3.64Å; K419-Y534 HydrophobicContact CD-CE2 4.25Å; K419-Y534 HydrophobicContact CG-CE2 4.46Å; K419-Y534 PolarHBondContact O-N 2.95Å; K419-Y534 VanDerWaalsContact O-N 3.14Å; K419-R556 PolarHBondContact O-NH2 3.46Å
420	M	92.3	Very high	88.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.6	-179.6	-69.3	-178.6	177.8	0	0	114.1	D416 L417 E418 G422 W424 I497 L510 L523 Y534 M537	D416-M420 WeakPolarHBondContact O-CG 3.29Å; D416-M420 PolarHBondContact O-N 2.81Å; L417-M420 HydrophobicContact CD2-SD 4.1Å; L417-M420 PolarHBondContact O-N 3.06Å; E418-M420 VanDerWaalsContact C-N 3.29Å; E418-M420 PolarHBondContact O-N 3.35Å; M420-G422 PolarHBondContact O-N 2.87Å; M420-W424 PolarHBondContact O-NE1 2.91Å; M420-I497 HydrophobicContact CB-CD1 4.42Å; M420-L510 HydrophobicContact CE-CD1 4.28Å; M420-L510 HydrophobicContact SD-CD1 4.37Å; M420-L523 HydrophobicContact CE-CB 4.21Å; M420-L523 HydrophobicContact CE-CD1 3.74Å; M420-L523 HydrophobicContact CE-CD2 3.5Å; M420-L523 VanDerWaalsContact CE-CD2 3.5Å; M420-L523 HydrophobicContact CE-CG 4.02Å; M420-Y534 HydrophobicContact CE-CE2 4.25Å; M420-Y534 HydrophobicContact CG-CD2 3.94Å; M420-Y534 HydrophobicContact CG-CE2 4.11Å; M420-M537 HydrophobicContact CG-SD 4.38Å
421	V	89.2	Confident	87.1	Confident	21 Å²	21	28.7 Å²	28.7	13%	0.127	15%	0.151	C	C	.	.			trans	-64.4	126	-177.2	-180	0	0	0	0	110.6	F466 P469 S474 R556	V421-F466 HydrophobicContact CG1-CB 3.69Å; V421-F466 HydrophobicContact CG1-CD1 4.15Å; V421-F466 HydrophobicContact CG1-CG 3.86Å; V421-P469 HydrophobicContact CG2-CB 3.61Å; V421-P469 HydrophobicContact CG2-CG 3.77Å; V421-S474 VanDerWaalsContact CA-OG 3.3Å; V421-S474 WeakPolarHBondContact CA-OG 3.18Å; V421-S474 WeakPolarHBondContact CG2-OG 3.41Å; V421-S474 PolarHBondContact N-OG 2.71Å; V421-R556 VanDerWaalsContact O-CZ 3.24Å; V421-R556 PolarHBondContact O-NH1 3.3Å; V421-R556 PolarHBondContact O-NH2 2.87Å
422	G	86.8	Confident	85.7	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.3	-163.6	165.8	0	0	0	0	0	115.4	M420 F466 E477	M420-G422 PolarHBondContact O-N 2.87Å; G422-F466 VanDerWaalsContact C-CZ 3.41Å; G422-F466 VanDerWaalsContact CA-CE1 3.47Å; G422-E477 PolarHBondContact O-N 2.85Å; G422-E477 VanDerWaalsContact O-N 3.1Å
423	P	87.9	Confident	84.4	Confident	21 Å²	21	32.4 Å²	32.4	14%	0.136	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	143.2	175.5	32.7	-30.2	0	0	0	111.2	F466 M479	P423-F466 VanDerWaalsContact CD-CZ 3.46Å; P423-F466 HydrophobicContact CG-CZ 4.4Å; P423-M479 HydrophobicContact CB-CE 3.34Å; P423-M479 HydrophobicContact CG-CE 4.28Å
424	W	91.8	Very high	83	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.8	-178.7	-67.4	98.1	0	0	0	109.6	M420 M476 E477 I478 M479 Y534 M537 F554 R556	M420-W424 PolarHBondContact O-NE1 2.91Å; W424-M476 HydrophobicContact CB-CE 3.59Å; W424-M476 HydrophobicContact CG-CE 3.86Å; W424-M476 HydrophobicContact CG-CG 4.3Å; W424-E477 PolarHBondContact N-O 2.96Å; W424-E477 VanDerWaalsContact O-O 3.1Å; W424-I478 WeakPolarHBondContact O-CA 3.31Å; W424-M479 PolarHBondContact O-N 3.08Å; W424-M479 VanDerWaalsContact O-N 3.14Å; W424-Y534 WeakPolarHBondContact CH2-O 3.42Å; W424-M537 HydrophobicContact CB-CE 4.38Å; W424-M537 HydrophobicContact CD2-CE 3.35Å; W424-M537 HydrophobicContact CD2-SD 4.17Å; W424-M537 HydrophobicContact CE3-CE 3.75Å; W424-M537 HydrophobicContact CE3-CG 4.15Å; W424-M537 HydrophobicContact CE3-SD 4.29Å; W424-M537 HydrophobicContact CG-CE 3.64Å; W424-M537 HydrophobicContact CH2-CB 4.44Å; W424-M537 HydrophobicContact CH2-CE 4.36Å; W424-M537 HydrophobicContact CH2-CG 4Å; W424-M537 HydrophobicContact CH2-SD 3.89Å; W424-M537 HydrophobicContact CZ2-CE 4.04Å; W424-M537 HydrophobicContact CZ2-CG 4.46Å; W424-M537 HydrophobicContact CZ2-SD 3.76Å; W424-M537 HydrophobicContact CZ3-CB 4.49Å; W424-M537 HydrophobicContact CZ3-CE 4.23Å; W424-M537 HydrophobicContact CZ3-CG 3.83Å; W424-M537 HydrophobicContact CZ3-SD 4.16Å; W424-F554 HydrophobicContact CB-CB 4.37Å; W424-F554 HydrophobicContact CB-CD1 4.32Å; W424-F554 HydrophobicContact CD2-CB 4.44Å; W424-F554 HydrophobicContact CE3-CB 3.84Å; W424-R556 HydrophobicContact CD2-CG 4.5Å; W424-R556 HydrophobicContact CE3-CG 4.14Å; W424-R556 HydrophobicContact CH2-CG 4.1Å; W424-R556 HydrophobicContact CZ2-CG 4.44Å; W424-R556 HydrophobicContact CZ3-CG 3.94Å
425	T	86.3	Confident	81.7	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.8	170.5	-59.8	0	0	0	0	107.7	I427 F554 A555 C594	T425-I427 HydrophobicContact CG2-CD1 4.21Å; T425-I427 PolarHBondContact O-N 2.78Å; T425-F554 CarbonylContact O-C 3.6Å; T425-F554 WeakPolarHBondContact O-CA 3.4Å; T425-A555 PolarHBondContact N-O 3.06Å; T425-A555 PolarHBondContact O-N 2.99Å; T425-C594 HydrophobicContact CG2-CB 3.45Å; T425-C594 VanDerWaalsContact CG2-CB 3.45Å; T425-C594 PolarHBondContact OG1-O 3.47Å
426	Q	86.7	Confident	80.5	Confident	11 Å²	11	37.1 Å²	37.1	5%	0.051	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	124.6	173.3	-163.8	175.7	-12.8	0	0	109.2	Y428 L434 H552 V553 F554 L588	Q426-Y428 PolarHBondContact NE2-O 3.46Å; Q426-L434 VanDerWaalsContact CD-CD2 3.43Å; Q426-L434 HydrophobicContact CG-CD2 4.48Å; Q426-L434 VanDerWaalsContact NE2-CD2 3.31Å; Q426-L434 VanDerWaalsContact OE1-CD2 3.25Å; Q426-H552 PolarHBondContact NE2-ND1 2.88Å; Q426-V553 CarbonylContact C-O 3.55Å; Q426-F554 HydrophobicContact CB-CD1 3.72Å; Q426-F554 HydrophobicContact CB-CE1 3.54Å; Q426-F554 HydrophobicContact CB-CZ 4.32Å; Q426-F554 HydrophobicContact CG-CD1 3.98Å; Q426-F554 HydrophobicContact CG-CE1 3.63Å; Q426-F554 HydrophobicContact CG-CE2 4.5Å; Q426-F554 HydrophobicContact CG-CZ 3.91Å; Q426-L588 VanDerWaalsContact O-CD1 3.3Å; Q426-L588 WeakPolarHBondContact O-CD1 3.2Å
427	I	83.6	Confident	79.1	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-45.9	-179.7	-50.4	-59.6	0	0	0	110.3	T425 V553 A555 A558 F561 P591	T425-I427 HydrophobicContact CG2-CD1 4.21Å; T425-I427 PolarHBondContact O-N 2.78Å; I427-V553 HydrophobicContact CB-CG1 4.4Å; I427-V553 PolarHBondContact N-O 3.34Å; I427-A555 HydrophobicContact CD1-CB 4.15Å; I427-A555 HydrophobicContact CG1-CB 3.86Å; I427-A558 HydrophobicContact CD1-CB 3.88Å; I427-F561 HydrophobicContact CB-CE1 4.46Å; I427-F561 HydrophobicContact CG1-CD1 4.14Å; I427-F561 HydrophobicContact CG1-CE1 4.38Å; I427-F561 HydrophobicContact CG1-CG 4.37Å; I427-F561 HydrophobicContact CG2-CD1 4.12Å; I427-F561 HydrophobicContact CG2-CE1 3.93Å; I427-P591 HydrophobicContact CG2-CB 4.47Å
428	Y	82.6	Confident	77.8	Confident	39 Å²	39	37.8 Å²	37.8	15%	0.153	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.3	180	-52.9	-77.4	0	0	0	110.6	Q426 H552 V553 F561 A587	Q426-Y428 PolarHBondContact NE2-O 3.46Å; Y428-H552 WeakPolarHBondContact O-CA 3.44Å; Y428-V553 HydrophobicContact CD2-CB 3.86Å; Y428-V553 HydrophobicContact CD2-CG1 4.12Å; Y428-V553 HydrophobicContact CD2-CG2 3.97Å; Y428-V553 HydrophobicContact CG-CB 4.45Å; Y428-V553 HydrophobicContact CG-CG2 4.48Å; Y428-V553 PolarHBondContact N-O 2.9Å; Y428-V553 PolarHBondContact O-N 2.88Å; Y428-F561 AromaticContact CE2-CE1 3.98Å; Y428-F561 HydrophobicContact CE2-CE1 3.98Å; Y428-F561 HydrophobicContact CE2-CZ 4.37Å; Y428-A587 HydrophobicContact CD1-CB 4.05Å; Y428-A587 HydrophobicContact CE1-CB 3.98Å
429	G	78	Confident	76.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171	172.2	176	0	0	0	0	0	114.3	A431 M585	G429-A431 PolarHBondContact O-N 2.83Å; G429-M585 VanDerWaalsContact CA-CE 3.49Å; G429-M585 VanDerWaalsContact N-CE 3.33Å
430	N	70	Confident	74.6	Confident	22 Å²	22	33.3 Å²	33.3	12%	0.118	17%	0.174	C	C	.	.			trans	-68.6	123.3	168.5	-177.6	-31.4	0	0	0	110.7	N432 A433 L434 S550	N430-N432 PolarHBondContact O-N 3.18Å; N430-N432 VanDerWaalsContact O-N 3.14Å; N430-N432 WeakPolarHBondContact OD1-CB 3.39Å; N430-N432 PolarHBondContact OD1-N 3.28Å; N430-A433 HydrophobicContact CB-CB 4.25Å; N430-A433 PolarHBondContact O-N 3.42Å; N430-A433 VanDerWaalsContact O-N 3.12Å; N430-L434 WeakPolarHBondContact O-CB 3.44Å; N430-L434 WeakPolarHBondContact O-CG 3.1Å; N430-L434 PolarHBondContact O-N 3.15Å; N430-S550 WeakPolarHBondContact CB-OG 3.37Å; N430-S550 PolarHBondContact ND2-OG 2.79Å
431	A	59.8	Low	73.1	Confident	31 Å²	31	33.8 Å²	33.8	26%	0.256	18%	0.176	S	C	.	.	H	α-helix	trans	-54.8	-32.8	-179.1	0	0	0	0	0	113.3	G429 K435	G429-A431 PolarHBondContact O-N 2.83Å; A431-K435 VanDerWaalsContact O-CB 3.27Å; A431-K435 WeakPolarHBondContact O-CB 3.29Å; A431-K435 WeakPolarHBondContact O-CG 3.38Å; A431-K435 PolarHBondContact O-N 2.91Å
432	N	63.8	Low	71.5	Confident	96 Å²	96	35.3 Å²	35.3	51%	0.513	19%	0.188	S	C	.	.	H	α-helix	trans	-73.8	-41.9	178.5	-71.9	-24.8	0	0	0	112.4	N430 K435 K436	N430-N432 PolarHBondContact O-N 3.18Å; N430-N432 VanDerWaalsContact O-N 3.14Å; N430-N432 WeakPolarHBondContact OD1-CB 3.39Å; N430-N432 PolarHBondContact OD1-N 3.28Å; N432-K435 PolarHBondContact O-N 2.97Å; N432-K436 WeakPolarHBondContact O-CG 3.39Å; N432-K436 PolarHBondContact O-N 2.98Å
433	A	65.8	Low	70.1	Confident	10 Å²	10	37.6 Å²	37.6	8%	0.083	20%	0.204	C	C	.	.	H	α-helix	trans	-69.1	-38.4	174.9	0	0	0	0	0	110.9	N430 K436 L437 E541	N430-A433 HydrophobicContact CB-CB 4.25Å; N430-A433 PolarHBondContact O-N 3.42Å; N430-A433 VanDerWaalsContact O-N 3.12Å; A433-K436 PolarHBondContact O-N 3.39Å; A433-L437 VanDerWaalsContact O-CB 3.31Å; A433-L437 WeakPolarHBondContact O-CB 3.44Å; A433-L437 PolarHBondContact O-N 3.14Å; A433-E541 WeakPolarHBondContact CB-OE1 3.35Å
434	L	65.6	Low	68.5	Low	10 Å²	10	37.3 Å²	37.3	5%	0.052	20%	0.202	C	C	.	.	H	α-helix	trans	-57.8	-51.2	169.1	-76	171	0	0	0	110.9	Q426 N430 K436 L437 Y438 L588	Q426-L434 VanDerWaalsContact CD-CD2 3.43Å; Q426-L434 HydrophobicContact CG-CD2 4.48Å; Q426-L434 VanDerWaalsContact NE2-CD2 3.31Å; Q426-L434 VanDerWaalsContact OE1-CD2 3.25Å; N430-L434 WeakPolarHBondContact O-CB 3.44Å; N430-L434 WeakPolarHBondContact O-CG 3.1Å; N430-L434 PolarHBondContact O-N 3.15Å; L434-K436 VanDerWaalsContact C-N 3.29Å; L434-K436 PolarHBondContact O-N 2.86Å; L434-L437 CarbonylContact O-C 3.55Å; L434-L437 WeakPolarHBondContact O-CB 3.46Å; L434-L437 PolarHBondContact O-N 2.85Å; L434-L437 VanDerWaalsContact O-N 3.09Å; L434-Y438 HydrophobicContact CB-CD2 4.35Å; L434-Y438 HydrophobicContact CD2-CE2 4.18Å; L434-Y438 WeakPolarHBondContact O-CB 3.47Å; L434-Y438 WeakPolarHBondContact O-CD2 3.3Å; L434-Y438 PolarHBondContact O-N 2.88Å; L434-L588 HydrophobicContact CD1-CD2 3.95Å; L434-L588 HydrophobicContact CD2-CD2 4.39Å
435	K	65.1	Low	66.7	Low	144 Å²	144	38.5 Å²	38.5	63%	0.626	21%	0.21	S	C	*	.	H	α-helix	trans	-56.9	-40.7	176	-81.4	174.3	-178.8	-177.7	0	112.3	A431 N432 A439	A431-K435 VanDerWaalsContact O-CB 3.27Å; A431-K435 WeakPolarHBondContact O-CB 3.29Å; A431-K435 WeakPolarHBondContact O-CG 3.38Å; A431-K435 PolarHBondContact O-N 2.91Å; N432-K435 PolarHBondContact O-N 2.97Å; K435-A439 WeakPolarHBondContact O-CB 3.41Å; K435-A439 PolarHBondContact O-N 3.11Å
436	K	66.1	Low	65.1	Low	131 Å²	131	44 Å²	44	57%	0.57	24%	0.236	S	C	*	.	H	α-helix	trans	-66.1	-42.2	175.1	-74.1	176.2	-178.1	178.3	0	111.9	N432 A433 L434 A439 T440 F517	N432-K436 WeakPolarHBondContact O-CG 3.39Å; N432-K436 PolarHBondContact O-N 2.98Å; A433-K436 PolarHBondContact O-N 3.39Å; L434-K436 VanDerWaalsContact C-N 3.29Å; L434-K436 PolarHBondContact O-N 2.86Å; K436-A439 PolarHBondContact O-N 3.39Å; K436-T440 WeakPolarHBondContact O-CB 3.48Å; K436-T440 PolarHBondContact O-N 2.7Å; K436-T440 PolarHBondContact O-OG1 3.05Å; K436-F517 HydrophobicContact CB-CE2 4.19Å; K436-F517 HydrophobicContact CD-CE2 4.43Å
437	L	64.2	Low	63.1	Low	13 Å²	13	48.3 Å²	48.3	7%	0.068	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-49.9	177.4	-171.2	142.2	0	0	0	110.3	A433 L434 T440 L441 I478 L514	A433-L437 VanDerWaalsContact O-CB 3.31Å; A433-L437 WeakPolarHBondContact O-CB 3.44Å; A433-L437 PolarHBondContact O-N 3.14Å; L434-L437 CarbonylContact O-C 3.55Å; L434-L437 WeakPolarHBondContact O-CB 3.46Å; L434-L437 PolarHBondContact O-N 2.85Å; L434-L437 VanDerWaalsContact O-N 3.09Å; L437-T440 WeakPolarHBondContact O-CB 3.33Å; L437-T440 PolarHBondContact O-N 3.06Å; L437-L441 HydrophobicContact CD2-CD1 3.57Å; L437-L441 HydrophobicContact CG-CD1 4.49Å; L437-L441 VanDerWaalsContact O-CG 3.24Å; L437-L441 WeakPolarHBondContact O-CG 3.29Å; L437-L441 PolarHBondContact O-N 3.45Å; L437-I478 HydrophobicContact CD1-CD1 4.16Å; L437-L514 HydrophobicContact CD1-CD1 3.58Å; L437-L514 HydrophobicContact CG-CD1 4.11Å
438	Y	64.3	Low	61.3	Low	68 Å²	68	50.1 Å²	50.1	27%	0.267	27%	0.268	S	S	.	.	H	α-helix	trans	-62.8	-42.2	173.8	-79.8	-71.8	0	0	0	113	L434 T440 L441 S442 F480 L588	L434-Y438 HydrophobicContact CB-CD2 4.35Å; L434-Y438 HydrophobicContact CD2-CE2 4.18Å; L434-Y438 WeakPolarHBondContact O-CB 3.47Å; L434-Y438 WeakPolarHBondContact O-CD2 3.3Å; L434-Y438 PolarHBondContact O-N 2.88Å; Y438-T440 VanDerWaalsContact C-N 3.28Å; Y438-T440 PolarHBondContact O-N 3.43Å; Y438-L441 HydrophobicContact CD1-CD1 4.25Å; Y438-L441 CarbonylContact O-C 3.5Å; Y438-L441 WeakPolarHBondContact O-CA 3.44Å; Y438-L441 WeakPolarHBondContact O-CB 3.26Å; Y438-L441 PolarHBondContact O-N 3.1Å; Y438-L441 VanDerWaalsContact O-N 3.1Å; Y438-S442 PolarHBondContact O-N 2.76Å; Y438-S442 PolarHBondContact O-OG 3.12Å; Y438-S442 VanDerWaalsContact O-OG 3.12Å; Y438-F480 HydrophobicContact CD1-CD2 4.37Å; Y438-F480 HydrophobicContact CE1-CB 4.21Å; Y438-F480 AromaticContact CE1-CD2 3.87Å; Y438-F480 HydrophobicContact CE1-CD2 3.87Å; Y438-F480 HydrophobicContact CE1-CG 4.29Å; Y438-L588 HydrophobicContact CE2-CD2 4.33Å
439	A	57.9	Low	59.8	Low	59 Å²	59	54.5 Å²	54.5	49%	0.488	29%	0.294	S	S	.	.	H	α-helix	trans	-63.9	-36.7	175.9	0	0	0	0	0	111.7	K435 K436 L441 S443	K435-A439 WeakPolarHBondContact O-CB 3.41Å; K435-A439 PolarHBondContact O-N 3.11Å; K436-A439 PolarHBondContact O-N 3.39Å; A439-L441 VanDerWaalsContact C-N 3.33Å; A439-S443 VanDerWaalsContact O-CB 3.26Å; A439-S443 WeakPolarHBondContact O-CB 3.35Å; A439-S443 PolarHBondContact O-N 2.95Å; A439-S443 PolarHBondContact O-OG 3.26Å
440	T	59.4	Low	58.4	Low	21 Å²	21	64.3 Å²	64.3	13%	0.129	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-45.1	172.3	-54.9	0	0	0	0	109.9	K436 L437 Y438 S443 V444 P515 N516 F517	K436-T440 WeakPolarHBondContact O-CB 3.48Å; K436-T440 PolarHBondContact O-N 2.7Å; K436-T440 PolarHBondContact O-OG1 3.05Å; L437-T440 WeakPolarHBondContact O-CB 3.33Å; L437-T440 PolarHBondContact O-N 3.06Å; Y438-T440 VanDerWaalsContact C-N 3.28Å; Y438-T440 PolarHBondContact O-N 3.43Å; T440-S443 PolarHBondContact O-N 2.9Å; T440-S443 PolarHBondContact O-OG 3.48Å; T440-V444 WeakPolarHBondContact O-CB 3.4Å; T440-V444 VanDerWaalsContact O-CG2 3.24Å; T440-V444 WeakPolarHBondContact O-CG2 3.21Å; T440-V444 PolarHBondContact O-N 2.92Å; T440-P515 WeakPolarHBondContact CG2-O 3.18Å; T440-N516 HydrophobicContact CG2-CB 4.47Å; T440-F517 HydrophobicContact CG2-CB 4.19Å
441	L	60.5	Low	57.1	Low	9 Å²	9	66.6 Å²	66.6	5%	0.047	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-47.6	176.9	-70.3	166	0	0	0	113	L437 Y438 A439 V444 S445 F480 L493	L437-L441 HydrophobicContact CD2-CD1 3.57Å; L437-L441 HydrophobicContact CG-CD1 4.49Å; L437-L441 VanDerWaalsContact O-CG 3.24Å; L437-L441 WeakPolarHBondContact O-CG 3.29Å; L437-L441 PolarHBondContact O-N 3.45Å; Y438-L441 HydrophobicContact CD1-CD1 4.25Å; Y438-L441 CarbonylContact O-C 3.5Å; Y438-L441 WeakPolarHBondContact O-CA 3.44Å; Y438-L441 WeakPolarHBondContact O-CB 3.26Å; Y438-L441 PolarHBondContact O-N 3.1Å; Y438-L441 VanDerWaalsContact O-N 3.1Å; A439-L441 VanDerWaalsContact C-N 3.33Å; L441-V444 CarbonylContact O-C 3.58Å; L441-V444 WeakPolarHBondContact O-CB 3.49Å; L441-V444 PolarHBondContact O-N 2.94Å; L441-S445 PolarHBondContact O-N 2.84Å; L441-F480 HydrophobicContact CB-CE1 4.49Å; L441-F480 HydrophobicContact CB-CE2 4.08Å; L441-F480 HydrophobicContact CB-CZ 3.77Å; L441-F480 HydrophobicContact CD1-CD1 3.62Å; L441-F480 HydrophobicContact CD1-CD2 3.93Å; L441-F480 HydrophobicContact CD1-CE1 3.35Å; L441-F480 HydrophobicContact CD1-CE2 3.63Å; L441-F480 HydrophobicContact CD1-CG 3.92Å; L441-F480 HydrophobicContact CD1-CZ 3.34Å; L441-F480 HydrophobicContact CD2-CD1 4.35Å; L441-F480 HydrophobicContact CD2-CE1 3.32Å; L441-F480 HydrophobicContact CD2-CE2 4.33Å; L441-F480 HydrophobicContact CD2-CZ 3.29Å; L441-F480 HydrophobicContact CG-CE1 3.83Å; L441-F480 HydrophobicContact CG-CE2 4.19Å; L441-F480 HydrophobicContact CG-CZ 3.6Å; L441-L493 HydrophobicContact CD2-CB 3.9Å; L441-L493 HydrophobicContact CD2-CD1 3.49Å; L441-L493 VanDerWaalsContact CD2-CD1 3.49Å; L441-L493 HydrophobicContact CD2-CD2 3.6Å; L441-L493 HydrophobicContact CD2-CG 3.84Å; L441-L493 HydrophobicContact CG-CD2 4.21Å
442	S	56	Low	56.2	Low	54 Å²	54	74.9 Å²	74.9	38%	0.378	38%	0.379	S	S	.	.	H	α-helix	trans	-63.9	-42	176.5	-59.8	0	0	0	0	111.2	Y438 V444 S445 E446	Y438-S442 PolarHBondContact O-N 2.76Å; Y438-S442 PolarHBondContact O-OG 3.12Å; Y438-S442 VanDerWaalsContact O-OG 3.12Å; S442-V444 PolarHBondContact O-N 2.86Å; S442-S445 CarbonylContact O-C 3.6Å; S442-S445 WeakPolarHBondContact O-CB 3.47Å; S442-S445 PolarHBondContact O-N 3.19Å; S442-S445 VanDerWaalsContact O-N 3.14Å; S442-E446 WeakPolarHBondContact O-CB 3.16Å; S442-E446 WeakPolarHBondContact O-CG 3.29Å; S442-E446 PolarHBondContact O-N 2.94Å
443	S	56.8	Low	55	Low	47 Å²	47	73.7 Å²	73.7	33%	0.329	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-34.1	176.5	73.9	0	0	0	0	112	A439 T440 L447	A439-S443 VanDerWaalsContact O-CB 3.26Å; A439-S443 WeakPolarHBondContact O-CB 3.35Å; A439-S443 PolarHBondContact O-N 2.95Å; A439-S443 PolarHBondContact O-OG 3.26Å; T440-S443 PolarHBondContact O-N 2.9Å; T440-S443 PolarHBondContact O-OG 3.48Å; S443-L447 VanDerWaalsContact O-CB 3.25Å; S443-L447 WeakPolarHBondContact O-CB 3.33Å; S443-L447 WeakPolarHBondContact O-CD1 3.29Å; S443-L447 WeakPolarHBondContact O-CG 3.44Å; S443-L447 PolarHBondContact O-N 3.2Å
444	V	55.1	Low	53.6	Low	16 Å²	16	75.7 Å²	75.7	10%	0.097	41%	0.407	C	S	.	.	H	α-helix	trans	-70.6	-45.9	173.6	169.1	0	0	0	0	109.4	T440 L441 S442 E446 L447 L448 F456	T440-V444 WeakPolarHBondContact O-CB 3.4Å; T440-V444 VanDerWaalsContact O-CG2 3.24Å; T440-V444 WeakPolarHBondContact O-CG2 3.21Å; T440-V444 PolarHBondContact O-N 2.92Å; L441-V444 CarbonylContact O-C 3.58Å; L441-V444 WeakPolarHBondContact O-CB 3.49Å; L441-V444 PolarHBondContact O-N 2.94Å; S442-V444 PolarHBondContact O-N 2.86Å; V444-E446 PolarHBondContact O-N 2.98Å; V444-L447 PolarHBondContact O-N 3.28Å; V444-L448 HydrophobicContact CG1-CD1 3.66Å; V444-L448 HydrophobicContact CG1-CG 4.29Å; V444-L448 WeakPolarHBondContact O-CB 3.4Å; V444-L448 VanDerWaalsContact O-CD1 3.23Å; V444-L448 WeakPolarHBondContact O-CD1 3.45Å; V444-L448 WeakPolarHBondContact O-CG 3.48Å; V444-L448 PolarHBondContact O-N 2.91Å; V444-F456 HydrophobicContact CG1-CE1 4.27Å; V444-F456 HydrophobicContact CG1-CE2 3.95Å; V444-F456 HydrophobicContact CG1-CZ 3.42Å; V444-F456 VanDerWaalsContact CG1-CZ 3.42Å
445	S	52.9	Low	52.3	Low	25 Å²	25	84.8 Å²	84.8	18%	0.175	45%	0.446	C	S	.	.	H	α-helix	trans	-56.7	-45.1	173.6	-160.3	0	0	0	0	112.4	L441 S442 L448 D449	L441-S445 PolarHBondContact O-N 2.84Å; S442-S445 CarbonylContact O-C 3.6Å; S442-S445 WeakPolarHBondContact O-CB 3.47Å; S442-S445 PolarHBondContact O-N 3.19Å; S442-S445 VanDerWaalsContact O-N 3.14Å; S445-L448 WeakPolarHBondContact O-CB 3.36Å; S445-L448 PolarHBondContact O-N 3.02Å; S445-D449 PolarHBondContact O-N 3.48Å
446	E	52.5	Low	51.1	Low	118 Å²	118	83.4 Å²	83.4	55%	0.551	44%	0.44	S	S	*	.	H	α-helix	trans	-68.4	-37.3	177.5	-74.9	-176.8	177.7	0	0	112.5	S442 V444 L448 R450	S442-E446 WeakPolarHBondContact O-CB 3.16Å; S442-E446 WeakPolarHBondContact O-CG 3.29Å; S442-E446 PolarHBondContact O-N 2.94Å; V444-E446 PolarHBondContact O-N 2.98Å; E446-L448 VanDerWaalsContact C-N 3.26Å; E446-R450 WeakPolarHBondContact O-CB 3.47Å; E446-R450 VanDerWaalsContact O-CG 3.27Å; E446-R450 WeakPolarHBondContact O-CG 3.47Å; E446-R450 PolarHBondContact O-N 2.83Å
447	L	45.3	Very low	50.1	Low	102 Å²	102	85.1 Å²	85.1	53%	0.534	45%	0.45	S	S	.	.	H	α-helix	trans	-64.9	-35	172.4	-90.2	158.7	0	0	0	111.2	S443 V444 R450 T451	S443-L447 VanDerWaalsContact O-CB 3.25Å; S443-L447 WeakPolarHBondContact O-CB 3.33Å; S443-L447 WeakPolarHBondContact O-CD1 3.29Å; S443-L447 WeakPolarHBondContact O-CG 3.44Å; S443-L447 PolarHBondContact O-N 3.2Å; V444-L447 PolarHBondContact O-N 3.28Å; L447-R450 PolarHBondContact O-N 3.36Å; L447-T451 WeakPolarHBondContact O-CB 3.46Å; L447-T451 PolarHBondContact O-N 3.41Å; L447-T451 PolarHBondContact O-OG1 3.16Å
448	L	46.1	Very low	49	Very low	37 Å²	37	91.6 Å²	91.6	19%	0.194	48%	0.477	C	S	.	.	H	α-helix	trans	-74.9	-42	178.4	-68.6	161.5	0	0	0	112.7	V444 S445 E446 R450 T451 A454 F456	V444-L448 HydrophobicContact CG1-CD1 3.66Å; V444-L448 HydrophobicContact CG1-CG 4.29Å; V444-L448 WeakPolarHBondContact O-CB 3.4Å; V444-L448 VanDerWaalsContact O-CD1 3.23Å; V444-L448 WeakPolarHBondContact O-CD1 3.45Å; V444-L448 WeakPolarHBondContact O-CG 3.48Å; V444-L448 PolarHBondContact O-N 2.91Å; S445-L448 WeakPolarHBondContact O-CB 3.36Å; S445-L448 PolarHBondContact O-N 3.02Å; E446-L448 VanDerWaalsContact C-N 3.26Å; L448-R450 PolarHBondContact O-N 3.18Å; L448-T451 WeakPolarHBondContact CA-OG1 3.39Å; L448-T451 CarbonylContact O-C 3.27Å; L448-T451 VanDerWaalsContact O-C 3.27Å; L448-T451 PolarHBondContact O-N 3.38Å; L448-A454 HydrophobicContact CD2-CB 3.58Å; L448-F456 HydrophobicContact CD1-CD1 4.12Å; L448-F456 HydrophobicContact CD1-CD2 3.14Å; L448-F456 HydrophobicContact CD1-CE1 4.05Å; L448-F456 HydrophobicContact CD1-CE2 3.1Å; L448-F456 HydrophobicContact CD1-CG 3.7Å; L448-F456 HydrophobicContact CD1-CZ 3.57Å; L448-F456 HydrophobicContact CD2-CD2 3.31Å; L448-F456 HydrophobicContact CD2-CE2 3.44Å; L448-F456 VanDerWaalsContact CD2-CE2 3.44Å; L448-F456 HydrophobicContact CD2-CG 4.44Å; L448-F456 HydrophobicContact CG-CD2 3.79Å; L448-F456 HydrophobicContact CG-CE2 3.75Å
449	D	49.9	Very low	47.9	Very low	131 Å²	131	90.8 Å²	90.8	70%	0.701	48%	0.475	S	S	*	.	H	α-helix	trans	-60.9	-26.8	173	-73	-22.8	0	0	0	111.1	S445	S445-D449 PolarHBondContact O-N 3.48Å
450	R	49.5	Very low	46.8	Very low	207 Å²	207	91.9 Å²	91.9	78%	0.781	48%	0.48	S	S	*	.	H	α-helix	trans	-87.3	-17.6	173.5	-71.3	177.8	-178.5	-177.1	4.5	114.4	E446 L447 L448	E446-R450 WeakPolarHBondContact O-CB 3.47Å; E446-R450 VanDerWaalsContact O-CG 3.27Å; E446-R450 WeakPolarHBondContact O-CG 3.47Å; E446-R450 PolarHBondContact O-N 2.83Å; L447-R450 PolarHBondContact O-N 3.36Å; L448-R450 PolarHBondContact O-N 3.18Å
451	T	43.6	Very low	45.8	Very low	69 Å²	69	96.4 Å²	96.4	42%	0.423	51%	0.509	S	S	.	.			trans	-112.6	79.7	178.3	46	0	0	0	0	109.5	L447 L448 G453 A454	L447-T451 WeakPolarHBondContact O-CB 3.46Å; L447-T451 PolarHBondContact O-N 3.41Å; L447-T451 PolarHBondContact O-OG1 3.16Å; L448-T451 WeakPolarHBondContact CA-OG1 3.39Å; L448-T451 CarbonylContact O-C 3.27Å; L448-T451 VanDerWaalsContact O-C 3.27Å; L448-T451 PolarHBondContact O-N 3.38Å; T451-G453 PolarHBondContact O-N 3.14Å; T451-A454 PolarHBondContact O-N 3.24Å
452	E	40.4	Very low	44.8	Very low	205 Å²	205	99.3 Å²	99.3	96%	0.958	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	88.9	161.3	-73.7	-175.9	156.5	0	0	109.1
453	G	38	Very low	44.3	Very low	72 Å²	72	102.6 Å²	102.6	74%	0.742	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.1	-16.7	-179.9	0	0	0	0	0	117.4	T451 K455	T451-G453 PolarHBondContact O-N 3.14Å; G453-K455 PolarHBondContact O-N 3.43Å
454	A	36.1	Very low	44.1	Very low	52 Å²	52	102.6 Å²	102.6	43%	0.43	55%	0.551	S	S	.	*			trans	-86.2	101.9	178	0	0	0	0	0	110.8	L448 T451 F456	L448-A454 HydrophobicContact CD2-CB 3.58Å; T451-A454 PolarHBondContact O-N 3.24Å; A454-F456 PolarHBondContact O-N 3.41Å
455	K	38.8	Very low	44	Very low	200 Å²	200	108.1 Å²	108.1	87%	0.87	59%	0.585	S	S	*	*			trans	-58.6	95.1	-178.9	-70.1	179.4	177.7	-179.6	0	112.1	G453	G453-K455 PolarHBondContact O-N 3.43Å
456	F	40.7	Very low	44.3	Very low	116 Å²	116	109.6 Å²	109.6	51%	0.509	59%	0.588	S	S	.	*			trans	-75.9	118.9	145.8	-89.1	-112.8	0	0	0	106.7	V444 L448 A454 K458	V444-F456 HydrophobicContact CG1-CE1 4.27Å; V444-F456 HydrophobicContact CG1-CE2 3.95Å; V444-F456 HydrophobicContact CG1-CZ 3.42Å; V444-F456 VanDerWaalsContact CG1-CZ 3.42Å; L448-F456 HydrophobicContact CD1-CD1 4.12Å; L448-F456 HydrophobicContact CD1-CD2 3.14Å; L448-F456 HydrophobicContact CD1-CE1 4.05Å; L448-F456 HydrophobicContact CD1-CE2 3.1Å; L448-F456 HydrophobicContact CD1-CG 3.7Å; L448-F456 HydrophobicContact CD1-CZ 3.57Å; L448-F456 HydrophobicContact CD2-CD2 3.31Å; L448-F456 HydrophobicContact CD2-CE2 3.44Å; L448-F456 VanDerWaalsContact CD2-CE2 3.44Å; L448-F456 HydrophobicContact CD2-CG 4.44Å; L448-F456 HydrophobicContact CG-CD2 3.79Å; L448-F456 HydrophobicContact CG-CE2 3.75Å; A454-F456 PolarHBondContact O-N 3.41Å; F456-K458 PolarHBondContact O-N 3.39Å
457	E	43.3	Very low	44.8	Very low	166 Å²	166	106.4 Å²	106.4	78%	0.776	58%	0.579	S	S	*	*			trans	-65.4	110.3	168	-80.6	-176.6	162.1	0	0	107.1	F459	E457-F459 PolarHBondContact O-N 3.05Å
458	K	43	Very low	45.7	Very low	149 Å²	149	112.4 Å²	112.4	65%	0.648	60%	0.595	S	S	*	*			trans	-42.7	129.2	161.9	-175.7	167.4	-172.2	145.3	0	107.3	F456 S460 E489	F456-K458 PolarHBondContact O-N 3.39Å; K458-S460 PolarHBondContact O-N 3.39Å; K458-E489 VanDerWaalsContact CE-OE1 3.28Å; K458-E489 WeakPolarHBondContact CE-OE1 3.48Å; K458-E489 IonicContact NZ-OE1 2.74Å; K458-E489 PolarHBondContact NZ-OE1 2.85Å
459	F	40	Very low	46.8	Very low	51 Å²	51	112.6 Å²	112.6	22%	0.224	60%	0.598	C	S	.	*			trans	-64.1	92.7	174.9	-160.6	-92.2	0	0	0	107.5	E457 M479 K492 P596	E457-F459 PolarHBondContact O-N 3.05Å; F459-M479 HydrophobicContact CE2-CE 3.93Å; F459-M479 HydrophobicContact CE2-SD 4.12Å; F459-M479 HydrophobicContact CZ-CE 3.79Å; F459-M479 HydrophobicContact CZ-SD 4.1Å; F459-K492 HydrophobicContact CD2-CB 4.15Å; F459-K492 HydrophobicContact CD2-CD 3.67Å; F459-K492 HydrophobicContact CE2-CD 3.8Å; F459-P596 HydrophobicContact CE1-CB 4.37Å
460	S	33.9	Very low	48.1	Very low	83 Å²	83	114.6 Å²	114.6	58%	0.58	60%	0.596	S	S	*	*			trans	-76.5	139.4	154.3	-119.8	0	0	0	0	105.2	K458 A462	K458-S460 PolarHBondContact O-N 3.39Å; S460-A462 PolarHBondContact O-N 2.81Å
461	P	39.6	Very low	49.3	Very low	116 Å²	116	115.3 Å²	115.3	75%	0.753	60%	0.598	S	S	*	*			trans	-65	26.7	174.6	26.5	-33.5	0	0	0	113.4
462	A	38.5	Very low	51.2	Low	70 Å²	70	114.5 Å²	114.5	58%	0.579	59%	0.59	S	S	*	*			trans	-64.2	136.2	171	0	0	0	0	0	109.4	S460 P464	S460-A462 PolarHBondContact O-N 2.81Å; A462-P464 VanDerWaalsContact O-N 3.15Å
463	V	47.3	Very low	53.4	Low	122 Å²	122	109.8 Å²	109.8	74%	0.739	56%	0.563	S	S	*	*			trans	-42	119.7	-178.4	-178.7	0	0	0	0	109.6	T465	V463-T465 PolarHBondContact O-N 3.02Å
464	P	51.2	Low	55.7	Low	48 Å²	48	106.3 Å²	106.3	31%	0.312	53%	0.528	S	S	.	.			trans	-61.5	115.4	-178.9	26.8	-36.2	0	0	0	109	A462 F466	A462-P464 VanDerWaalsContact O-N 3.15Å; P464-F466 HydrophobicContact CB-CD2 4.04Å; P464-F466 HydrophobicContact CB-CE1 4.39Å; P464-F466 HydrophobicContact CB-CE2 3.28Å; P464-F466 HydrophobicContact CB-CZ 3.44Å; P464-F466 VanDerWaalsContact CB-CZ 3.44Å; P464-F466 HydrophobicContact CG-CD2 4.17Å; P464-F466 HydrophobicContact CG-CE2 3.35Å; P464-F466 HydrophobicContact CG-CZ 3.92Å; P464-F466 WeakPolarHBondContact O-CD2 3.4Å; P464-F466 PolarHBondContact O-N 3.18Å
465	T	52.5	Low	58.2	Low	132 Å²	132	106.4 Å²	106.4	81%	0.81	52%	0.519	S	S	*	.			trans	-80.8	85.3	179.8	43	0	0	0	0	109.2	V463	V463-T465 PolarHBondContact O-N 3.02Å
466	F	60.7	Low	60.5	Low	55 Å²	55	96.9 Å²	96.9	24%	0.241	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-79.8	130.4	171.1	-60.6	-69.4	0	0	0	110.1	V421 G422 P423 P464 E475 E477	V421-F466 HydrophobicContact CG1-CB 3.69Å; V421-F466 HydrophobicContact CG1-CD1 4.15Å; V421-F466 HydrophobicContact CG1-CG 3.86Å; G422-F466 VanDerWaalsContact C-CZ 3.41Å; G422-F466 VanDerWaalsContact CA-CE1 3.47Å; P423-F466 VanDerWaalsContact CD-CZ 3.46Å; P423-F466 HydrophobicContact CG-CZ 4.4Å; P464-F466 HydrophobicContact CB-CD2 4.04Å; P464-F466 HydrophobicContact CB-CE1 4.39Å; P464-F466 HydrophobicContact CB-CE2 3.28Å; P464-F466 HydrophobicContact CB-CZ 3.44Å; P464-F466 VanDerWaalsContact CB-CZ 3.44Å; P464-F466 HydrophobicContact CG-CD2 4.17Å; P464-F466 HydrophobicContact CG-CE2 3.35Å; P464-F466 HydrophobicContact CG-CZ 3.92Å; P464-F466 WeakPolarHBondContact O-CD2 3.4Å; P464-F466 PolarHBondContact O-N 3.18Å; F466-E475 HydrophobicContact CD1-CB 4.38Å; F466-E477 VanDerWaalsContact CE1-CD 3.42Å; F466-E477 HydrophobicContact CE1-CG 3.81Å; F466-E477 WeakPolarHBondContact CE1-OE1 3.38Å; F466-E477 HydrophobicContact CZ-CG 4.33Å
467	S	61.6	Low	62.6	Low	51 Å²	51	91.8 Å²	91.8	36%	0.357	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-68.9	148.6	165	80.3	0	0	0	0	109.4	E475	S467-E475 WeakPolarHBondContact CB-OE1 3.34Å; S467-E475 PolarHBondContact N-OE2 3.37Å; S467-E475 PolarHBondContact OG-OE1 2.85Å; S467-E475 PolarHBondContact OG-OE2 3.3Å
468	R	66	Low	64.4	Low	229 Å²	229	84.1 Å²	84.1	86%	0.864	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-55.1	135.9	176.7	-76.6	-175.3	-179.1	176.3	0.3	109.1	R470	R468-R470 PolarHBondContact O-N 3.08Å
469	P	68.5	Low	65.9	Low	40 Å²	40	77.6 Å²	77.6	26%	0.26	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-52.5	129.9	177.6	19.6	-28.6	0	0	0	108.8	E418 V421	E418-P469 HydrophobicContact CB-CG 4.06Å; E418-P469 HydrophobicContact CG-CB 4.24Å; E418-P469 HydrophobicContact CG-CG 3.83Å; V421-P469 HydrophobicContact CG2-CB 3.61Å; V421-P469 HydrophobicContact CG2-CG 3.77Å
470	R	77.1	Confident	67.2	Low	174 Å²	174	75.6 Å²	75.6	66%	0.657	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-85.4	153.9	168.5	-59.2	-175	-179	-173.7	0.3	106.7	R468 H472 R473	R468-R470 PolarHBondContact O-N 3.08Å; R470-H472 PolarHBondContact O-N 3.26Å; R470-R473 HydrophobicContact CB-CB 4.25Å; R470-R473 PolarHBondContact N-O 2.93Å; R470-R473 PolarHBondContact O-N 3.36Å
471	R	75.2	Confident	68.4	Low	222 Å²	222	73.8 Å²	73.8	84%	0.838	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.9	-25.8	-171.6	-66.7	-175.6	177.4	174.6	-1.1	116.1
472	H	82.2	Confident	69.2	Low	51 Å²	51	69.7 Å²	69.7	24%	0.236	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	17.9	-179.7	-54.3	-59.1	0	0	0	113.2	L417 R470 Q498 Q499 R501	L417-H472 VanDerWaalsContact CD1-CA 3.5Å; R470-H472 PolarHBondContact O-N 3.26Å; H472-Q498 WeakPolarHBondContact O-CA 3.21Å; H472-Q499 HydrophobicContact CB-CB 4.33Å; H472-Q499 PolarHBondContact ND1-OE1 3.2Å; H472-Q499 PolarHBondContact O-N 3.5Å; H472-Q499 VanDerWaalsContact O-N 3.07Å; H472-R501 PolarHBondContact CD2-NE 2.76Å; H472-R501 VanDerWaalsContact CD2-NE 3.31Å; H472-R501 PolarHBondContact CD2-NH2 2.76Å; H472-R501 VanDerWaalsContact CD2-NH2 3.3Å; H472-R501 PolarHBondContact CE1-NE 3.39Å; H472-R501 PolarHBondContact CE1-NH2 3.41Å; H472-R501 VanDerWaalsContact CG-NE 3.33Å; H472-R501 PolarHBondContact ND1-NE 2.98Å; H472-R501 VanDerWaalsContact NE2-CZ 3.34Å; H472-R501 PolarHBondContact NE2-NE 3.26Å; H472-R501 PolarHBondContact NE2-NH2 3.14Å
473	R	86.8	Confident	69.9	Low	106 Å²	106	71.1 Å²	71.1	40%	0.4	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	122.1	-173.6	-173.1	-177	168.2	177.2	-3.6	110.6	R470 V496 I497	R470-R473 HydrophobicContact CB-CB 4.25Å; R470-R473 PolarHBondContact N-O 2.93Å; R470-R473 PolarHBondContact O-N 3.36Å; R473-V496 HydrophobicContact CG-CG1 3.31Å; R473-I497 WeakPolarHBondContact CA-O 3.16Å
474	S	87.5	Confident	70	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.5	170.5	-177.8	0	0	0	0	109.9	L417 V421 V496 I497	L417-S474 PolarHBondContact O-OG 2.73Å; V421-S474 VanDerWaalsContact CA-OG 3.3Å; V421-S474 WeakPolarHBondContact CA-OG 3.18Å; V421-S474 WeakPolarHBondContact CG2-OG 3.41Å; V421-S474 PolarHBondContact N-OG 2.71Å; S474-V496 WeakPolarHBondContact O-CA 3.38Å; S474-I497 PolarHBondContact N-O 3.41Å; S474-I497 PolarHBondContact O-N 3.2Å
475	E	87.7	Confident	69.9	Low	53 Å²	53	71.9 Å²	71.9	25%	0.248	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	141.4	166.4	-71.9	170.4	-174.2	0	0	109.3	F466 S467	F466-E475 HydrophobicContact CD1-CB 4.38Å; S467-E475 WeakPolarHBondContact CB-OE1 3.34Å; S467-E475 PolarHBondContact N-OE2 3.37Å; S467-E475 PolarHBondContact OG-OE1 2.85Å; S467-E475 PolarHBondContact OG-OE2 3.3Å
476	M	86.7	Confident	69.5	Low	1 Å²	1	75.9 Å²	75.9	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.5	-179.9	-174.2	-159	-173.6	0	0	108.2	W424 I478 G495 I497 V512 M537 W539 F554	W424-M476 HydrophobicContact CB-CE 3.59Å; W424-M476 HydrophobicContact CG-CE 3.86Å; W424-M476 HydrophobicContact CG-CG 4.3Å; M476-I478 HydrophobicContact CE-CD1 4.02Å; M476-I478 HydrophobicContact CE-CG1 3.57Å; M476-I478 HydrophobicContact SD-CD1 4.04Å; M476-I478 HydrophobicContact SD-CG1 3.8Å; M476-G495 PolarHBondContact N-O 2.8Å; M476-G495 CarbonylContact O-C 3.6Å; M476-G495 WeakPolarHBondContact O-CA 2.8Å; M476-G495 PolarHBondContact O-N 3.08Å; M476-G495 VanDerWaalsContact O-O 3.07Å; M476-I497 HydrophobicContact CB-CD1 3.9Å; M476-I497 HydrophobicContact CB-CG1 4.06Å; M476-I497 HydrophobicContact CG-CD1 4.07Å; M476-I497 HydrophobicContact CG-CG1 4.5Å; M476-I497 HydrophobicContact SD-CD1 4.07Å; M476-I497 HydrophobicContact SD-CG1 4.2Å; M476-V512 HydrophobicContact SD-CG1 4.46Å; M476-M537 HydrophobicContact CE-CE 3.75Å; M476-W539 HydrophobicContact CE-CH2 3.49Å; M476-W539 VanDerWaalsContact CE-CH2 3.49Å; M476-W539 HydrophobicContact CE-CZ2 4.47Å; M476-W539 HydrophobicContact CE-CZ3 3.81Å; M476-W539 HydrophobicContact SD-CH2 3.51Å; M476-W539 VanDerWaalsContact SD-CH2 3.51Å; M476-W539 HydrophobicContact SD-CZ3 4.05Å; M476-F554 HydrophobicContact CE-CD1 3.85Å; M476-F554 HydrophobicContact CE-CE1 3.9Å; M476-F554 HydrophobicContact CE-CG 4.38Å; M476-F554 HydrophobicContact CE-CZ 4.47Å
477	E	84.8	Confident	69.1	Low	9 Å²	9	78.2 Å²	78.2	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.9	170.9	-66.7	174	177.8	0	0	108.9	G422 W424 F466 K492 L493 Q494	G422-E477 PolarHBondContact O-N 2.85Å; G422-E477 VanDerWaalsContact O-N 3.1Å; W424-E477 PolarHBondContact N-O 2.96Å; W424-E477 VanDerWaalsContact O-O 3.1Å; F466-E477 VanDerWaalsContact CE1-CD 3.42Å; F466-E477 HydrophobicContact CE1-CG 3.81Å; F466-E477 WeakPolarHBondContact CE1-OE1 3.38Å; F466-E477 HydrophobicContact CZ-CG 4.33Å; E477-K492 HydrophobicContact CB-CG 4.49Å; E477-K492 HydrophobicContact CG-CD 4.46Å; E477-K492 WeakPolarHBondContact OE1-CE 3.32Å; E477-K492 IonicContact OE1-NZ 2.71Å; E477-K492 PolarHBondContact OE1-NZ 3.29Å; E477-K492 WeakPolarHBondContact OE2-CE 3.46Å; E477-K492 IonicContact OE2-NZ 2.73Å; E477-K492 PolarHBondContact OE2-NZ 2.82Å; E477-L493 WeakPolarHBondContact CA-O 3.24Å; E477-Q494 HydrophobicContact CG-CG 4.31Å
478	I	81	Confident	68.8	Low	5 Å²	5	77.4 Å²	77.4	3%	0.026	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.7	172.9	-59.4	173.4	0	0	0	107.6	W424 L437 M476 L493 L514	W424-I478 WeakPolarHBondContact O-CA 3.31Å; L437-I478 HydrophobicContact CD1-CD1 4.16Å; M476-I478 HydrophobicContact CE-CD1 4.02Å; M476-I478 HydrophobicContact CE-CG1 3.57Å; M476-I478 HydrophobicContact SD-CD1 4.04Å; M476-I478 HydrophobicContact SD-CG1 3.8Å; I478-L493 HydrophobicContact CB-CB 4.24Å; I478-L493 PolarHBondContact N-O 3.07Å; I478-L493 PolarHBondContact O-N 2.82Å; I478-L514 HydrophobicContact CD1-CD1 3.98Å; I478-L514 HydrophobicContact CD1-CD2 3.81Å
479	M	74.4	Confident	68.5	Low	12 Å²	12	70.4 Å²	70.4	6%	0.059	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.3	174.9	-54.9	-155.2	-152.8	0	0	110.4	P423 W424 F459 Q491 P596	P423-M479 HydrophobicContact CB-CE 3.34Å; P423-M479 HydrophobicContact CG-CE 4.28Å; W424-M479 PolarHBondContact O-N 3.08Å; W424-M479 VanDerWaalsContact O-N 3.14Å; F459-M479 HydrophobicContact CE2-CE 3.93Å; F459-M479 HydrophobicContact CE2-SD 4.12Å; F459-M479 HydrophobicContact CZ-CE 3.79Å; F459-M479 HydrophobicContact CZ-SD 4.1Å; M479-Q491 WeakPolarHBondContact CA-O 2.91Å; M479-P596 HydrophobicContact CE-CB 4.15Å; M479-P596 HydrophobicContact SD-CB 3.74Å
480	F	67.4	Low	68.2	Low	8 Å²	8	70.1 Å²	70.1	4%	0.035	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	153	176.9	64.4	-79.6	0	0	0	110.8	Y438 L441 Q491 L493	Y438-F480 HydrophobicContact CD1-CD2 4.37Å; Y438-F480 HydrophobicContact CE1-CB 4.21Å; Y438-F480 AromaticContact CE1-CD2 3.87Å; Y438-F480 HydrophobicContact CE1-CD2 3.87Å; Y438-F480 HydrophobicContact CE1-CG 4.29Å; L441-F480 HydrophobicContact CB-CE1 4.49Å; L441-F480 HydrophobicContact CB-CE2 4.08Å; L441-F480 HydrophobicContact CB-CZ 3.77Å; L441-F480 HydrophobicContact CD1-CD1 3.62Å; L441-F480 HydrophobicContact CD1-CD2 3.93Å; L441-F480 HydrophobicContact CD1-CE1 3.35Å; L441-F480 HydrophobicContact CD1-CE2 3.63Å; L441-F480 HydrophobicContact CD1-CG 3.92Å; L441-F480 HydrophobicContact CD1-CZ 3.34Å; L441-F480 HydrophobicContact CD2-CD1 4.35Å; L441-F480 HydrophobicContact CD2-CE1 3.32Å; L441-F480 HydrophobicContact CD2-CE2 4.33Å; L441-F480 HydrophobicContact CD2-CZ 3.29Å; L441-F480 HydrophobicContact CG-CE1 3.83Å; L441-F480 HydrophobicContact CG-CE2 4.19Å; L441-F480 HydrophobicContact CG-CZ 3.6Å; F480-Q491 HydrophobicContact CD1-CB 4.16Å; F480-Q491 WeakPolarHBondContact CD1-O 3.16Å; F480-Q491 HydrophobicContact CD2-CB 4.03Å; F480-Q491 HydrophobicContact CE1-CB 3.53Å; F480-Q491 HydrophobicContact CE2-CB 3.44Å; F480-Q491 VanDerWaalsContact CE2-CB 3.44Å; F480-Q491 HydrophobicContact CE2-CG 4.05Å; F480-Q491 HydrophobicContact CG-CB 4.36Å; F480-Q491 HydrophobicContact CZ-CB 3.14Å; F480-Q491 HydrophobicContact CZ-CG 4.07Å; F480-Q491 PolarHBondContact N-O 3.33Å; F480-Q491 PolarHBondContact O-N 2.71Å; F480-L493 HydrophobicContact CE1-CB 4.2Å
481	H	59.7	Low	67.7	Low	45 Å²	45	64.2 Å²	64.2	21%	0.208	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.6	174.5	-162	-88.4	0	0	0	109.8	S483 G488 Q593	H481-S483 PolarHBondContact O-N 3.07Å; H481-G488 WeakPolarHBondContact NE2-CA 3.27Å; H481-G488 PolarHBondContact NE2-O 3.33Å; H481-Q593 HydrophobicContact CB-CB 4.02Å; H481-Q593 VanDerWaalsContact CB-O 3.26Å; H481-Q593 WeakPolarHBondContact CB-O 3.31Å; H481-Q593 PolarHBondContact CD2-O 3.09Å
482	N	57.5	Low	67.7	Low	30 Å²	30	55.8 Å²	55.8	16%	0.16	29%	0.285	C	S	.	.			trans	-86.4	104.6	168.6	-177.1	-2.9	0	0	0	108.6	E484 S485 Q491	N482-E484 PolarHBondContact O-N 2.87Å; N482-E484 WeakPolarHBondContact OD1-CB 3.26Å; N482-E484 PolarHBondContact OD1-N 3.29Å; N482-S485 PolarHBondContact O-N 2.77Å; N482-S485 PolarHBondContact O-OG 3.32Å; N482-Q491 HydrophobicContact CB-CG 4.16Å; N482-Q491 PolarHBondContact ND2-NE2 2.84Å
483	S	51.9	Low	67.5	Low	101 Å²	101	53.5 Å²	53.5	71%	0.706	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.3	177.3	52.8	0	0	0	0	113.5	H481	H481-S483 PolarHBondContact O-N 3.07Å
484	E	50.5	Low	67.5	Low	157 Å²	157	54 Å²	54	73%	0.734	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-17.6	178	-58	-174.7	164.5	0	0	112.4	N482 F486	N482-E484 PolarHBondContact O-N 2.87Å; N482-E484 WeakPolarHBondContact OD1-CB 3.26Å; N482-E484 PolarHBondContact OD1-N 3.29Å; E484-F486 PolarHBondContact O-N 2.83Å
485	S	48.7	Very low	67.5	Low	29 Å²	29	54.3 Å²	54.3	20%	0.203	28%	0.284	C	S	.	.			trans	-77.8	110	172.6	78.3	0	0	0	0	109.3	N482 V487 G488	N482-S485 PolarHBondContact O-N 2.77Å; N482-S485 PolarHBondContact O-OG 3.32Å; S485-V487 PolarHBondContact O-N 3.1Å; S485-G488 PolarHBondContact O-N 2.76Å
486	F	42.9	Very low	67.6	Low	215 Å²	215	52.9 Å²	52.9	94%	0.943	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-10.7	175.7	-76.4	-83.6	0	0	0	114.1	E484	E484-F486 PolarHBondContact O-N 2.83Å
487	V	54.1	Low	67.9	Low	105 Å²	105	52.9 Å²	52.9	64%	0.636	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-2.3	-174.3	-163.7	0	0	0	0	112.2	S485 E489	S485-V487 PolarHBondContact O-N 3.1Å; V487-E489 HydrophobicContact CB-CG 3.84Å; V487-E489 HydrophobicContact CG1-CG 3.66Å; V487-E489 PolarHBondContact O-N 2.76Å
488	G	54.5	Low	68.2	Low	34 Å²	34	55.4 Å²	55.4	35%	0.351	29%	0.29	S	S	.	.			trans	58.8	28.9	-178.9	0	0	0	0	0	113.1	H481 S485 L490	H481-G488 WeakPolarHBondContact NE2-CA 3.27Å; H481-G488 PolarHBondContact NE2-O 3.33Å; S485-G488 PolarHBondContact O-N 2.76Å; G488-L490 PolarHBondContact O-N 2.88Å
489	E	59.4	Low	68.7	Low	82 Å²	82	56.6 Å²	56.6	38%	0.383	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-79.9	126	-174.4	-73.9	-174.2	166.6	0	0	109.4	K458 V487 Q491	K458-E489 VanDerWaalsContact CE-OE1 3.28Å; K458-E489 WeakPolarHBondContact CE-OE1 3.48Å; K458-E489 IonicContact NZ-OE1 2.74Å; K458-E489 PolarHBondContact NZ-OE1 2.85Å; V487-E489 HydrophobicContact CB-CG 3.84Å; V487-E489 HydrophobicContact CG1-CG 3.66Å; V487-E489 PolarHBondContact O-N 2.76Å; E489-Q491 PolarHBondContact O-N 2.64Å
490	L	62.5	Low	69.2	Low	33 Å²	33	58.3 Å²	58.3	17%	0.173	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	123.7	171.6	-71.2	118.5	0	0	0	109.7	G488 L595 P596	G488-L490 PolarHBondContact O-N 2.88Å; L490-L595 WeakPolarHBondContact CD1-O 3.44Å; L490-L595 VanDerWaalsContact CD2-C 3.42Å; L490-L595 WeakPolarHBondContact CD2-O 3.44Å; L490-L595 VanDerWaalsContact CG-O 3.27Å; L490-L595 WeakPolarHBondContact CG-O 3.48Å; L490-P596 WeakPolarHBondContact CD1-OXT 3.39Å
491	Q	66.1	Low	69.9	Low	50 Å²	50	65.5 Å²	65.5	23%	0.234	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.5	171.5	-64.5	-164.1	-8.7	0	0	108.6	M479 F480 N482 E489	M479-Q491 WeakPolarHBondContact CA-O 2.91Å; F480-Q491 HydrophobicContact CD1-CB 4.16Å; F480-Q491 WeakPolarHBondContact CD1-O 3.16Å; F480-Q491 HydrophobicContact CD2-CB 4.03Å; F480-Q491 HydrophobicContact CE1-CB 3.53Å; F480-Q491 HydrophobicContact CE2-CB 3.44Å; F480-Q491 VanDerWaalsContact CE2-CB 3.44Å; F480-Q491 HydrophobicContact CE2-CG 4.05Å; F480-Q491 HydrophobicContact CG-CB 4.36Å; F480-Q491 HydrophobicContact CZ-CB 3.14Å; F480-Q491 HydrophobicContact CZ-CG 4.07Å; F480-Q491 PolarHBondContact N-O 3.33Å; F480-Q491 PolarHBondContact O-N 2.71Å; N482-Q491 HydrophobicContact CB-CG 4.16Å; N482-Q491 PolarHBondContact ND2-NE2 2.84Å; E489-Q491 PolarHBondContact O-N 2.64Å
492	K	75.6	Confident	70.8	Confident	45 Å²	45	71 Å²	71	20%	0.196	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.1	-179.9	168.2	172.8	160.9	163.7	0	109	F459 E477 Q494	F459-K492 HydrophobicContact CD2-CB 4.15Å; F459-K492 HydrophobicContact CD2-CD 3.67Å; F459-K492 HydrophobicContact CE2-CD 3.8Å; E477-K492 HydrophobicContact CB-CG 4.49Å; E477-K492 HydrophobicContact CG-CD 4.46Å; E477-K492 WeakPolarHBondContact OE1-CE 3.32Å; E477-K492 IonicContact OE1-NZ 2.71Å; E477-K492 PolarHBondContact OE1-NZ 3.29Å; E477-K492 WeakPolarHBondContact OE2-CE 3.46Å; E477-K492 IonicContact OE2-NZ 2.73Å; E477-K492 PolarHBondContact OE2-NZ 2.82Å; K492-Q494 HydrophobicContact CG-CG 4.44Å
493	L	78.7	Confident	71.6	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.016	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	110.3	171.1	-169.8	62.1	0	0	0	109.6	L441 E477 I478 F480 L514 P515	L441-L493 HydrophobicContact CD2-CB 3.9Å; L441-L493 HydrophobicContact CD2-CD1 3.49Å; L441-L493 VanDerWaalsContact CD2-CD1 3.49Å; L441-L493 HydrophobicContact CD2-CD2 3.6Å; L441-L493 HydrophobicContact CD2-CG 3.84Å; L441-L493 HydrophobicContact CG-CD2 4.21Å; E477-L493 WeakPolarHBondContact CA-O 3.24Å; I478-L493 HydrophobicContact CB-CB 4.24Å; I478-L493 PolarHBondContact N-O 3.07Å; I478-L493 PolarHBondContact O-N 2.82Å; F480-L493 HydrophobicContact CE1-CB 4.2Å; L493-L514 HydrophobicContact CD2-CB 4.06Å; L493-L514 HydrophobicContact CD2-CD1 3.7Å; L493-L514 HydrophobicContact CD2-CD2 3.82Å; L493-L514 HydrophobicContact CD2-CG 4.04Å; L493-L514 HydrophobicContact CG-CD2 4.22Å; L493-P515 HydrophobicContact CD1-CG 3.82Å
494	Q	85.9	Confident	72.5	Confident	118 Å²	118	67.1 Å²	67.1	55%	0.551	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	129	171.5	-67.4	-177	1	0	0	109.8	E477 K492 P515	E477-Q494 HydrophobicContact CG-CG 4.31Å; K492-Q494 HydrophobicContact CG-CG 4.44Å; Q494-P515 WeakPolarHBondContact O-CD 3.38Å
495	G	87.5	Confident	73.1	Confident	5 Å²	5	64.1 Å²	64.1	5%	0.052	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	171.9	179.9	0	0	0	0	0	111.9	M476 R513	M476-G495 PolarHBondContact N-O 2.8Å; M476-G495 CarbonylContact O-C 3.6Å; M476-G495 WeakPolarHBondContact O-CA 2.8Å; M476-G495 PolarHBondContact O-N 3.08Å; M476-G495 VanDerWaalsContact O-O 3.07Å; G495-R513 CarbonylContact C-O 3.47Å; G495-R513 VanDerWaalsContact CA-O 3.26Å; G495-R513 WeakPolarHBondContact CA-O 3.25Å
496	V	90.8	Very high	74.1	Confident	24 Å²	24	69.2 Å²	69.2	15%	0.145	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.5	177.4	176	0	0	0	0	108.5	R473 S474 R513	R473-V496 HydrophobicContact CG-CG1 3.31Å; S474-V496 WeakPolarHBondContact O-CA 3.38Å; V496-R513 HydrophobicContact CB-CB 4.37Å; V496-R513 PolarHBondContact N-O 2.77Å; V496-R513 PolarHBondContact O-N 3.12Å
497	I	92	Very high	75.8	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.2	168.1	-56.7	159.8	0	0	0	107	L417 M420 R473 S474 M476 L510 V512 W539	L417-I497 HydrophobicContact CD2-CG2 4.11Å; M420-I497 HydrophobicContact CB-CD1 4.42Å; R473-I497 WeakPolarHBondContact CA-O 3.16Å; S474-I497 PolarHBondContact N-O 3.41Å; S474-I497 PolarHBondContact O-N 3.2Å; M476-I497 HydrophobicContact CB-CD1 3.9Å; M476-I497 HydrophobicContact CB-CG1 4.06Å; M476-I497 HydrophobicContact CG-CD1 4.07Å; M476-I497 HydrophobicContact CG-CG1 4.5Å; M476-I497 HydrophobicContact SD-CD1 4.07Å; M476-I497 HydrophobicContact SD-CG1 4.2Å; I497-L510 HydrophobicContact CG2-CB 4.35Å; I497-L510 HydrophobicContact CG2-CD1 4.21Å; I497-L510 HydrophobicContact CG2-CD2 4.07Å; I497-L510 HydrophobicContact CG2-CG 4.45Å; I497-V512 HydrophobicContact CG1-CG2 4.44Å; I497-W539 HydrophobicContact CD1-CH2 3.64Å; I497-W539 HydrophobicContact CD1-CZ2 3.54Å; I497-W539 HydrophobicContact CG1-CH2 3.92Å; I497-W539 HydrophobicContact CG1-CZ2 4.13Å
498	Q	91.4	Very high	77.4	Confident	62 Å²	62	57.1 Å²	57.1	29%	0.29	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134	176.3	-179.3	165.7	-5.1	0	0	110.1	H472 L510 E511	H472-Q498 WeakPolarHBondContact O-CA 3.21Å; Q498-L510 CarbonylContact O-C 3.58Å; Q498-L510 WeakPolarHBondContact O-CA 3.23Å; Q498-E511 PolarHBondContact N-O 2.78Å; Q498-E511 PolarHBondContact O-N 2.91Å
499	Q	91.9	Very high	79.2	Confident	31 Å²	31	55.7 Å²	55.7	15%	0.145	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	125.1	171.2	-178.5	-171.9	0.9	0	0	109.5	L417 H472 R501 L510	L417-Q499 HydrophobicContact CD1-CB 4.07Å; H472-Q499 HydrophobicContact CB-CB 4.33Å; H472-Q499 PolarHBondContact ND1-OE1 3.2Å; H472-Q499 PolarHBondContact O-N 3.5Å; H472-Q499 VanDerWaalsContact O-N 3.07Å; Q499-R501 PolarHBondContact O-N 3.3Å; Q499-L510 HydrophobicContact CB-CD2 4.24Å
500	D	85.4	Confident	80.9	Confident	48 Å²	48	51.9 Å²	51.9	26%	0.257	27%	0.265	S	S	.	.			trans	-85.3	102.6	176.9	-164.9	-24.6	0	0	0	110.3	N502 V503 S504 A509	D500-N502 VanDerWaalsContact C-N 3.31Å; D500-N502 WeakPolarHBondContact OD1-CB 3.37Å; D500-N502 PolarHBondContact OD1-N 2.8Å; D500-V503 HydrophobicContact CB-CB 4.3Å; D500-V503 HydrophobicContact CB-CG2 4.34Å; D500-V503 PolarHBondContact OD1-N 3.33Å; D500-V503 WeakPolarHBondContact OD2-CG2 3.26Å; D500-S504 PolarHBondContact O-N 3.23Å; D500-S504 VanDerWaalsContact O-N 3.08Å; D500-A509 HydrophobicContact CB-CB 4.07Å; D500-A509 PolarHBondContact N-O 3.01Å
501	R	82	Confident	82.3	Confident	158 Å²	158	52 Å²	52	60%	0.596	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-21.5	179.2	-71.7	172.9	157.3	-142.3	-7.2	113.1	H472 Q499 V503	H472-R501 PolarHBondContact CD2-NE 2.76Å; H472-R501 VanDerWaalsContact CD2-NE 3.31Å; H472-R501 PolarHBondContact CD2-NH2 2.76Å; H472-R501 VanDerWaalsContact CD2-NH2 3.3Å; H472-R501 PolarHBondContact CE1-NE 3.39Å; H472-R501 PolarHBondContact CE1-NH2 3.41Å; H472-R501 VanDerWaalsContact CG-NE 3.33Å; H472-R501 PolarHBondContact ND1-NE 2.98Å; H472-R501 VanDerWaalsContact NE2-CZ 3.34Å; H472-R501 PolarHBondContact NE2-NE 3.26Å; H472-R501 PolarHBondContact NE2-NH2 3.14Å; Q499-R501 PolarHBondContact O-N 3.3Å; R501-V503 VanDerWaalsContact C-N 3.34Å
502	N	78.1	Confident	83.5	Confident	160 Å²	160	49.8 Å²	49.8	86%	0.856	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-32.7	179.4	-61.5	-15.6	0	0	0	110	D500	D500-N502 VanDerWaalsContact C-N 3.31Å; D500-N502 WeakPolarHBondContact OD1-CB 3.37Å; D500-N502 PolarHBondContact OD1-N 2.8Å
503	V	73.4	Confident	84.3	Confident	44 Å²	44	52.1 Å²	52.1	27%	0.267	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-33.6	-177.4	-178.4	0	0	0	0	112.5	I406 L408 D500 R501 A509	I406-V503 HydrophobicContact CB-CG1 4.08Å; I406-V503 HydrophobicContact CD1-CG1 4.48Å; I406-V503 HydrophobicContact CD1-CG2 4.07Å; I406-V503 HydrophobicContact CG2-CG1 4.17Å; L408-V503 HydrophobicContact CD1-CG1 4.41Å; L408-V503 HydrophobicContact CD2-CG1 4.19Å; L408-V503 HydrophobicContact CG-CG1 4.32Å; D500-V503 HydrophobicContact CB-CB 4.3Å; D500-V503 HydrophobicContact CB-CG2 4.34Å; D500-V503 PolarHBondContact OD1-N 3.33Å; D500-V503 WeakPolarHBondContact OD2-CG2 3.26Å; R501-V503 VanDerWaalsContact C-N 3.34Å; V503-A509 HydrophobicContact CB-CB 3.78Å; V503-A509 HydrophobicContact CG1-CB 3.75Å
504	S	70.7	Confident	84.7	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.042	27%	0.265	C	S	.	.			trans	-138.7	105.5	-177.8	-167.4	0	0	0	0	112.3	D500 H506 G507 K508	D500-S504 PolarHBondContact O-N 3.23Å; D500-S504 VanDerWaalsContact O-N 3.08Å; S504-H506 PolarHBondContact O-N 2.94Å; S504-H506 PolarHBondContact OG-N 3.42Å; S504-G507 PolarHBondContact O-N 3.39Å; S504-G507 PolarHBondContact OG-N 3.12Å; S504-K508 WeakPolarHBondContact OG-CB 3.41Å; S504-K508 PolarHBondContact OG-N 3.46Å; S504-K508 VanDerWaalsContact OG-N 3.1Å
505	A	64.4	Low	84.4	Confident	95 Å²	95	49.6 Å²	49.6	79%	0.785	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-24.4	167.9	0	0	0	0	0	112.6
506	H	69.6	Low	84.1	Confident	136 Å²	136	56 Å²	56	63%	0.63	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-0.8	-175.6	-57.7	-57.9	0	0	0	114.7	N414 S504 K508	N414-H506 PolarHBondContact OD1-O 3.09Å; N414-H506 VanDerWaalsContact OD1-O 3.1Å; S504-H506 PolarHBondContact O-N 2.94Å; S504-H506 PolarHBondContact OG-N 3.42Å; H506-K508 HydrophobicContact CB-CG 4.39Å
507	G	77.7	Confident	83.7	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.01	29%	0.289	C	S	.	.	S	Bend	trans	73.6	28.4	179	0	0	0	0	0	116.1	S415 S504	S415-G507 PolarHBondContact N-O 2.94Å; S415-G507 PolarHBondContact OG-O 3.46Å; S504-G507 PolarHBondContact O-N 3.39Å; S504-G507 PolarHBondContact OG-N 3.12Å
508	K	88.7	Confident	83.6	Confident	64 Å²	64	62.7 Å²	62.7	28%	0.278	32%	0.316	S	S	.	.			trans	-83.8	-36.6	172.4	-62.7	-174.6	172.6	-152.5	0	111.8	L408 C412 N414 S504 H506 C522	L408-K508 HydrophobicContact CD1-CB 4.12Å; C412-K508 HydrophobicContact CB-CB 3.98Å; C412-K508 HydrophobicContact CB-CD 4.18Å; C412-K508 HydrophobicContact CB-CG 4.45Å; C412-K508 WeakPolarHBondContact O-CD 3.36Å; C412-K508 VanDerWaalsContact O-CE 3.3Å; C412-K508 WeakPolarHBondContact O-CE 3.46Å; C412-K508 PolarHBondContact O-NZ 2.74Å; N414-K508 WeakPolarHBondContact OD1-CE 3.33Å; N414-K508 WeakPolarHBondContact OD1-CG 3.49Å; S504-K508 WeakPolarHBondContact OG-CB 3.41Å; S504-K508 PolarHBondContact OG-N 3.46Å; S504-K508 VanDerWaalsContact OG-N 3.1Å; H506-K508 HydrophobicContact CB-CG 4.39Å; K508-C522 WeakPolarHBondContact O-CA 3.19Å; K508-C522 WeakPolarHBondContact O-CB 3.41Å
509	A	91.8	Very high	83.5	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.033	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125.2	178.3	0	0	0	0	0	111	L408 D500 V503	L408-A509 HydrophobicContact CD1-CB 4.35Å; L408-A509 HydrophobicContact CD2-CB 3.9Å; D500-A509 HydrophobicContact CB-CB 4.07Å; D500-A509 PolarHBondContact N-O 3.01Å; V503-A509 HydrophobicContact CB-CB 3.78Å; V503-A509 HydrophobicContact CG1-CB 3.75Å
510	L	94.2	Very high	83.5	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.9	177.2	-63.8	177.9	0	0	0	109.6	S415 L417 M420 I497 Q498 Q499 P520 V521 L523	S415-L510 WeakPolarHBondContact OG-CD2 3.13Å; L417-L510 HydrophobicContact CD2-CD2 3.99Å; M420-L510 HydrophobicContact CE-CD1 4.28Å; M420-L510 HydrophobicContact SD-CD1 4.37Å; I497-L510 HydrophobicContact CG2-CB 4.35Å; I497-L510 HydrophobicContact CG2-CD1 4.21Å; I497-L510 HydrophobicContact CG2-CD2 4.07Å; I497-L510 HydrophobicContact CG2-CG 4.45Å; Q498-L510 CarbonylContact O-C 3.58Å; Q498-L510 WeakPolarHBondContact O-CA 3.23Å; Q499-L510 HydrophobicContact CB-CD2 4.24Å; L510-P520 WeakPolarHBondContact O-CA 3.48Å; L510-V521 CarbonylContact C-O 3.56Å; L510-V521 WeakPolarHBondContact CA-O 3.29Å; L510-V521 HydrophobicContact CB-CG2 3.8Å; L510-V521 PolarHBondContact N-O 3.11Å; L510-V521 PolarHBondContact O-N 2.68Å; L510-L523 HydrophobicContact CD1-CB 4.44Å
511	E	93	Very high	83.9	Confident	34 Å²	34	58.8 Å²	58.8	16%	0.159	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.3	169.8	-171.9	-178.8	-124.5	0	0	108.2	Q498 R513 K518	Q498-E511 PolarHBondContact N-O 2.78Å; Q498-E511 PolarHBondContact O-N 2.91Å; E511-R513 HydrophobicContact CG-CG 4.19Å; E511-R513 IonicContact OE2-CZ 2.64Å; E511-R513 IonicContact OE2-NE 2.62Å; E511-R513 PolarHBondContact OE2-NE 2.87Å; E511-R513 IonicContact OE2-NH2 2.77Å; E511-R513 PolarHBondContact OE2-NH2 3Å; E511-K518 HydrophobicContact CG-CB 4.41Å
512	V	91.8	Very high	84.6	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.024	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	115	171.7	-175	0	0	0	0	107.4	M476 I497 L514 K518 L519 V521 W539	M476-V512 HydrophobicContact SD-CG1 4.46Å; I497-V512 HydrophobicContact CG1-CG2 4.44Å; V512-L514 HydrophobicContact CG1-CD2 4.11Å; V512-L514 HydrophobicContact CG1-CG 4.14Å; V512-K518 CarbonylContact O-C 3.56Å; V512-K518 WeakPolarHBondContact O-CA 3.32Å; V512-L519 HydrophobicContact CB-CB 4.32Å; V512-L519 PolarHBondContact N-O 3.43Å; V512-L519 PolarHBondContact O-N 3.15Å; V512-V521 HydrophobicContact CG2-CG1 4.44Å; V512-V521 HydrophobicContact CG2-CG2 3.69Å; V512-W539 HydrophobicContact CG1-CZ3 4.34Å; V512-W539 HydrophobicContact CG2-CE3 3.92Å; V512-W539 HydrophobicContact CG2-CH2 3.76Å; V512-W539 HydrophobicContact CG2-CZ2 4.5Å; V512-W539 HydrophobicContact CG2-CZ3 3.45Å; V512-W539 VanDerWaalsContact CG2-CZ3 3.45Å
513	R	90.9	Very high	85.4	Confident	95 Å²	95	43.7 Å²	43.7	36%	0.358	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	108.9	176.7	-63.7	-174.2	171.8	166.1	9.4	109.3	G495 V496 E511 K518	G495-R513 CarbonylContact C-O 3.47Å; G495-R513 VanDerWaalsContact CA-O 3.26Å; G495-R513 WeakPolarHBondContact CA-O 3.25Å; V496-R513 HydrophobicContact CB-CB 4.37Å; V496-R513 PolarHBondContact N-O 2.77Å; V496-R513 PolarHBondContact O-N 3.12Å; E511-R513 HydrophobicContact CG-CG 4.19Å; E511-R513 IonicContact OE2-CZ 2.64Å; E511-R513 IonicContact OE2-NE 2.62Å; E511-R513 PolarHBondContact OE2-NE 2.87Å; E511-R513 IonicContact OE2-NH2 2.77Å; E511-R513 PolarHBondContact OE2-NH2 3Å; R513-K518 HydrophobicContact CG-CG 4.39Å
514	L	86.9	Confident	86.5	Confident	14 Å²	14	42.1 Å²	42.1	7%	0.073	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	163.6	168.6	-55.6	176.8	0	0	0	108.4	L437 I478 L493 V512 N516 F517	L437-L514 HydrophobicContact CD1-CD1 3.58Å; L437-L514 HydrophobicContact CG-CD1 4.11Å; I478-L514 HydrophobicContact CD1-CD1 3.98Å; I478-L514 HydrophobicContact CD1-CD2 3.81Å; L493-L514 HydrophobicContact CD2-CB 4.06Å; L493-L514 HydrophobicContact CD2-CD1 3.7Å; L493-L514 HydrophobicContact CD2-CD2 3.82Å; L493-L514 HydrophobicContact CD2-CG 4.04Å; L493-L514 HydrophobicContact CG-CD2 4.22Å; V512-L514 HydrophobicContact CG1-CD2 4.11Å; V512-L514 HydrophobicContact CG1-CG 4.14Å; L514-N516 PolarHBondContact O-N 2.92Å; L514-N516 VanDerWaalsContact O-N 3.12Å; L514-F517 CarbonylContact C-O 3.53Å; L514-F517 HydrophobicContact CB-CB 4.27Å; L514-F517 HydrophobicContact CB-CD1 4.43Å; L514-F517 HydrophobicContact CD1-CD1 3.99Å; L514-F517 HydrophobicContact CG-CD1 4.45Å; L514-F517 PolarHBondContact N-O 3.34Å; L514-F517 PolarHBondContact O-N 3.46Å; L514-F517 VanDerWaalsContact O-N 3.07Å
515	P	81	Confident	87.7	Confident	53 Å²	53	44 Å²	44	34%	0.344	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	122.3	171.9	-26.6	35.4	0	0	0	110.3	T440 L493 Q494 F517	T440-P515 WeakPolarHBondContact CG2-O 3.18Å; L493-P515 HydrophobicContact CD1-CG 3.82Å; Q494-P515 WeakPolarHBondContact O-CD 3.38Å; P515-F517 PolarHBondContact O-N 2.81Å; P515-F517 VanDerWaalsContact O-N 3.08Å
516	N	80.6	Confident	89.3	Confident	141 Å²	141	40.3 Å²	40.3	75%	0.754	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	8	-178.9	-52.8	-38.4	0	0	0	116.8	T440 L514	T440-N516 HydrophobicContact CG2-CB 4.47Å; L514-N516 PolarHBondContact O-N 2.92Å; L514-N516 VanDerWaalsContact O-N 3.12Å
517	F	82.3	Confident	90.5	Very high	34 Å²	34	34 Å²	34	15%	0.149	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	131.1	-175.8	-178.6	-102.9	0	0	0	111.8	K436 T440 L514 P515 L519	K436-F517 HydrophobicContact CB-CE2 4.19Å; K436-F517 HydrophobicContact CD-CE2 4.43Å; T440-F517 HydrophobicContact CG2-CB 4.19Å; L514-F517 CarbonylContact C-O 3.53Å; L514-F517 HydrophobicContact CB-CB 4.27Å; L514-F517 HydrophobicContact CB-CD1 4.43Å; L514-F517 HydrophobicContact CD1-CD1 3.99Å; L514-F517 HydrophobicContact CG-CD1 4.45Å; L514-F517 PolarHBondContact N-O 3.34Å; L514-F517 PolarHBondContact O-N 3.46Å; L514-F517 VanDerWaalsContact O-N 3.07Å; P515-F517 PolarHBondContact O-N 2.81Å; P515-F517 VanDerWaalsContact O-N 3.08Å; F517-L519 HydrophobicContact CD1-CB 4.37Å; F517-L519 HydrophobicContact CE1-CB 3.64Å; F517-L519 HydrophobicContact CE1-CD1 4.28Å; F517-L519 HydrophobicContact CE1-CD2 4.28Å; F517-L519 HydrophobicContact CE1-CG 4.28Å; F517-L519 HydrophobicContact CZ-CB 4.13Å; F517-L519 HydrophobicContact CZ-CD1 3.97Å; F517-L519 HydrophobicContact CZ-CG 4.47Å
518	K	89.7	Confident	91.2	Very high	130 Å²	130	36.4 Å²	36.4	57%	0.565	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.6	174.6	-61.2	-176.4	-179.9	-177.1	0	108.5	E511 V512 R513	E511-K518 HydrophobicContact CG-CB 4.41Å; V512-K518 CarbonylContact O-C 3.56Å; V512-K518 WeakPolarHBondContact O-CA 3.32Å; R513-K518 HydrophobicContact CG-CG 4.39Å
519	L	89.5	Confident	91.2	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.115	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	107.4	177.9	-170.2	65	0	0	0	109.6	V512 F517 V521 E541	V512-L519 HydrophobicContact CB-CB 4.32Å; V512-L519 PolarHBondContact N-O 3.43Å; V512-L519 PolarHBondContact O-N 3.15Å; F517-L519 HydrophobicContact CD1-CB 4.37Å; F517-L519 HydrophobicContact CE1-CB 3.64Å; F517-L519 HydrophobicContact CE1-CD1 4.28Å; F517-L519 HydrophobicContact CE1-CD2 4.28Å; F517-L519 HydrophobicContact CE1-CG 4.28Å; F517-L519 HydrophobicContact CZ-CB 4.13Å; F517-L519 HydrophobicContact CZ-CD1 3.97Å; F517-L519 HydrophobicContact CZ-CG 4.47Å; L519-V521 HydrophobicContact CB-CG1 4.37Å; L519-V521 HydrophobicContact CD2-CG1 3.74Å; L519-V521 HydrophobicContact CG-CG1 3.6Å; L519-V521 PolarHBondContact O-N 3.18Å; L519-E541 HydrophobicContact CD1-CG 4.15Å
520	P	92.4	Very high	91.1	Very high	37 Å²	37	43.1 Å²	43.1	24%	0.24	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	122.4	171.7	32.3	-34.9	0	0	0	108.9	L510 T542 T543	L510-P520 WeakPolarHBondContact O-CA 3.48Å; P520-T542 VanDerWaalsContact C-OG1 3.24Å; P520-T542 WeakPolarHBondContact CB-OG1 3.23Å; P520-T542 PolarHBondContact O-N 2.8Å; P520-T542 PolarHBondContact O-OG1 3.22Å; P520-T543 HydrophobicContact CB-CG2 4.06Å; P520-T543 HydrophobicContact CG-CG2 3.36Å; P520-T543 WeakPolarHBondContact CG-OG1 3.35Å
521	V	94.4	Very high	90.8	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	171.2	-176.3	-57.1	0	0	0	0	110.7	L510 V512 L519 W539 T540	L510-V521 CarbonylContact C-O 3.56Å; L510-V521 WeakPolarHBondContact CA-O 3.29Å; L510-V521 HydrophobicContact CB-CG2 3.8Å; L510-V521 PolarHBondContact N-O 3.11Å; L510-V521 PolarHBondContact O-N 2.68Å; V512-V521 HydrophobicContact CG2-CG1 4.44Å; V512-V521 HydrophobicContact CG2-CG2 3.69Å; L519-V521 HydrophobicContact CB-CG1 4.37Å; L519-V521 HydrophobicContact CD2-CG1 3.74Å; L519-V521 HydrophobicContact CG-CG1 3.6Å; L519-V521 PolarHBondContact O-N 3.18Å; V521-W539 HydrophobicContact CB-CB 4.23Å; V521-W539 HydrophobicContact CG2-CB 4.42Å; V521-W539 HydrophobicContact CG2-CD2 4.17Å; V521-W539 HydrophobicContact CG2-CE3 4.35Å; V521-W539 HydrophobicContact CG2-CG 4.22Å; V521-T540 CarbonylContact C-O 3.43Å; V521-T540 WeakPolarHBondContact CA-O 3.21Å; V521-T540 WeakPolarHBondContact CB-O 3.34Å
522	C	95.2	Very high	90.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.8	161	76.5	0	0	0	0	110.9	C412 K508 W539 T540 T542	C412-C522 HydrophobicContact CB-CB 3.66Å; C412-C522 WeakPolarHBondContact CB-SG 3.45Å; C412-C522 WeakPolarHBondContact SG-CB 3.4Å; C412-C522 CovalentContact SG-SG 2.02Å; C412-C522 PolarHBondContact SG-SG 3.4Å; K508-C522 WeakPolarHBondContact O-CA 3.19Å; K508-C522 WeakPolarHBondContact O-CB 3.41Å; C522-W539 CarbonylContact O-C 3.57Å; C522-W539 VanDerWaalsContact O-CA 3.3Å; C522-W539 WeakPolarHBondContact O-CA 3.47Å; C522-T540 PolarHBondContact N-O 2.74Å; C522-T540 PolarHBondContact O-N 3.3Å; C522-T540 WeakPolarHBondContact SG-CG2 3.41Å; C522-T542 HydrophobicContact CB-CG2 3.85Å
523	L	95.9	Very high	90.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.7	173.5	-172.9	69.3	0	0	0	109.4	C412 I413 M420 L510 A526 M537	C412-L523 CarbonylContact C-O 3.55Å; C412-L523 WeakPolarHBondContact CA-O 3.08Å; I413-L523 HydrophobicContact CD1-CD2 3.71Å; I413-L523 HydrophobicContact CD1-CG 3.95Å; I413-L523 HydrophobicContact CG1-CB 4.1Å; I413-L523 HydrophobicContact CG1-CD2 3.81Å; I413-L523 HydrophobicContact CG1-CG 3.79Å; I413-L523 WeakPolarHBondContact CG1-O 3.32Å; I413-L523 PolarHBondContact N-O 3.14Å; M420-L523 HydrophobicContact CE-CB 4.21Å; M420-L523 HydrophobicContact CE-CD1 3.74Å; M420-L523 HydrophobicContact CE-CD2 3.5Å; M420-L523 VanDerWaalsContact CE-CD2 3.5Å; M420-L523 HydrophobicContact CE-CG 4.02Å; L510-L523 HydrophobicContact CD1-CB 4.44Å; L523-A526 HydrophobicContact CD1-CB 4.17Å; L523-A526 HydrophobicContact CD2-CB 4.14Å; L523-M537 HydrophobicContact CD1-CB 3.94Å
524	V	95.8	Very high	91.1	Very high	11 Å²	11	45.3 Å²	45.3	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-32.8	176.5	-54.9	0	0	0	0	112.2	Q411 I538 T540 Y572	Q411-V524 HydrophobicContact CB-CG1 4.42Å; Q411-V524 HydrophobicContact CG-CB 4.34Å; Q411-V524 HydrophobicContact CG-CG1 3.68Å; V524-I538 HydrophobicContact CG2-CB 3.71Å; V524-I538 HydrophobicContact CG2-CG2 3.54Å; V524-I538 WeakPolarHBondContact CG2-O 3.36Å; V524-I538 PolarHBondContact N-O 2.84Å; V524-T540 HydrophobicContact CG1-CG2 3.43Å; V524-T540 VanDerWaalsContact CG1-CG2 3.43Å; V524-Y572 HydrophobicContact CG2-CE1 4.18Å; V524-Y572 WeakPolarHBondContact CG2-OH 3.27Å
525	K	96.5	Very high	91.5	Very high	46 Å²	46	46.4 Å²	46.4	20%	0.2	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	145.2	177.1	-168.6	165.7	179.7	168.3	0	110.3	Y536 M537 I538 E568 Y572	K525-Y536 WeakPolarHBondContact CE-OH 3.46Å; K525-Y536 HydrophobicContact CG-CE2 4.25Å; K525-M537 CarbonylContact O-C 3.6Å; K525-M537 WeakPolarHBondContact O-CA 3.42Å; K525-I538 HydrophobicContact CB-CB 4.23Å; K525-I538 HydrophobicContact CB-CD1 4.07Å; K525-I538 HydrophobicContact CB-CG1 4.23Å; K525-I538 HydrophobicContact CD-CD1 4.47Å; K525-I538 PolarHBondContact N-O 3.25Å; K525-I538 PolarHBondContact O-N 2.77Å; K525-E568 WeakPolarHBondContact CE-OE1 3.42Å; K525-E568 IonicContact NZ-OE1 2.71Å; K525-E568 PolarHBondContact NZ-OE1 3.31Å; K525-Y572 HydrophobicContact CB-CE1 4.44Å; K525-Y572 HydrophobicContact CD-CD1 4.11Å; K525-Y572 HydrophobicContact CD-CD2 3.72Å; K525-Y572 HydrophobicContact CD-CE2 4.28Å; K525-Y572 HydrophobicContact CD-CG 3.62Å
526	A	96.7	Very high	92.2	Very high	18 Å²	18	43.9 Å²	43.9	15%	0.149	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	149.3	170.7	0	0	0	0	0	110.3	L523 Y534 Y536 M537	L523-A526 HydrophobicContact CD1-CB 4.17Å; L523-A526 HydrophobicContact CD2-CB 4.14Å; A526-Y534 HydrophobicContact CB-CD1 3.74Å; A526-Y534 HydrophobicContact CB-CD2 3.97Å; A526-Y534 HydrophobicContact CB-CE1 3.83Å; A526-Y534 HydrophobicContact CB-CE2 4.06Å; A526-Y534 HydrophobicContact CB-CG 3.81Å; A526-Y536 WeakPolarHBondContact CA-O 3.45Å; A526-M537 HydrophobicContact CB-CB 4.18Å
527	G	94.7	Very high	92.9	Very high	3 Å²	3	37.2 Å²	37.2	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.3	-177.7	0	0	0	0	0	113.4	T535 Y536	G527-T535 WeakPolarHBondContact O-CA 3.49Å; G527-T535 PolarHBondContact O-N 2.76Å; G527-T535 PolarHBondContact O-OG1 2.77Å; G527-Y536 VanDerWaalsContact CA-CE1 3.49Å; G527-Y536 PolarHBondContact N-O 3.42Å; G527-Y536 VanDerWaalsContact N-O 3.11Å; G527-Y536 PolarHBondContact O-N 3.36Å; G527-Y536 VanDerWaalsContact O-N 3.09Å
528	P	93.4	Very high	93.6	Very high	52 Å²	52	35.6 Å²	35.6	34%	0.338	23%	0.23	S	C	.	.			cis	-75	147.9	-8.1	31.9	-34.4	0	0	0	111.6	T535	P528-T535 VanDerWaalsContact CD-OG1 3.29Å; P528-T535 WeakPolarHBondContact CD-OG1 3.46Å; P528-T535 HydrophobicContact CG-CG2 4.43Å
529	S	89	Confident	93.8	Very high	95 Å²	95	29.6 Å²	29.6	66%	0.664	20%	0.204	S	C	*	.	S	Bend	trans	-71.2	-31.3	178.6	55.5	0	0	0	0	113	K419	K419-S529 PolarHBondContact NZ-O 3.31Å
530	S	88.7	Confident	94	Very high	114 Å²	114	28.5 Å²	28.5	80%	0.797	20%	0.199	S	C	*	.	S	Bend	trans	-80.5	-12.5	179.7	55	0	0	0	0	114.3
531	G	88.6	Confident	94	Very high	20 Å²	20	28 Å²	28	21%	0.206	19%	0.193	C	C	.	.	S	Bend	trans	-72.1	155.7	-179.8	0	0	0	0	0	112.8	K419 T533	K419-G531 VanDerWaalsContact CE-O 3.29Å; K419-G531 WeakPolarHBondContact CE-O 3.44Å; K419-G531 PolarHBondContact NZ-O 3.41Å; G531-T533 PolarHBondContact O-N 2.9Å
532	G	92.5	Very high	93.9	Very high	70 Å²	70	29.1 Å²	29.1	72%	0.722	20%	0.2	S	C	*	.	S	Bend	trans	-66.9	-19.4	167.9	0	0	0	0	0	113
533	T	93.1	Very high	93.7	Very high	69 Å²	69	32.4 Å²	32.4	42%	0.423	22%	0.22	S	C	.	.	S	Bend	trans	-141.8	153.3	175	54.2	0	0	0	0	110.1	G531	G531-T533 PolarHBondContact O-N 2.9Å
534	Y	95.5	Very high	93.2	Very high	22 Å²	22	34.9 Å²	34.9	9%	0.086	25%	0.245	C	C	.	.			trans	-76.7	137.5	171.1	-63.6	-45.1	0	0	0	110.3	D416 K419 M420 W424 A526 R556	D416-Y534 HydrophobicContact CB-CE2 4.3Å; D416-Y534 WeakPolarHBondContact CB-OH 3.13Å; K419-Y534 HydrophobicContact CB-CD1 4.22Å; K419-Y534 HydrophobicContact CB-CD2 3.51Å; K419-Y534 HydrophobicContact CB-CE1 4.2Å; K419-Y534 HydrophobicContact CB-CE2 3.48Å; K419-Y534 VanDerWaalsContact CB-CE2 3.48Å; K419-Y534 HydrophobicContact CB-CG 3.89Å; K419-Y534 HydrophobicContact CD-CD1 4.15Å; K419-Y534 HydrophobicContact CD-CE1 3.64Å; K419-Y534 HydrophobicContact CD-CE2 4.25Å; K419-Y534 HydrophobicContact CG-CE2 4.46Å; K419-Y534 PolarHBondContact O-N 2.95Å; K419-Y534 VanDerWaalsContact O-N 3.14Å; M420-Y534 HydrophobicContact CE-CE2 4.25Å; M420-Y534 HydrophobicContact CG-CD2 3.94Å; M420-Y534 HydrophobicContact CG-CE2 4.11Å; W424-Y534 WeakPolarHBondContact CH2-O 3.42Å; A526-Y534 HydrophobicContact CB-CD1 3.74Å; A526-Y534 HydrophobicContact CB-CD2 3.97Å; A526-Y534 HydrophobicContact CB-CE1 3.83Å; A526-Y534 HydrophobicContact CB-CE2 4.06Å; A526-Y534 HydrophobicContact CB-CG 3.81Å; Y534-R556 WeakPolarHBondContact O-CD 3.35Å; Y534-R556 PolarHBondContact O-NE 2.89Å
535	T	95.2	Very high	92.7	Very high	38 Å²	38	38.9 Å²	38.9	23%	0.233	28%	0.28	C	S	.	.	S	Bend	trans	-87.8	-32.4	172.1	61.4	0	0	0	0	112.1	G527 P528 A555 R556	G527-T535 WeakPolarHBondContact O-CA 3.49Å; G527-T535 PolarHBondContact O-N 2.76Å; G527-T535 PolarHBondContact O-OG1 2.77Å; P528-T535 VanDerWaalsContact CD-OG1 3.29Å; P528-T535 WeakPolarHBondContact CD-OG1 3.46Å; P528-T535 HydrophobicContact CG-CG2 4.43Å; T535-A555 WeakPolarHBondContact O-CA 3.24Å; T535-R556 PolarHBondContact O-N 2.96Å
536	Y	96	Very high	92.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	157.2	173	76.7	-92.2	0	0	0	110.7	K525 A526 G527 I538 F554 F561 N565 E568 V569	K525-Y536 WeakPolarHBondContact CE-OH 3.46Å; K525-Y536 HydrophobicContact CG-CE2 4.25Å; A526-Y536 WeakPolarHBondContact CA-O 3.45Å; G527-Y536 VanDerWaalsContact CA-CE1 3.49Å; G527-Y536 PolarHBondContact N-O 3.42Å; G527-Y536 VanDerWaalsContact N-O 3.11Å; G527-Y536 PolarHBondContact O-N 3.36Å; G527-Y536 VanDerWaalsContact O-N 3.09Å; Y536-I538 HydrophobicContact CD2-CG1 4.37Å; Y536-I538 HydrophobicContact CE2-CG1 4.49Å; Y536-F554 CarbonylContact C-O 3.6Å; Y536-F554 WeakPolarHBondContact CA-O 3.45Å; Y536-F554 WeakPolarHBondContact CB-O 3.43Å; Y536-F561 HydrophobicContact CG-CD2 4.48Å; Y536-F561 HydrophobicContact CG-CE2 4.21Å; Y536-N565 HydrophobicContact CD1-CB 3.78Å; Y536-N565 WeakPolarHBondContact CD1-OD1 3.28Å; Y536-N565 HydrophobicContact CE1-CB 4.08Å; Y536-N565 WeakPolarHBondContact CE1-OD1 3.5Å; Y536-E568 PolarHBondContact OH-OE1 3.25Å; Y536-E568 PolarHBondContact OH-OE2 3.32Å; Y536-V569 HydrophobicContact CD2-CG2 3.67Å; Y536-V569 HydrophobicContact CE1-CG2 4.39Å; Y536-V569 HydrophobicContact CE2-CG2 3.53Å; Y536-V569 HydrophobicContact CG-CG2 4.21Å
537	M	96.3	Very high	91.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	149	172.1	61.5	-173.9	-178.9	0	0	110.5	M420 W424 M476 L523 K525 A526 W539 F554	M420-M537 HydrophobicContact CG-SD 4.38Å; W424-M537 HydrophobicContact CB-CE 4.38Å; W424-M537 HydrophobicContact CD2-CE 3.35Å; W424-M537 HydrophobicContact CD2-SD 4.17Å; W424-M537 HydrophobicContact CE3-CE 3.75Å; W424-M537 HydrophobicContact CE3-CG 4.15Å; W424-M537 HydrophobicContact CE3-SD 4.29Å; W424-M537 HydrophobicContact CG-CE 3.64Å; W424-M537 HydrophobicContact CH2-CB 4.44Å; W424-M537 HydrophobicContact CH2-CE 4.36Å; W424-M537 HydrophobicContact CH2-CG 4Å; W424-M537 HydrophobicContact CH2-SD 3.89Å; W424-M537 HydrophobicContact CZ2-CE 4.04Å; W424-M537 HydrophobicContact CZ2-CG 4.46Å; W424-M537 HydrophobicContact CZ2-SD 3.76Å; W424-M537 HydrophobicContact CZ3-CB 4.49Å; W424-M537 HydrophobicContact CZ3-CE 4.23Å; W424-M537 HydrophobicContact CZ3-CG 3.83Å; W424-M537 HydrophobicContact CZ3-SD 4.16Å; M476-M537 HydrophobicContact CE-CE 3.75Å; L523-M537 HydrophobicContact CD1-CB 3.94Å; K525-M537 CarbonylContact O-C 3.6Å; K525-M537 WeakPolarHBondContact O-CA 3.42Å; A526-M537 HydrophobicContact CB-CB 4.18Å; M537-W539 HydrophobicContact CE-CH2 3.51Å; M537-W539 HydrophobicContact CE-CZ2 3.14Å; M537-W539 HydrophobicContact CE-CZ3 4.31Å; M537-W539 HydrophobicContact SD-CH2 4.43Å; M537-W539 HydrophobicContact SD-CZ2 3.48Å; M537-W539 WeakPolarHBondContact SD-CZ2 3.25Å; M537-F554 HydrophobicContact CE-CB 3.77Å; M537-F554 HydrophobicContact CE-CD2 4.19Å; M537-F554 HydrophobicContact CE-CG 3.99Å; M537-F554 HydrophobicContact CG-CB 3.91Å; M537-F554 PolarHBondContact N-O 2.62Å; M537-F554 PolarHBondContact O-N 3.21Å
538	I	95.8	Very high	91.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.7	176.7	-48.8	-177.1	0	0	0	107.5	V524 K525 Y536 H551 H552 V553 V569 Y572	V524-I538 HydrophobicContact CG2-CB 3.71Å; V524-I538 HydrophobicContact CG2-CG2 3.54Å; V524-I538 WeakPolarHBondContact CG2-O 3.36Å; V524-I538 PolarHBondContact N-O 2.84Å; K525-I538 HydrophobicContact CB-CB 4.23Å; K525-I538 HydrophobicContact CB-CD1 4.07Å; K525-I538 HydrophobicContact CB-CG1 4.23Å; K525-I538 HydrophobicContact CD-CD1 4.47Å; K525-I538 PolarHBondContact N-O 3.25Å; K525-I538 PolarHBondContact O-N 2.77Å; Y536-I538 HydrophobicContact CD2-CG1 4.37Å; Y536-I538 HydrophobicContact CE2-CG1 4.49Å; I538-H551 HydrophobicContact CG2-CB 4Å; I538-H552 CarbonylContact C-O 3.56Å; I538-H552 VanDerWaalsContact CA-O 3.27Å; I538-H552 WeakPolarHBondContact CA-O 3.4Å; I538-V553 HydrophobicContact CD1-CG2 4.34Å; I538-V553 HydrophobicContact CG1-CG1 4.49Å; I538-V553 HydrophobicContact CG1-CG2 4.17Å; I538-V553 HydrophobicContact CG2-CG2 4.28Å; I538-V569 HydrophobicContact CD1-CG1 3.83Å; I538-V569 HydrophobicContact CD1-CG2 4.29Å; I538-Y572 HydrophobicContact CD1-CD1 3.42Å; I538-Y572 VanDerWaalsContact CD1-CD1 3.42Å; I538-Y572 HydrophobicContact CD1-CE1 3.65Å; I538-Y572 HydrophobicContact CD1-CG 4.43Å; I538-Y572 HydrophobicContact CG2-CE1 4.21Å
539	W	95.1	Very high	91.5	Very high	4 Å²	4	48 Å²	48	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	156.1	172.8	-64.5	-20.3	0	0	0	110.8	M476 I497 V512 V521 C522 M537 H551 H552 F554	M476-W539 HydrophobicContact CE-CH2 3.49Å; M476-W539 VanDerWaalsContact CE-CH2 3.49Å; M476-W539 HydrophobicContact CE-CZ2 4.47Å; M476-W539 HydrophobicContact CE-CZ3 3.81Å; M476-W539 HydrophobicContact SD-CH2 3.51Å; M476-W539 VanDerWaalsContact SD-CH2 3.51Å; M476-W539 HydrophobicContact SD-CZ3 4.05Å; I497-W539 HydrophobicContact CD1-CH2 3.64Å; I497-W539 HydrophobicContact CD1-CZ2 3.54Å; I497-W539 HydrophobicContact CG1-CH2 3.92Å; I497-W539 HydrophobicContact CG1-CZ2 4.13Å; V512-W539 HydrophobicContact CG1-CZ3 4.34Å; V512-W539 HydrophobicContact CG2-CE3 3.92Å; V512-W539 HydrophobicContact CG2-CH2 3.76Å; V512-W539 HydrophobicContact CG2-CZ2 4.5Å; V512-W539 HydrophobicContact CG2-CZ3 3.45Å; V512-W539 VanDerWaalsContact CG2-CZ3 3.45Å; V521-W539 HydrophobicContact CB-CB 4.23Å; V521-W539 HydrophobicContact CG2-CB 4.42Å; V521-W539 HydrophobicContact CG2-CD2 4.17Å; V521-W539 HydrophobicContact CG2-CE3 4.35Å; V521-W539 HydrophobicContact CG2-CG 4.22Å; C522-W539 CarbonylContact O-C 3.57Å; C522-W539 VanDerWaalsContact O-CA 3.3Å; C522-W539 WeakPolarHBondContact O-CA 3.47Å; M537-W539 HydrophobicContact CE-CH2 3.51Å; M537-W539 HydrophobicContact CE-CZ2 3.14Å; M537-W539 HydrophobicContact CE-CZ3 4.31Å; M537-W539 HydrophobicContact SD-CH2 4.43Å; M537-W539 HydrophobicContact SD-CZ2 3.48Å; M537-W539 WeakPolarHBondContact SD-CZ2 3.25Å; W539-H551 CarbonylContact O-C 3.51Å; W539-H551 WeakPolarHBondContact O-CA 3.43Å; W539-H552 HydrophobicContact CB-CB 4.39Å; W539-H552 PolarHBondContact N-O 3.2Å; W539-H552 PolarHBondContact O-N 2.88Å; W539-F554 HydrophobicContact CD2-CD2 4.17Å; W539-F554 AromaticContact CD2-CE2 3.93Å; W539-F554 HydrophobicContact CD2-CE2 3.93Å; W539-F554 AromaticContact CE3-CD2 3.89Å; W539-F554 HydrophobicContact CE3-CD2 3.89Å; W539-F554 AromaticContact CE3-CE2 3.26Å; W539-F554 HydrophobicContact CE3-CE2 3.26Å; W539-F554 AromaticContact CE3-CZ 3.87Å; W539-F554 HydrophobicContact CE3-CZ 3.87Å; W539-F554 HydrophobicContact CZ3-CD2 4.18Å; W539-F554 AromaticContact CZ3-CE2 3.62Å; W539-F554 HydrophobicContact CZ3-CE2 3.62Å; W539-F554 AromaticContact CZ3-CZ 3.84Å; W539-F554 HydrophobicContact CZ3-CZ 3.84Å
540	T	94	Very high	91.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.7	162.3	-172	0	0	0	0	109.8	C409 V521 C522 V524 C548 S550	C409-T540 HydrophobicContact CB-CG2 4.32Å; V521-T540 CarbonylContact C-O 3.43Å; V521-T540 WeakPolarHBondContact CA-O 3.21Å; V521-T540 WeakPolarHBondContact CB-O 3.34Å; C522-T540 PolarHBondContact N-O 2.74Å; C522-T540 PolarHBondContact O-N 3.3Å; C522-T540 WeakPolarHBondContact SG-CG2 3.41Å; V524-T540 HydrophobicContact CG1-CG2 3.43Å; V524-T540 VanDerWaalsContact CG1-CG2 3.43Å; T540-C548 VanDerWaalsContact OG1-CA 3.26Å; T540-C548 WeakPolarHBondContact OG1-CA 3.31Å; T540-S550 VanDerWaalsContact CA-O 3.29Å; T540-S550 WeakPolarHBondContact CA-O 3.5Å; T540-S550 PolarHBondContact OG1-O 3.33Å
541	E	92.3	Very high	91.7	Very high	25 Å²	25	38.2 Å²	38.2	12%	0.117	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	135.3	169.1	-61.8	177.7	-132.5	0	0	109.9	A433 L519 C548 S550 H552	A433-E541 WeakPolarHBondContact CB-OE1 3.35Å; L519-E541 HydrophobicContact CD1-CG 4.15Å; E541-C548 PolarHBondContact O-N 2.85Å; E541-S550 PolarHBondContact N-O 3.2Å; E541-S550 WeakPolarHBondContact OE1-CB 3.3Å; E541-S550 PolarHBondContact OE1-OG 3.37Å; E541-H552 IonicContact OE1-CE1 3.31Å; E541-H552 IonicContact OE1-NE2 3.53Å; E541-H552 PolarHBondContact OE1-NE2 3.5Å; E541-H552 VanDerWaalsContact OE1-NE2 3.16Å
542	T	92.4	Very high	91.8	Very high	24 Å²	24	37.5 Å²	37.5	15%	0.147	24%	0.236	C	C	.	.	S	Bend	trans	-99.5	2.5	177.1	53.7	0	0	0	0	112.7	L408 P520 C522	L408-T542 HydrophobicContact CD2-CG2 4.09Å; P520-T542 VanDerWaalsContact C-OG1 3.24Å; P520-T542 WeakPolarHBondContact CB-OG1 3.23Å; P520-T542 PolarHBondContact O-N 2.8Å; P520-T542 PolarHBondContact O-OG1 3.22Å; C522-T542 HydrophobicContact CB-CG2 3.85Å
543	T	90.1	Very high	91.9	Very high	69 Å²	69	34.2 Å²	34.2	42%	0.423	20%	0.202	S	C	.	.	S	Bend	trans	-135.1	168.4	178.1	66.6	0	0	0	0	111.2	P520	P520-T543 HydrophobicContact CB-CG2 4.06Å; P520-T543 HydrophobicContact CG-CG2 3.36Å; P520-T543 WeakPolarHBondContact CG-OG1 3.35Å
544	G	86.4	Confident	91.9	Very high	52 Å²	52	31.2 Å²	31.2	54%	0.536	18%	0.183	S	C	.	.	S	Bend	trans	87.9	178	178	0	0	0	0	0	114.1	N546 H547	G544-N546 PolarHBondContact O-N 3.45Å; G544-N546 VanDerWaalsContact O-N 3.15Å; G544-H547 WeakPolarHBondContact O-CB 3.31Å; G544-H547 PolarHBondContact O-N 3.18Å; G544-H547 VanDerWaalsContact O-N 3.17Å; G544-H547 PolarHBondContact O-ND1 3.19Å
545	A	84.6	Confident	91.8	Very high	96 Å²	96	30.1 Å²	30.1	79%	0.793	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.3	-177.9	0	0	0	0	0	113.1
546	N	83.8	Confident	91.6	Very high	52 Å²	52	30 Å²	30	28%	0.278	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	23.7	-177.8	-59.9	-30.9	0	0	0	112.4	G544 C548 R549 S550 L583	G544-N546 PolarHBondContact O-N 3.45Å; G544-N546 VanDerWaalsContact O-N 3.15Å; N546-C548 PolarHBondContact O-N 2.66Å; N546-R549 PolarHBondContact O-N 3.11Å; N546-S550 PolarHBondContact O-N 3.04Å; N546-L583 HydrophobicContact CB-CD1 3.6Å; N546-L583 WeakPolarHBondContact OD1-CD1 3.41Å
547	H	89.2	Confident	91.2	Very high	105 Å²	105	34.8 Å²	34.8	49%	0.486	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	136.1	176.7	67.9	-82.9	0	0	0	109.9	G544 R549	G544-H547 WeakPolarHBondContact O-CB 3.31Å; G544-H547 PolarHBondContact O-N 3.18Å; G544-H547 VanDerWaalsContact O-N 3.17Å; G544-H547 PolarHBondContact O-ND1 3.19Å; H547-R549 PolarHBondContact O-N 3.47Å
548	C	91.8	Very high	90.6	Very high	25 Å²	25	34.9 Å²	34.9	17%	0.169	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	5.4	179.7	-49.3	0	0	0	0	116.1	C409 Q411 T540 E541 N546	C409-C548 WeakPolarHBondContact CA-SG 3.3Å; C409-C548 HydrophobicContact CB-CB 3.54Å; C409-C548 WeakPolarHBondContact CB-SG 2.96Å; C409-C548 WeakPolarHBondContact SG-CA 3.13Å; C409-C548 WeakPolarHBondContact SG-CB 3.19Å; C409-C548 CovalentContact SG-SG 2.02Å; C409-C548 PolarHBondContact SG-SG 3Å; Q411-C548 PolarHBondContact NE2-O 3.24Å; T540-C548 VanDerWaalsContact OG1-CA 3.26Å; T540-C548 WeakPolarHBondContact OG1-CA 3.31Å; E541-C548 PolarHBondContact O-N 2.85Å; N546-C548 PolarHBondContact O-N 2.66Å
549	R	91	Very high	90.1	Very high	128 Å²	128	38.3 Å²	38.3	48%	0.483	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-11.8	178.4	-58.5	-177.5	172.7	178.3	-3.2	115	N546 H547 H551 R581 L583	N546-R549 PolarHBondContact O-N 3.11Å; H547-R549 PolarHBondContact O-N 3.47Å; R549-H551 PolarHBondContact O-N 3.47Å; R549-R581 WeakPolarHBondContact CA-O 3.35Å; R549-R581 WeakPolarHBondContact CG-O 3.31Å; R549-L583 HydrophobicContact CB-CD1 3.9Å; R549-L583 HydrophobicContact CB-CG 3.89Å; R549-L583 PolarHBondContact O-N 3.44Å
550	S	90.4	Very high	89.8	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.014	22%	0.222	C	C	.	.			trans	-95.3	89.3	-178.4	-168.1	0	0	0	0	109.5	N430 T540 E541 N546 H552	N430-S550 WeakPolarHBondContact CB-OG 3.37Å; N430-S550 PolarHBondContact ND2-OG 2.79Å; T540-S550 VanDerWaalsContact CA-O 3.29Å; T540-S550 WeakPolarHBondContact CA-O 3.5Å; T540-S550 PolarHBondContact OG1-O 3.33Å; E541-S550 PolarHBondContact N-O 3.2Å; E541-S550 WeakPolarHBondContact OE1-CB 3.3Å; E541-S550 PolarHBondContact OE1-OG 3.37Å; N546-S550 PolarHBondContact O-N 3.04Å; S550-H552 PolarHBondContact O-CD2 3.01Å
551	H	91.7	Very high	89.7	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	150.9	177.6	-69.6	-46.1	0	0	0	112.3	Q411 I538 W539 R549 L573 L582 M585	Q411-H551 PolarHBondContact NE2-CE1 2.81Å; Q411-H551 VanDerWaalsContact NE2-CE1 3.26Å; I538-H551 HydrophobicContact CG2-CB 4Å; W539-H551 CarbonylContact O-C 3.51Å; W539-H551 WeakPolarHBondContact O-CA 3.43Å; R549-H551 PolarHBondContact O-N 3.47Å; H551-L573 HydrophobicContact CB-CD2 4.25Å; H551-L582 HydrophobicContact CB-CD1 3.74Å; H551-L582 WeakPolarHBondContact CD2-CD1 3.34Å; H551-M585 HydrophobicContact CB-CE 4.14Å; H551-M585 HydrophobicContact CB-SD 3.77Å; H551-M585 WeakPolarHBondContact O-CE 3.33Å
552	H	91.7	Very high	89.5	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.028	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	118.6	174.2	-66.5	-98.1	0	0	0	108.7	Q426 Y428 I538 W539 E541 S550 F554	Q426-H552 PolarHBondContact NE2-ND1 2.88Å; Y428-H552 WeakPolarHBondContact O-CA 3.44Å; I538-H552 CarbonylContact C-O 3.56Å; I538-H552 VanDerWaalsContact CA-O 3.27Å; I538-H552 WeakPolarHBondContact CA-O 3.4Å; W539-H552 HydrophobicContact CB-CB 4.39Å; W539-H552 PolarHBondContact N-O 3.2Å; W539-H552 PolarHBondContact O-N 2.88Å; E541-H552 IonicContact OE1-CE1 3.31Å; E541-H552 IonicContact OE1-NE2 3.53Å; E541-H552 PolarHBondContact OE1-NE2 3.5Å; E541-H552 VanDerWaalsContact OE1-NE2 3.16Å; S550-H552 PolarHBondContact O-CD2 3.01Å; H552-F554 HydrophobicContact CB-CD2 4.28Å; H552-F554 HydrophobicContact CB-CE2 3.5Å; H552-F554 HydrophobicContact CB-CZ 4.18Å
553	V	93	Very high	89.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.4	-178.6	-177	0	0	0	0	108.6	Q426 I427 Y428 I538 F561 V569 L573 M585	Q426-V553 CarbonylContact C-O 3.55Å; I427-V553 HydrophobicContact CB-CG1 4.4Å; I427-V553 PolarHBondContact N-O 3.34Å; Y428-V553 HydrophobicContact CD2-CB 3.86Å; Y428-V553 HydrophobicContact CD2-CG1 4.12Å; Y428-V553 HydrophobicContact CD2-CG2 3.97Å; Y428-V553 HydrophobicContact CG-CB 4.45Å; Y428-V553 HydrophobicContact CG-CG2 4.48Å; Y428-V553 PolarHBondContact N-O 2.9Å; Y428-V553 PolarHBondContact O-N 2.88Å; I538-V553 HydrophobicContact CD1-CG2 4.34Å; I538-V553 HydrophobicContact CG1-CG1 4.49Å; I538-V553 HydrophobicContact CG1-CG2 4.17Å; I538-V553 HydrophobicContact CG2-CG2 4.28Å; V553-F561 HydrophobicContact CG1-CE2 3.91Å; V553-F561 HydrophobicContact CG1-CZ 3.72Å; V553-V569 HydrophobicContact CG1-CG1 4.1Å; V553-V569 HydrophobicContact CG2-CG1 4.17Å; V553-L573 HydrophobicContact CG2-CD1 4.17Å; V553-M585 HydrophobicContact CG2-CE 4.46Å
554	F	92.9	Very high	89.6	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.5	175.1	-62.4	-92.8	0	0	0	109.9	W424 T425 Q426 M476 Y536 M537 W539 H552	W424-F554 HydrophobicContact CB-CB 4.37Å; W424-F554 HydrophobicContact CB-CD1 4.32Å; W424-F554 HydrophobicContact CD2-CB 4.44Å; W424-F554 HydrophobicContact CE3-CB 3.84Å; T425-F554 CarbonylContact O-C 3.6Å; T425-F554 WeakPolarHBondContact O-CA 3.4Å; Q426-F554 HydrophobicContact CB-CD1 3.72Å; Q426-F554 HydrophobicContact CB-CE1 3.54Å; Q426-F554 HydrophobicContact CB-CZ 4.32Å; Q426-F554 HydrophobicContact CG-CD1 3.98Å; Q426-F554 HydrophobicContact CG-CE1 3.63Å; Q426-F554 HydrophobicContact CG-CE2 4.5Å; Q426-F554 HydrophobicContact CG-CZ 3.91Å; M476-F554 HydrophobicContact CE-CD1 3.85Å; M476-F554 HydrophobicContact CE-CE1 3.9Å; M476-F554 HydrophobicContact CE-CG 4.38Å; M476-F554 HydrophobicContact CE-CZ 4.47Å; Y536-F554 CarbonylContact C-O 3.6Å; Y536-F554 WeakPolarHBondContact CA-O 3.45Å; Y536-F554 WeakPolarHBondContact CB-O 3.43Å; M537-F554 HydrophobicContact CE-CB 3.77Å; M537-F554 HydrophobicContact CE-CD2 4.19Å; M537-F554 HydrophobicContact CE-CG 3.99Å; M537-F554 HydrophobicContact CG-CB 3.91Å; M537-F554 PolarHBondContact N-O 2.62Å; M537-F554 PolarHBondContact O-N 3.21Å; W539-F554 HydrophobicContact CD2-CD2 4.17Å; W539-F554 AromaticContact CD2-CE2 3.93Å; W539-F554 HydrophobicContact CD2-CE2 3.93Å; W539-F554 AromaticContact CE3-CD2 3.89Å; W539-F554 HydrophobicContact CE3-CD2 3.89Å; W539-F554 AromaticContact CE3-CE2 3.26Å; W539-F554 HydrophobicContact CE3-CE2 3.26Å; W539-F554 AromaticContact CE3-CZ 3.87Å; W539-F554 HydrophobicContact CE3-CZ 3.87Å; W539-F554 HydrophobicContact CZ3-CD2 4.18Å; W539-F554 AromaticContact CZ3-CE2 3.62Å; W539-F554 HydrophobicContact CZ3-CE2 3.62Å; W539-F554 AromaticContact CZ3-CZ 3.84Å; W539-F554 HydrophobicContact CZ3-CZ 3.84Å; H552-F554 HydrophobicContact CB-CD2 4.28Å; H552-F554 HydrophobicContact CB-CE2 3.5Å; H552-F554 HydrophobicContact CB-CZ 4.18Å
555	A	93.7	Very high	90	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151.1	173	0	0	0	0	0	110.6	T425 I427 T535 F561	T425-A555 PolarHBondContact N-O 3.06Å; T425-A555 PolarHBondContact O-N 2.99Å; I427-A555 HydrophobicContact CD1-CB 4.15Å; I427-A555 HydrophobicContact CG1-CB 3.86Å; T535-A555 WeakPolarHBondContact O-CA 3.24Å; A555-F561 HydrophobicContact CB-CB 3.6Å; A555-F561 HydrophobicContact CB-CD2 3.58Å; A555-F561 HydrophobicContact CB-CE2 4.47Å; A555-F561 HydrophobicContact CB-CG 3.73Å
556	R	91.1	Very high	90.3	Very high	34 Å²	34	46.7 Å²	46.7	13%	0.128	21%	0.214	C	C	.	.	S	Bend	trans	-68	-38.5	175.4	-68.5	-166.8	-179.8	-97.7	-2.5	112.6	K419 V421 W424 Y534 T535	K419-R556 PolarHBondContact O-NH2 3.46Å; V421-R556 VanDerWaalsContact O-CZ 3.24Å; V421-R556 PolarHBondContact O-NH1 3.3Å; V421-R556 PolarHBondContact O-NH2 2.87Å; W424-R556 HydrophobicContact CD2-CG 4.5Å; W424-R556 HydrophobicContact CE3-CG 4.14Å; W424-R556 HydrophobicContact CH2-CG 4.1Å; W424-R556 HydrophobicContact CZ2-CG 4.44Å; W424-R556 HydrophobicContact CZ3-CG 3.94Å; Y534-R556 WeakPolarHBondContact O-CD 3.35Å; Y534-R556 PolarHBondContact O-NE 2.89Å; T535-R556 PolarHBondContact O-N 2.96Å
557	H	88	Confident	90.8	Very high	102 Å²	102	51.7 Å²	51.7	47%	0.472	24%	0.236	S	C	.	.			trans	-139.3	120.4	177.3	-49.6	-73.2	0	0	0	109.5	D559 S560 F561	H557-D559 VanDerWaalsContact C-N 3.29Å; H557-D559 PolarHBondContact O-N 2.6Å; H557-S560 WeakPolarHBondContact CB-OG 3.14Å; H557-S560 PolarHBondContact O-N 2.71Å; H557-S560 PolarHBondContact O-OG 2.89Å; H557-F561 WeakPolarHBondContact O-CB 3.11Å; H557-F561 PolarHBondContact O-N 2.7Å
558	A	84.7	Confident	91	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-56.7	-42	-179.2	0	0	0	0	0	112.1	I427 S560 F561 H562 L595	I427-A558 HydrophobicContact CD1-CB 3.88Å; A558-S560 PolarHBondContact O-N 3.05Å; A558-F561 WeakPolarHBondContact O-CB 3.49Å; A558-F561 PolarHBondContact O-N 2.97Å; A558-H562 PolarHBondContact O-CD2 3.34Å; A558-H562 PolarHBondContact O-N 3.49Å; A558-L595 HydrophobicContact CB-CD2 4.36Å
559	D	84.9	Confident	91.1	Very high	73 Å²	73	49.6 Å²	49.6	39%	0.39	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-45.9	-179.9	-62.2	-17	0	0	0	112.8	H557 F561 R563 M592	H557-D559 VanDerWaalsContact C-N 3.29Å; H557-D559 PolarHBondContact O-N 2.6Å; D559-F561 VanDerWaalsContact C-N 3.29Å; D559-F561 PolarHBondContact O-N 2.69Å; D559-R563 PolarHBondContact O-N 2.93Å; D559-M592 WeakPolarHBondContact OD1-CE 3.48Å; D559-M592 VanDerWaalsContact OD1-SD 3.35Å
560	S	87.7	Confident	91.2	Very high	23 Å²	23	44.5 Å²	44.5	16%	0.161	21%	0.212	C	C	.	.	H	α-helix	trans	-67.1	-35.3	177.3	70.8	0	0	0	0	111.3	H557 A558 R563 E564	H557-S560 WeakPolarHBondContact CB-OG 3.14Å; H557-S560 PolarHBondContact O-N 2.71Å; H557-S560 PolarHBondContact O-OG 2.89Å; A558-S560 PolarHBondContact O-N 3.05Å; S560-R563 PolarHBondContact O-N 3.46Å; S560-E564 VanDerWaalsContact O-CB 3.31Å; S560-E564 WeakPolarHBondContact O-CB 3.26Å; S560-E564 PolarHBondContact O-N 3.29Å
561	F	91.5	Very high	91.4	Very high	1 Å²	1	49.5 Å²	49.5	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-49	178.6	178.2	-94	0	0	0	111.4	I427 Y428 Y536 V553 A555 H557 A558 D559 R563 E564 N565 I566 V569	I427-F561 HydrophobicContact CB-CE1 4.46Å; I427-F561 HydrophobicContact CG1-CD1 4.14Å; I427-F561 HydrophobicContact CG1-CE1 4.38Å; I427-F561 HydrophobicContact CG1-CG 4.37Å; I427-F561 HydrophobicContact CG2-CD1 4.12Å; I427-F561 HydrophobicContact CG2-CE1 3.93Å; Y428-F561 AromaticContact CE2-CE1 3.98Å; Y428-F561 HydrophobicContact CE2-CE1 3.98Å; Y428-F561 HydrophobicContact CE2-CZ 4.37Å; Y536-F561 HydrophobicContact CG-CD2 4.48Å; Y536-F561 HydrophobicContact CG-CE2 4.21Å; V553-F561 HydrophobicContact CG1-CE2 3.91Å; V553-F561 HydrophobicContact CG1-CZ 3.72Å; A555-F561 HydrophobicContact CB-CB 3.6Å; A555-F561 HydrophobicContact CB-CD2 3.58Å; A555-F561 HydrophobicContact CB-CE2 4.47Å; A555-F561 HydrophobicContact CB-CG 3.73Å; H557-F561 WeakPolarHBondContact O-CB 3.11Å; H557-F561 PolarHBondContact O-N 2.7Å; A558-F561 WeakPolarHBondContact O-CB 3.49Å; A558-F561 PolarHBondContact O-N 2.97Å; D559-F561 VanDerWaalsContact C-N 3.29Å; D559-F561 PolarHBondContact O-N 2.69Å; F561-R563 VanDerWaalsContact C-N 3.29Å; F561-R563 PolarHBondContact O-N 2.86Å; F561-E564 PolarHBondContact O-N 3.46Å; F561-N565 HydrophobicContact CD2-CB 3.88Å; F561-N565 HydrophobicContact CE2-CB 4.11Å; F561-N565 CarbonylContact O-C 3.54Å; F561-N565 WeakPolarHBondContact O-CA 3.41Å; F561-N565 PolarHBondContact O-N 3.47Å; F561-I566 PolarHBondContact O-N 3.37Å; F561-V569 HydrophobicContact CE2-CB 4.31Å; F561-V569 HydrophobicContact CE2-CG2 3.82Å; F561-V569 HydrophobicContact CZ-CB 3.95Å; F561-V569 HydrophobicContact CZ-CG1 3.98Å; F561-V569 HydrophobicContact CZ-CG2 3.99Å
562	H	89.2	Confident	91.5	Very high	42 Å²	42	50.5 Å²	50.5	19%	0.194	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-36.2	178.1	-75.4	-62.6	0	0	0	112.8	A558 I566	A558-H562 PolarHBondContact O-CD2 3.34Å; A558-H562 PolarHBondContact O-N 3.49Å; H562-I566 WeakPolarHBondContact ND1-CD1 3.03Å; H562-I566 WeakPolarHBondContact O-CG2 3.23Å
563	R	91.5	Very high	91.5	Very high	183 Å²	183	51.3 Å²	51.3	69%	0.691	25%	0.246	S	C	*	.	H	α-helix	trans	-77.5	-37.1	-179.7	-78.1	176.5	41.3	-113.7	-25.9	114.1	D559 S560 F561	D559-R563 PolarHBondContact O-N 2.93Å; S560-R563 PolarHBondContact O-N 3.46Å; F561-R563 VanDerWaalsContact C-N 3.29Å; F561-R563 PolarHBondContact O-N 2.86Å
564	E	93.6	Very high	91.4	Very high	115 Å²	115	55 Å²	55	54%	0.537	26%	0.262	S	S	.	.	H	α-helix	trans	-116	-24.4	-163	-62.1	169.3	-165.1	0	0	113.2	S560 F561	S560-E564 VanDerWaalsContact O-CB 3.31Å; S560-E564 WeakPolarHBondContact O-CB 3.26Å; S560-E564 PolarHBondContact O-N 3.29Å; F561-E564 PolarHBondContact O-N 3.46Å
565	N	93.9	Very high	91.4	Very high	17 Å²	17	59.7 Å²	59.7	9%	0.091	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-10.4	-167.8	-59.7	-74.1	0	0	0	114.3	Y536 F561 E567 E568 V569	Y536-N565 HydrophobicContact CD1-CB 3.78Å; Y536-N565 WeakPolarHBondContact CD1-OD1 3.28Å; Y536-N565 HydrophobicContact CE1-CB 4.08Å; Y536-N565 WeakPolarHBondContact CE1-OD1 3.5Å; F561-N565 HydrophobicContact CD2-CB 3.88Å; F561-N565 HydrophobicContact CE2-CB 4.11Å; F561-N565 CarbonylContact O-C 3.54Å; F561-N565 WeakPolarHBondContact O-CA 3.41Å; F561-N565 PolarHBondContact O-N 3.47Å; N565-E567 VanDerWaalsContact C-N 3.35Å; N565-E567 PolarHBondContact O-N 3.01Å; N565-E568 PolarHBondContact O-N 2.62Å; N565-V569 PolarHBondContact O-N 3.38Å
566	I	91.8	Very high	91.3	Very high	64 Å²	64	60 Å²	60	33%	0.328	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-39.7	-174.3	-169.4	160.3	0	0	0	113.2	F561 H562 G570	F561-I566 PolarHBondContact O-N 3.37Å; H562-I566 WeakPolarHBondContact ND1-CD1 3.03Å; H562-I566 WeakPolarHBondContact O-CG2 3.23Å; I566-G570 WeakPolarHBondContact O-CA 3.47Å; I566-G570 PolarHBondContact O-N 3.4Å
567	E	93.1	Very high	91.2	Very high	157 Å²	157	64 Å²	64	73%	0.734	30%	0.302	S	S	*	.	H	α-helix	trans	-66.8	-43.8	179.6	-65.6	-174.5	173.8	0	0	110.8	N565 G570 N571	N565-E567 VanDerWaalsContact C-N 3.35Å; N565-E567 PolarHBondContact O-N 3.01Å; E567-G570 PolarHBondContact O-N 2.91Å; E567-N571 VanDerWaalsContact O-CB 3.32Å; E567-N571 WeakPolarHBondContact O-CB 3.45Å; E567-N571 PolarHBondContact O-N 2.96Å; E567-N571 PolarHBondContact O-ND2 2.75Å; E567-N571 VanDerWaalsContact O-ND2 3.13Å
568	E	94.9	Very high	91.3	Very high	85 Å²	85	64.7 Å²	64.7	40%	0.397	31%	0.305	S	S	.	.	H	α-helix	trans	-65	-45	-179.9	-164.2	-158.5	158.4	0	0	112	K525 Y536 N565 Y572	K525-E568 WeakPolarHBondContact CE-OE1 3.42Å; K525-E568 IonicContact NZ-OE1 2.71Å; K525-E568 PolarHBondContact NZ-OE1 3.31Å; Y536-E568 PolarHBondContact OH-OE1 3.25Å; Y536-E568 PolarHBondContact OH-OE2 3.32Å; N565-E568 PolarHBondContact O-N 2.62Å; E568-Y572 PolarHBondContact O-N 2.98Å; E568-Y572 VanDerWaalsContact O-N 3.1Å
569	V	94	Very high	91.6	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.006	33%	0.325	C	S	.	.	H	α-helix	trans	-71.6	-39.7	178.6	173.1	0	0	0	0	111	Y536 I538 V553 F561 N565 Y572 L573	Y536-V569 HydrophobicContact CD2-CG2 3.67Å; Y536-V569 HydrophobicContact CE1-CG2 4.39Å; Y536-V569 HydrophobicContact CE2-CG2 3.53Å; Y536-V569 HydrophobicContact CG-CG2 4.21Å; I538-V569 HydrophobicContact CD1-CG1 3.83Å; I538-V569 HydrophobicContact CD1-CG2 4.29Å; V553-V569 HydrophobicContact CG1-CG1 4.1Å; V553-V569 HydrophobicContact CG2-CG1 4.17Å; F561-V569 HydrophobicContact CE2-CB 4.31Å; F561-V569 HydrophobicContact CE2-CG2 3.82Å; F561-V569 HydrophobicContact CZ-CB 3.95Å; F561-V569 HydrophobicContact CZ-CG1 3.98Å; F561-V569 HydrophobicContact CZ-CG2 3.99Å; N565-V569 PolarHBondContact O-N 3.38Å; V569-Y572 PolarHBondContact O-N 3.27Å; V569-L573 HydrophobicContact CG1-CD1 3.96Å; V569-L573 HydrophobicContact CG1-CG 4.21Å; V569-L573 WeakPolarHBondContact O-CG 3.37Å; V569-L573 PolarHBondContact O-N 2.96Å
570	G	91.9	Very high	91.8	Very high	22 Å²	22	71.1 Å²	71.1	23%	0.227	34%	0.339	C	S	.	.	H	α-helix	trans	-60.5	-44.8	175.5	0	0	0	0	0	112.2	I566 E567 L573 K574	I566-G570 WeakPolarHBondContact O-CA 3.47Å; I566-G570 PolarHBondContact O-N 3.4Å; E567-G570 PolarHBondContact O-N 2.91Å; G570-L573 PolarHBondContact O-N 2.98Å; G570-K574 VanDerWaalsContact O-CB 3.25Å; G570-K574 WeakPolarHBondContact O-CB 3.37Å; G570-K574 PolarHBondContact O-N 2.98Å
571	N	94.3	Very high	91.8	Very high	106 Å²	106	74.2 Å²	74.2	57%	0.567	35%	0.347	S	S	*	.	H	α-helix	trans	-63	-42.1	175.3	-72.9	-27.3	0	0	0	111.9	E567 K574 E575	E567-N571 VanDerWaalsContact O-CB 3.32Å; E567-N571 WeakPolarHBondContact O-CB 3.45Å; E567-N571 PolarHBondContact O-N 2.96Å; E567-N571 PolarHBondContact O-ND2 2.75Å; E567-N571 VanDerWaalsContact O-ND2 3.13Å; N571-K574 WeakPolarHBondContact O-CB 3.32Å; N571-K574 PolarHBondContact O-N 3.22Å; N571-E575 PolarHBondContact O-N 2.96Å
572	Y	94.6	Very high	91.5	Very high	22 Å²	22	75 Å²	75	9%	0.086	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-51.6	174.9	169.9	-101.5	0	0	0	112.1	V524 K525 I538 E568 V569 K574 E575 E576	V524-Y572 HydrophobicContact CG2-CE1 4.18Å; V524-Y572 WeakPolarHBondContact CG2-OH 3.27Å; K525-Y572 HydrophobicContact CB-CE1 4.44Å; K525-Y572 HydrophobicContact CD-CD1 4.11Å; K525-Y572 HydrophobicContact CD-CD2 3.72Å; K525-Y572 HydrophobicContact CD-CE2 4.28Å; K525-Y572 HydrophobicContact CD-CG 3.62Å; I538-Y572 HydrophobicContact CD1-CD1 3.42Å; I538-Y572 VanDerWaalsContact CD1-CD1 3.42Å; I538-Y572 HydrophobicContact CD1-CE1 3.65Å; I538-Y572 HydrophobicContact CD1-CG 4.43Å; I538-Y572 HydrophobicContact CG2-CE1 4.21Å; E568-Y572 PolarHBondContact O-N 2.98Å; E568-Y572 VanDerWaalsContact O-N 3.1Å; V569-Y572 PolarHBondContact O-N 3.27Å; Y572-K574 VanDerWaalsContact C-N 3.25Å; Y572-K574 PolarHBondContact O-N 2.95Å; Y572-E575 PolarHBondContact O-N 3.32Å; Y572-E575 VanDerWaalsContact O-N 3.16Å; Y572-E576 HydrophobicContact CD1-CG 4.36Å; Y572-E576 HydrophobicContact CD2-CG 4.2Å; Y572-E576 HydrophobicContact CE1-CG 3.84Å; Y572-E576 HydrophobicContact CE2-CG 3.65Å; Y572-E576 WeakPolarHBondContact CE2-OE1 3.5Å; Y572-E576 VanDerWaalsContact CZ-CG 3.45Å; Y572-E576 WeakPolarHBondContact O-CG 3.46Å; Y572-E576 PolarHBondContact O-N 3.36Å
573	L	91.6	Very high	91	Very high	24 Å²	24	76.1 Å²	76.1	13%	0.126	36%	0.359	C	S	.	.	H	α-helix	trans	-62.9	-35	180	-67.4	176.2	0	0	0	111.8	H551 V553 V569 G570 E576 Y577 L582 M585	H551-L573 HydrophobicContact CB-CD2 4.25Å; V553-L573 HydrophobicContact CG2-CD1 4.17Å; V569-L573 HydrophobicContact CG1-CD1 3.96Å; V569-L573 HydrophobicContact CG1-CG 4.21Å; V569-L573 WeakPolarHBondContact O-CG 3.37Å; V569-L573 PolarHBondContact O-N 2.96Å; G570-L573 PolarHBondContact O-N 2.98Å; L573-E576 PolarHBondContact O-N 2.95Å; L573-Y577 WeakPolarHBondContact O-CB 3.43Å; L573-Y577 PolarHBondContact O-N 2.91Å; L573-L582 HydrophobicContact CB-CD2 3.93Å; L573-L582 HydrophobicContact CD2-CD2 3.86Å; L573-L582 HydrophobicContact CG-CD2 4.45Å; L573-L582 WeakPolarHBondContact O-CD2 3.3Å; L573-M585 HydrophobicContact CD1-SD 4.35Å; L573-M585 HydrophobicContact CD2-SD 4Å
574	K	90.1	Very high	89.5	Confident	76 Å²	76	71 Å²	71	33%	0.33	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-49.4	173	-175.2	178.5	170.6	-177.8	0	111.4	F255 G570 N571 Y572 E576 Y577 E578	F255-K574 HydrophobicContact CE1-CB 4.24Å; F255-K574 HydrophobicContact CE1-CD 4.31Å; F255-K574 HydrophobicContact CZ-CB 3.82Å; F255-K574 HydrophobicContact CZ-CD 4.1Å; F255-K574 HydrophobicContact CZ-CG 3.93Å; G570-K574 VanDerWaalsContact O-CB 3.25Å; G570-K574 WeakPolarHBondContact O-CB 3.37Å; G570-K574 PolarHBondContact O-N 2.98Å; N571-K574 WeakPolarHBondContact O-CB 3.32Å; N571-K574 PolarHBondContact O-N 3.22Å; Y572-K574 VanDerWaalsContact C-N 3.25Å; Y572-K574 PolarHBondContact O-N 2.95Å; K574-E576 PolarHBondContact O-N 3.46Å; K574-Y577 WeakPolarHBondContact O-CB 3.46Å; K574-Y577 PolarHBondContact O-N 2.95Å; K574-E578 WeakPolarHBondContact CE-OE1 3.49Å; K574-E578 WeakPolarHBondContact O-CG 3.31Å; K574-E578 PolarHBondContact O-N 3.42Å
575	E	93.5	Very high	88.1	Confident	105 Å²	105	66.7 Å²	66.7	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-43.2	177.8	-178.1	-178	177	0	0	111.6	N571 Y572 Y577 E578 N579	N571-E575 PolarHBondContact O-N 2.96Å; Y572-E575 PolarHBondContact O-N 3.32Å; Y572-E575 VanDerWaalsContact O-N 3.16Å; E575-Y577 VanDerWaalsContact C-N 3.29Å; E575-Y577 PolarHBondContact O-N 2.94Å; E575-E578 PolarHBondContact O-N 3.41Å; E575-N579 WeakPolarHBondContact CG-ND2 3.42Å; E575-N579 WeakPolarHBondContact O-CB 3.17Å; E575-N579 VanDerWaalsContact O-CG 3.29Å; E575-N579 PolarHBondContact O-N 3.03Å; E575-N579 PolarHBondContact O-ND2 3.37Å
576	E	92.2	Very high	86.3	Confident	7 Å²	7	67 Å²	67	3%	0.033	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-37.4	175.9	-68.1	-58.8	142.4	0	0	112.2	Q411 Y572 L573 K574 N580 R581 L582	Q411-E576 PolarHBondContact OE1-OE2 3.44Å; Y572-E576 HydrophobicContact CD1-CG 4.36Å; Y572-E576 HydrophobicContact CD2-CG 4.2Å; Y572-E576 HydrophobicContact CE1-CG 3.84Å; Y572-E576 HydrophobicContact CE2-CG 3.65Å; Y572-E576 WeakPolarHBondContact CE2-OE1 3.5Å; Y572-E576 VanDerWaalsContact CZ-CG 3.45Å; Y572-E576 WeakPolarHBondContact O-CG 3.46Å; Y572-E576 PolarHBondContact O-N 3.36Å; L573-E576 PolarHBondContact O-N 2.95Å; K574-E576 PolarHBondContact O-N 3.46Å; E576-N580 PolarHBondContact O-N 3.35Å; E576-R581 VanDerWaalsContact CD-NH2 3.33Å; E576-R581 CarbonylContact O-C 3.55Å; E576-R581 WeakPolarHBondContact O-CA 3.45Å; E576-R581 PolarHBondContact O-N 2.98Å; E576-R581 IonicContact OE1-CZ 3.74Å; E576-R581 IonicContact OE1-NE 3.99Å; E576-R581 IonicContact OE1-NH2 3.41Å; E576-R581 PolarHBondContact OE1-NH2 3.45Å; E576-R581 WeakPolarHBondContact OE2-CB 3.41Å; E576-R581 IonicContact OE2-CZ 3.69Å; E576-R581 IonicContact OE2-NE 3.16Å; E576-R581 PolarHBondContact OE2-NE 3.48Å; E576-R581 IonicContact OE2-NH2 2.86Å; E576-R581 PolarHBondContact OE2-NH2 2.99Å; E576-L582 HydrophobicContact CB-CB 3.71Å; E576-L582 PolarHBondContact O-N 3.36Å
577	Y	88	Confident	84.5	Confident	117 Å²	117	64.9 Å²	64.9	46%	0.459	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-48	175.4	179.1	-103.5	0	0	0	112	L573 K574 E575 N579 N580 I584	L573-Y577 WeakPolarHBondContact O-CB 3.43Å; L573-Y577 PolarHBondContact O-N 2.91Å; K574-Y577 WeakPolarHBondContact O-CB 3.46Å; K574-Y577 PolarHBondContact O-N 2.95Å; E575-Y577 VanDerWaalsContact C-N 3.29Å; E575-Y577 PolarHBondContact O-N 2.94Å; Y577-N579 PolarHBondContact O-N 3.38Å; Y577-N580 PolarHBondContact O-N 3.46Å; Y577-I584 HydrophobicContact CD2-CG1 4.32Å; Y577-I584 HydrophobicContact CE2-CD1 4.16Å; Y577-I584 HydrophobicContact CE2-CG1 3.65Å
578	E	90.8	Very high	82.7	Confident	118 Å²	118	59 Å²	59	55%	0.551	29%	0.294	S	S	*	.	H	α-helix	trans	-60	-32.3	177.7	-73.1	174.1	175.9	0	0	111.9	K574 E575 N580	K574-E578 WeakPolarHBondContact CE-OE1 3.49Å; K574-E578 WeakPolarHBondContact O-CG 3.31Å; K574-E578 PolarHBondContact O-N 3.42Å; E575-E578 PolarHBondContact O-N 3.41Å; E578-N580 VanDerWaalsContact C-N 3.28Å; E578-N580 PolarHBondContact O-N 3.42Å
579	N	91.7	Very high	80.2	Confident	80 Å²	80	61 Å²	61	43%	0.428	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	5.4	175.4	-70.4	-45.1	0	0	0	114.4	E575 Y577 R581	E575-N579 WeakPolarHBondContact CG-ND2 3.42Å; E575-N579 WeakPolarHBondContact O-CB 3.17Å; E575-N579 VanDerWaalsContact O-CG 3.29Å; E575-N579 PolarHBondContact O-N 3.03Å; E575-N579 PolarHBondContact O-ND2 3.37Å; Y577-N579 PolarHBondContact O-N 3.38Å; N579-R581 HydrophobicContact CB-CG 4.1Å; N579-R581 PolarHBondContact O-N 3.25Å
580	N	87.4	Confident	78.2	Confident	128 Å²	128	65.9 Å²	65.9	68%	0.684	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	26.8	-173.6	-61.4	-65.7	0	0	0	114	E576 Y577 E578	E576-N580 PolarHBondContact O-N 3.35Å; Y577-N580 PolarHBondContact O-N 3.46Å; E578-N580 VanDerWaalsContact C-N 3.28Å; E578-N580 PolarHBondContact O-N 3.42Å
581	R	88.1	Confident	76	Confident	88 Å²	88	65.8 Å²	65.8	33%	0.332	32%	0.321	S	S	.	.			trans	-99.7	-11.1	177.5	-65.1	-164.8	-55.7	-139.9	-0.3	112.8	R549 E576 N579	R549-R581 WeakPolarHBondContact CA-O 3.35Å; R549-R581 WeakPolarHBondContact CG-O 3.31Å; E576-R581 VanDerWaalsContact CD-NH2 3.33Å; E576-R581 CarbonylContact O-C 3.55Å; E576-R581 WeakPolarHBondContact O-CA 3.45Å; E576-R581 PolarHBondContact O-N 2.98Å; E576-R581 IonicContact OE1-CZ 3.74Å; E576-R581 IonicContact OE1-NE 3.99Å; E576-R581 IonicContact OE1-NH2 3.41Å; E576-R581 PolarHBondContact OE1-NH2 3.45Å; E576-R581 WeakPolarHBondContact OE2-CB 3.41Å; E576-R581 IonicContact OE2-CZ 3.69Å; E576-R581 IonicContact OE2-NE 3.16Å; E576-R581 PolarHBondContact OE2-NE 3.48Å; E576-R581 IonicContact OE2-NH2 2.86Å; E576-R581 PolarHBondContact OE2-NH2 2.99Å; N579-R581 HydrophobicContact CB-CG 4.1Å; N579-R581 PolarHBondContact O-N 3.25Å
582	L	85.7	Confident	73.8	Confident	17 Å²	17	65.3 Å²	65.3	9%	0.089	32%	0.316	C	S	.	.	S	Bend	trans	-115.7	132.7	173.7	175.5	63.9	0	0	0	111.5	H551 L573 E576 M585	H551-L582 HydrophobicContact CB-CD1 3.74Å; H551-L582 WeakPolarHBondContact CD2-CD1 3.34Å; L573-L582 HydrophobicContact CB-CD2 3.93Å; L573-L582 HydrophobicContact CD2-CD2 3.86Å; L573-L582 HydrophobicContact CG-CD2 4.45Å; L573-L582 WeakPolarHBondContact O-CD2 3.3Å; E576-L582 HydrophobicContact CB-CB 3.71Å; E576-L582 PolarHBondContact O-N 3.36Å; L582-M585 HydrophobicContact CD1-CG 3.72Å; L582-M585 HydrophobicContact CD1-SD 3.67Å; L582-M585 HydrophobicContact CD2-SD 4.27Å; L582-M585 HydrophobicContact CG-CG 4.43Å
583	L	77.6	Confident	71.4	Confident	67 Å²	67	68.5 Å²	68.5	35%	0.351	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-83.5	140.4	163.8	-74.9	164.2	0	0	0	109.7	N546 R549 M585	N546-L583 HydrophobicContact CB-CD1 3.6Å; N546-L583 WeakPolarHBondContact OD1-CD1 3.41Å; R549-L583 HydrophobicContact CB-CD1 3.9Å; R549-L583 HydrophobicContact CB-CG 3.89Å; R549-L583 PolarHBondContact O-N 3.44Å; L583-M585 WeakPolarHBondContact O-CG 3.35Å; L583-M585 PolarHBondContact O-N 3.36Å
584	I	61.7	Low	69.2	Low	76 Å²	76	67.7 Å²	67.7	39%	0.39	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-51.3	119.1	179.9	-59.2	176.6	0	0	0	109.5	Y251 Y577	Y251-I584 HydrophobicContact CD2-CG2 4.02Å; Y251-I584 HydrophobicContact CE2-CD1 4.16Å; Y251-I584 HydrophobicContact CE2-CG2 3.41Å; Y251-I584 VanDerWaalsContact CE2-CG2 3.41Å; Y577-I584 HydrophobicContact CD2-CG1 4.32Å; Y577-I584 HydrophobicContact CE2-CD1 4.16Å; Y577-I584 HydrophobicContact CE2-CG1 3.65Å
585	M	63.4	Low	67	Low	23 Å²	23	66.7 Å²	66.7	11%	0.113	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-86.7	146.3	-179.8	-55.4	178.6	62.4	0	0	109.6	G429 H551 V553 L573 L582 L583	G429-M585 VanDerWaalsContact CA-CE 3.49Å; G429-M585 VanDerWaalsContact N-CE 3.33Å; H551-M585 HydrophobicContact CB-CE 4.14Å; H551-M585 HydrophobicContact CB-SD 3.77Å; H551-M585 WeakPolarHBondContact O-CE 3.33Å; V553-M585 HydrophobicContact CG2-CE 4.46Å; L573-M585 HydrophobicContact CD1-SD 4.35Å; L573-M585 HydrophobicContact CD2-SD 4Å; L582-M585 HydrophobicContact CD1-CG 3.72Å; L582-M585 HydrophobicContact CD1-SD 3.67Å; L582-M585 HydrophobicContact CD2-SD 4.27Å; L582-M585 HydrophobicContact CG-CG 4.43Å; L583-M585 WeakPolarHBondContact O-CG 3.35Å; L583-M585 PolarHBondContact O-N 3.36Å
586	S	55.1	Low	64.2	Low	23 Å²	23	65.9 Å²	65.9	16%	0.161	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.2	166	-61.6	0	0	0	0	108.1
587	A	54.2	Low	62.8	Low	21 Å²	21	68.9 Å²	68.9	17%	0.174	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.5	163	0	0	0	0	0	108.6	V252 Y428 E589	V252-A587 HydrophobicContact CB-CB 3.87Å; V252-A587 HydrophobicContact CG1-CB 3.99Å; V252-A587 HydrophobicContact CG2-CB 4.26Å; Y428-A587 HydrophobicContact CD1-CB 4.05Å; Y428-A587 HydrophobicContact CE1-CB 3.98Å; A587-E589 PolarHBondContact O-N 3.41Å
588	L	55.4	Low	61.5	Low	34 Å²	34	66.3 Å²	66.3	18%	0.178	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-64.5	132.3	162.1	-67.1	170.8	0	0	0	106.5	Q426 L434 Y438 H590 P591	Q426-L588 VanDerWaalsContact O-CD1 3.3Å; Q426-L588 WeakPolarHBondContact O-CD1 3.2Å; L434-L588 HydrophobicContact CD1-CD2 3.95Å; L434-L588 HydrophobicContact CD2-CD2 4.39Å; Y438-L588 HydrophobicContact CE2-CD2 4.33Å; L588-H590 PolarHBondContact O-N 3.4Å; L588-P591 WeakPolarHBondContact O-CD 3.44Å
589	E	43.4	Very low	59.9	Low	126 Å²	126	63.4 Å²	63.4	59%	0.589	33%	0.328	S	S	*	.	S	Bend	trans	-59.2	-24.9	-174.5	-70.9	177.9	173	0	0	112.1	A587	A587-E589 PolarHBondContact O-N 3.41Å
590	H	50.7	Low	58	Low	103 Å²	103	62.5 Å²	62.5	48%	0.477	32%	0.322	S	S	.	.			trans	-147.8	71.8	-177	-53.3	92.3	0	0	0	112.1	L588 M592 Q593	L588-H590 PolarHBondContact O-N 3.4Å; H590-M592 PolarHBondContact O-N 3Å; H590-M592 VanDerWaalsContact O-N 3.15Å; H590-Q593 HydrophobicContact CB-CB 4.23Å; H590-Q593 HydrophobicContact CB-CG 3.69Å; H590-Q593 WeakPolarHBondContact O-CB 3.4Å; H590-Q593 PolarHBondContact O-N 3.17Å
591	P	47.2	Very low	56.2	Low	21 Å²	21	58.4 Å²	58.4	14%	0.136	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-62.2	-26	-179.7	27.9	-34.1	0	0	0	112	I427 L588 Q593 C594	I427-P591 HydrophobicContact CG2-CB 4.47Å; L588-P591 WeakPolarHBondContact O-CD 3.44Å; P591-Q593 PolarHBondContact O-N 3.5Å; P591-C594 WeakPolarHBondContact O-CB 3.48Å; P591-C594 PolarHBondContact O-N 2.99Å
592	M	46.5	Very low	54.1	Low	95 Å²	95	56.4 Å²	56.4	47%	0.468	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-62.6	-19.3	172.8	-62	-67.9	-68.5	0	0	113.6	D559 H590 L595	D559-M592 WeakPolarHBondContact OD1-CE 3.48Å; D559-M592 VanDerWaalsContact OD1-SD 3.35Å; H590-M592 PolarHBondContact O-N 3Å; H590-M592 VanDerWaalsContact O-N 3.15Å; M592-L595 HydrophobicContact CE-CD1 4.25Å; M592-L595 WeakPolarHBondContact O-CD1 3.37Å; M592-L595 WeakPolarHBondContact O-CG 3.3Å
593	Q	45.6	Very low	51.8	Low	89 Å²	89	59.2 Å²	59.2	42%	0.416	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-75.2	-19	173.8	-69.6	173.7	7	0	0	111.2	H481 H590 P591 L595	H481-Q593 HydrophobicContact CB-CB 4.02Å; H481-Q593 VanDerWaalsContact CB-O 3.26Å; H481-Q593 WeakPolarHBondContact CB-O 3.31Å; H481-Q593 PolarHBondContact CD2-O 3.09Å; H590-Q593 HydrophobicContact CB-CB 4.23Å; H590-Q593 HydrophobicContact CB-CG 3.69Å; H590-Q593 WeakPolarHBondContact O-CB 3.4Å; H590-Q593 PolarHBondContact O-N 3.17Å; P591-Q593 PolarHBondContact O-N 3.5Å; Q593-L595 PolarHBondContact O-N 3.44Å
594	C	45.8	Very low	49.8	Very low	7 Å²	7	58.6 Å²	58.6	5%	0.047	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-87.4	29.3	176.4	-56.5	0	0	0	0	113.4	T425 P591	T425-C594 HydrophobicContact CG2-CB 3.45Å; T425-C594 VanDerWaalsContact CG2-CB 3.45Å; T425-C594 PolarHBondContact OG1-O 3.47Å; P591-C594 WeakPolarHBondContact O-CB 3.48Å; P591-C594 PolarHBondContact O-N 2.99Å
595	L	42.8	Very low	48.8	Very low	55 Å²	55	57.2 Å²	57.2	29%	0.288	30%	0.302	S	S	.	.			trans	-80.9	130.9	175.4	-75.1	170.7	0	0	0	110.9	L490 A558 M592 Q593	L490-L595 WeakPolarHBondContact CD1-O 3.44Å; L490-L595 VanDerWaalsContact CD2-C 3.42Å; L490-L595 WeakPolarHBondContact CD2-O 3.44Å; L490-L595 VanDerWaalsContact CG-O 3.27Å; L490-L595 WeakPolarHBondContact CG-O 3.48Å; A558-L595 HydrophobicContact CB-CD2 4.36Å; M592-L595 HydrophobicContact CE-CD1 4.25Å; M592-L595 WeakPolarHBondContact O-CD1 3.37Å; M592-L595 WeakPolarHBondContact O-CG 3.3Å; Q593-L595 PolarHBondContact O-N 3.44Å
596	P	35.6	Very low	47.5	Very low	89 Å²	89	60.3 Å²	60.3	58%	0.578	32%	0.319	S	S	*	.			trans	-57.8	0	179.4	23	-33.2	0	0	0	116.1	F459 M479 L490	F459-P596 HydrophobicContact CE1-CB 4.37Å; M479-P596 HydrophobicContact CE-CB 4.15Å; M479-P596 HydrophobicContact SD-CB 3.74Å; L490-P596 WeakPolarHBondContact CD1-OXT 3.39Å

Retrieved 596 of 596 residues in 856.2 ms (Link to these results)

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