A0A087XQM7_POEFO Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A087XQM7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 744 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	35.3	Very low	43.5	Very low	229 Å²	229	122.6 Å²	122.6	100%	1.128	75%	0.752	S	S	*	*				0	93.7	0	-70.3	160.6	176.6	0	0	106.7
2	T	37.1	Very low	43.9	Very low	124 Å²	124	124.8 Å²	124.8	76%	0.761	74%	0.743	S	S	*	*				61.8	88.3	92.3	57.3	0	0	0	0	110.1
3	V	43.1	Very low	44.2	Very low	150 Å²	150	122.6 Å²	122.6	91%	0.909	72%	0.724	S	S	*	*				53.7	113.6	56.7	-170	0	0	0	0	111.4
4	G	38	Very low	44.4	Very low	75 Å²	75	121.9 Å²	121.9	77%	0.773	72%	0.715	S	S	*	*			trans	177.6	82.6	176.8	0	0	0	0	0	114.2
5	A	48.9	Very low	44.6	Very low	94 Å²	94	122.8 Å²	122.8	78%	0.777	71%	0.706	S	S	*	*			trans	-174.4	96.6	156.4	0	0	0	0	0	112.1
6	P	47.1	Very low	44.6	Very low	112 Å²	112	122.1 Å²	122.1	73%	0.727	70%	0.695	S	S	*	*			trans	-137.2	0.5	153.3	38	-25.4	0	0	0	115
7	S	47.1	Very low	44.7	Very low	82 Å²	82	119.1 Å²	119.1	57%	0.573	68%	0.679	S	S	*	*	H	α-helix	trans	-70	-40.3	-168.1	50.9	0	0	0	0	115.3	F9 S11	S7-F9 PolarHBondContact O-N 3.47Å; S7-S11 PolarHBondContact O-N 3.47Å
8	H	46.7	Very low	44.7	Very low	163 Å²	163	118.2 Å²	118.2	76%	0.755	67%	0.671	S	S	*	*	H	α-helix	trans	-70	-34	-170.6	-79.3	-94.8	0	0	0	114	F12	H8-F12 PolarHBondContact O-N 3.07Å
9	F	47.9	Very low	44.7	Very low	173 Å²	173	116.5 Å²	116.5	76%	0.759	66%	0.661	S	S	*	*	H	α-helix	trans	-69.6	-40.6	-177.9	-128.8	-89.2	0	0	0	111.9	S7 S11 F12 I13	S7-F9 PolarHBondContact O-N 3.47Å; F9-S11 PolarHBondContact O-N 3.36Å; F9-F12 PolarHBondContact O-N 3.49Å; F9-I13 WeakPolarHBondContact O-CG1 3.4Å; F9-I13 PolarHBondContact O-N 2.95Å
10	A	44.3	Very low	44.7	Very low	64 Å²	64	114.3 Å²	114.3	53%	0.529	65%	0.652	S	S	.	*	H	α-helix	trans	-62.9	-41.8	177.2	0	0	0	0	0	112.3	F12 I13 L14	A10-F12 VanDerWaalsContact C-N 3.35Å; A10-F12 PolarHBondContact O-N 3.46Å; A10-I13 PolarHBondContact O-N 3.44Å; A10-L14 WeakPolarHBondContact O-CB 3.46Å; A10-L14 PolarHBondContact O-N 3.19Å
11	S	43.6	Very low	44.4	Very low	83 Å²	83	113.8 Å²	113.8	58%	0.58	65%	0.647	S	S	*	*	H	α-helix	trans	-63.1	-39.1	178.1	-171.7	0	0	0	0	112.5	S7 F9 L14 K15	S7-S11 PolarHBondContact O-N 3.47Å; F9-S11 PolarHBondContact O-N 3.36Å; S11-L14 PolarHBondContact O-N 3.31Å; S11-K15 PolarHBondContact O-N 3.28Å
12	F	47.3	Very low	44.7	Very low	148 Å²	148	106.1 Å²	106.1	65%	0.649	62%	0.616	S	S	*	*	H	α-helix	trans	-66.5	-46.3	178	-156.3	-82.2	0	0	0	111.9	H8 F9 A10 K15 Q16	H8-F12 PolarHBondContact O-N 3.07Å; F9-F12 PolarHBondContact O-N 3.49Å; A10-F12 VanDerWaalsContact C-N 3.35Å; A10-F12 PolarHBondContact O-N 3.46Å; F12-K15 PolarHBondContact O-N 3.49Å; F12-Q16 PolarHBondContact O-N 2.96Å
13	I	48.4	Very low	44.7	Very low	97 Å²	97	108.1 Å²	108.1	50%	0.497	62%	0.615	S	S	.	*	H	α-helix	trans	-61.9	-44.4	175.9	-63.6	-64.4	0	0	0	111.2	F9 A10 K15 Q16 V17	F9-I13 WeakPolarHBondContact O-CG1 3.4Å; F9-I13 PolarHBondContact O-N 2.95Å; A10-I13 PolarHBondContact O-N 3.44Å; I13-K15 VanDerWaalsContact C-N 3.31Å; I13-K15 PolarHBondContact O-N 2.72Å; I13-Q16 PolarHBondContact O-N 2.87Å; I13-V17 HydrophobicContact CG2-CG2 4.43Å; I13-V17 WeakPolarHBondContact O-CG2 3.36Å; I13-V17 PolarHBondContact O-N 2.71Å
14	L	46.4	Very low	44.5	Very low	113 Å²	113	103.8 Å²	103.8	59%	0.592	60%	0.595	S	S	*	*	H	α-helix	trans	-63.3	-38.5	-179.2	-162.9	73	0	0	0	111.7	A10 S11 V17 L18	A10-L14 WeakPolarHBondContact O-CB 3.46Å; A10-L14 PolarHBondContact O-N 3.19Å; S11-L14 PolarHBondContact O-N 3.31Å; L14-V17 PolarHBondContact O-N 2.97Å; L14-L18 HydrophobicContact CG-CD1 4.35Å; L14-L18 WeakPolarHBondContact O-CB 3.48Å; L14-L18 WeakPolarHBondContact O-CG 3.37Å; L14-L18 PolarHBondContact O-N 3.46Å
15	K	47.8	Very low	44.4	Very low	135 Å²	135	103.4 Å²	103.4	59%	0.587	58%	0.584	S	S	*	*	H	α-helix	trans	-66.8	-44.7	173.9	-171.1	172.2	-179.1	179.9	0	112.2	S11 F12 I13 V17 L18 D19	S11-K15 PolarHBondContact O-N 3.28Å; F12-K15 PolarHBondContact O-N 3.49Å; I13-K15 VanDerWaalsContact C-N 3.31Å; I13-K15 PolarHBondContact O-N 2.72Å; K15-V17 PolarHBondContact O-N 3.39Å; K15-L18 PolarHBondContact O-N 3.25Å; K15-L18 VanDerWaalsContact O-N 3.16Å; K15-D19 PolarHBondContact O-N 3.31Å
16	Q	44.9	Very low	43.8	Very low	111 Å²	111	107.5 Å²	107.5	52%	0.519	59%	0.585	S	S	.	*	H	α-helix	trans	-57.6	-38.7	176.2	-159.5	79.7	41.1	0	0	111.9	F12 I13 S20	F12-Q16 PolarHBondContact O-N 2.96Å; I13-Q16 PolarHBondContact O-N 2.87Å; Q16-S20 WeakPolarHBondContact O-CB 3.37Å; Q16-S20 PolarHBondContact O-N 3.29Å; Q16-S20 VanDerWaalsContact O-N 3.11Å; Q16-S20 PolarHBondContact O-OG 3.23Å
17	V	46.4	Very low	43.3	Very low	71 Å²	71	109.4 Å²	109.4	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-70.5	-42.6	175.9	170.5	0	0	0	0	111.8	I13 L14 K15 S20 L21	I13-V17 HydrophobicContact CG2-CG2 4.43Å; I13-V17 WeakPolarHBondContact O-CG2 3.36Å; I13-V17 PolarHBondContact O-N 2.71Å; L14-V17 PolarHBondContact O-N 2.97Å; K15-V17 PolarHBondContact O-N 3.39Å; V17-S20 PolarHBondContact O-N 3Å; V17-L21 HydrophobicContact CG1-CD1 3.88Å; V17-L21 HydrophobicContact CG1-CG 4.43Å; V17-L21 WeakPolarHBondContact O-CB 3.31Å; V17-L21 VanDerWaalsContact O-CG 3.31Å; V17-L21 WeakPolarHBondContact O-CG 3.47Å; V17-L21 PolarHBondContact O-N 3.39Å
18	L	45.2	Very low	43.3	Very low	103 Å²	103	110.6 Å²	110.6	54%	0.539	59%	0.591	S	S	.	*	H	α-helix	trans	-66.2	-41.1	177.1	-76.3	166.4	0	0	0	112.8	L14 K15 S20 L21 S22	L14-L18 HydrophobicContact CG-CD1 4.35Å; L14-L18 WeakPolarHBondContact O-CB 3.48Å; L14-L18 WeakPolarHBondContact O-CG 3.37Å; L14-L18 PolarHBondContact O-N 3.46Å; K15-L18 PolarHBondContact O-N 3.25Å; K15-L18 VanDerWaalsContact O-N 3.16Å; L18-S20 VanDerWaalsContact C-N 3.3Å; L18-S20 PolarHBondContact O-N 3.16Å; L18-L21 PolarHBondContact O-N 3.47Å; L18-S22 WeakPolarHBondContact O-CB 3.43Å; L18-S22 PolarHBondContact O-N 2.87Å
19	D	43.7	Very low	43.2	Very low	87 Å²	87	108.5 Å²	108.5	47%	0.465	59%	0.59	S	S	.	*	H	α-helix	trans	-65.3	-36	174.5	-70.2	-26.6	0	0	0	110.9	K15 S22 F23	K15-D19 PolarHBondContact O-N 3.31Å; D19-S22 PolarHBondContact O-N 2.7Å; D19-F23 PolarHBondContact O-N 3.16Å
20	S	44.2	Very low	42.8	Very low	71 Å²	71	108.8 Å²	108.8	50%	0.497	60%	0.596	S	S	.	*	H	α-helix	trans	-67.9	-39.1	173.8	-58.2	0	0	0	0	112.9	Q16 V17 L18 F23 A24	Q16-S20 WeakPolarHBondContact O-CB 3.37Å; Q16-S20 PolarHBondContact O-N 3.29Å; Q16-S20 VanDerWaalsContact O-N 3.11Å; Q16-S20 PolarHBondContact O-OG 3.23Å; V17-S20 PolarHBondContact O-N 3Å; L18-S20 VanDerWaalsContact C-N 3.3Å; L18-S20 PolarHBondContact O-N 3.16Å; S20-F23 PolarHBondContact O-N 3.08Å; S20-A24 PolarHBondContact O-N 2.89Å
21	L	40.1	Very low	42.7	Very low	104 Å²	104	110.6 Å²	110.6	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-69.3	-34.5	174.9	-74	167.4	0	0	0	111.9	V17 L18 A24 A25	V17-L21 HydrophobicContact CG1-CD1 3.88Å; V17-L21 HydrophobicContact CG1-CG 4.43Å; V17-L21 WeakPolarHBondContact O-CB 3.31Å; V17-L21 VanDerWaalsContact O-CG 3.31Å; V17-L21 WeakPolarHBondContact O-CG 3.47Å; V17-L21 PolarHBondContact O-N 3.39Å; L18-L21 PolarHBondContact O-N 3.47Å; L21-A24 PolarHBondContact O-N 3.11Å; L21-A25 WeakPolarHBondContact O-CB 3.46Å; L21-A25 PolarHBondContact O-N 2.88Å
22	S	39.8	Very low	42.8	Very low	69 Å²	69	110.8 Å²	110.8	48%	0.483	60%	0.596	S	S	.	*	H	α-helix	trans	-63.8	-42.5	172.2	-167.7	0	0	0	0	111.5	L18 D19 A25 F26	L18-S22 WeakPolarHBondContact O-CB 3.43Å; L18-S22 PolarHBondContact O-N 2.87Å; D19-S22 PolarHBondContact O-N 2.7Å; S22-A25 PolarHBondContact O-N 3.41Å; S22-F26 PolarHBondContact O-N 3.2Å; S22-F26 VanDerWaalsContact O-N 3.16Å
23	F	38.9	Very low	43	Very low	166 Å²	166	110.5 Å²	110.5	73%	0.728	61%	0.609	S	S	*	*	H	α-helix	trans	-63.8	-39.1	172.2	-111.5	-90.8	0	0	0	113	D19 S20 F26	D19-F23 PolarHBondContact O-N 3.16Å; S20-F23 PolarHBondContact O-N 3.08Å; F23-F26 PolarHBondContact O-N 2.91Å
24	A	37.1	Very low	43.3	Very low	59 Å²	59	108.9 Å²	108.9	49%	0.488	62%	0.616	S	S	.	*	H	α-helix	trans	-66.4	-36.4	175.3	0	0	0	0	0	112.5	S20 L21 F26 L27	S20-A24 PolarHBondContact O-N 2.89Å; L21-A24 PolarHBondContact O-N 3.11Å; A24-F26 VanDerWaalsContact C-N 3.33Å; A24-F26 PolarHBondContact O-N 2.67Å; A24-L27 PolarHBondContact O-N 3.47Å
25	A	36.5	Very low	43.5	Very low	66 Å²	66	105.2 Å²	105.2	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-67.4	-31.1	175.8	0	0	0	0	0	112.9	L21 S22 L27	L21-A25 WeakPolarHBondContact O-CB 3.46Å; L21-A25 PolarHBondContact O-N 2.88Å; S22-A25 PolarHBondContact O-N 3.41Å; A25-L27 VanDerWaalsContact C-N 3.26Å; A25-L27 PolarHBondContact O-N 2.73Å
26	F	36.2	Very low	44	Very low	181 Å²	181	100.6 Å²	100.6	79%	0.794	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-4.6	178	-113.5	-83.4	0	0	0	115	S22 F23 A24	S22-F26 PolarHBondContact O-N 3.2Å; S22-F26 VanDerWaalsContact O-N 3.16Å; F23-F26 PolarHBondContact O-N 2.91Å; A24-F26 VanDerWaalsContact C-N 3.33Å; A24-F26 PolarHBondContact O-N 2.67Å
27	L	36.7	Very low	44.8	Very low	151 Å²	151	99 Å²	99	79%	0.791	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	11.7	175.4	-72.2	171	0	0	0	113.4	A24 A25	A24-L27 PolarHBondContact O-N 3.47Å; A25-L27 VanDerWaalsContact C-N 3.26Å; A25-L27 PolarHBondContact O-N 2.73Å
28	V	46.3	Very low	45.7	Very low	107 Å²	107	100.4 Å²	100.4	65%	0.648	60%	0.599	S	S	*	*	S	Bend	trans	-98.6	132.2	172.8	-165.8	0	0	0	0	109.4
29	V	46.5	Very low	47.1	Very low	120 Å²	120	103.7 Å²	103.7	73%	0.727	60%	0.604	S	S	*	*			trans	69.9	63.3	-178.2	-155.4	0	0	0	0	115.9
30	M	39.2	Very low	48.6	Very low	178 Å²	178	109.2 Å²	109.2	88%	0.877	62%	0.619	S	S	*	*			trans	-120.5	84	143.7	-78.5	-90	77.2	0	0	108.6
31	D	41.6	Very low	50.1	Low	102 Å²	102	113.8 Å²	113.8	55%	0.545	63%	0.625	S	S	.	*			trans	-68.8	129.3	174	-113.5	-44.3	0	0	0	109.8
32	P	44.6	Very low	51.9	Low	87 Å²	87	114.9 Å²	114.9	57%	0.565	63%	0.627	S	S	*	*			trans	-68	129.7	175.9	27.2	-32.9	0	0	0	110.1	G34 G35	P32-G34 PolarHBondContact O-N 3.31Å; P32-G35 PolarHBondContact O-N 3.31Å
33	P	52.3	Low	53.8	Low	143 Å²	143	114.2 Å²	114.2	93%	0.929	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	92.1	-173.7	27.7	-34.9	0	0	0	111.4
34	G	55.4	Low	55.8	Low	63 Å²	63	109.3 Å²	109.3	65%	0.649	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.6	-30.5	177.4	0	0	0	0	0	114.3	P32	P32-G34 PolarHBondContact O-N 3.31Å
35	G	50.3	Low	57.9	Low	36 Å²	36	112.9 Å²	112.9	37%	0.371	61%	0.606	S	S	.	*	S	Bend	trans	-87	-16.4	-172.8	0	0	0	0	0	116.5	P32 S37 E38 R39	P32-G35 PolarHBondContact O-N 3.31Å; G35-S37 PolarHBondContact O-N 3.04Å; G35-E38 PolarHBondContact O-N 3.4Å; G35-R39 WeakPolarHBondContact O-CB 3.42Å; G35-R39 PolarHBondContact O-N 3.43Å; G35-R39 VanDerWaalsContact O-N 3.09Å
36	G	57.2	Low	60.1	Low	37 Å²	37	113.9 Å²	113.9	38%	0.381	60%	0.602	S	S	.	*	H	α-helix	trans	-67.9	-30.4	-169.6	0	0	0	0	0	115.1	R40	G36-R40 WeakPolarHBondContact O-CB 3.48Å; G36-R40 PolarHBondContact O-N 2.96Å; G36-R40 VanDerWaalsContact O-N 3.08Å
37	S	61.8	Low	62.2	Low	77 Å²	77	112.9 Å²	112.9	54%	0.538	59%	0.593	S	S	.	*	H	α-helix	trans	-66.5	-47.6	177.2	46.2	0	0	0	0	111.9	G35 R40 R41	G35-S37 PolarHBondContact O-N 3.04Å; S37-R40 PolarHBondContact O-N 3.41Å; S37-R41 WeakPolarHBondContact O-CG 3.03Å; S37-R41 PolarHBondContact O-N 3.32Å
38	E	66.9	Low	64.4	Low	102 Å²	102	110.1 Å²	110.1	48%	0.477	57%	0.572	S	S	.	*	H	α-helix	trans	-75.6	-38.9	-177.3	-158.2	52	-130.1	0	0	111.6	G35 R40 R41 Q42	G35-E38 PolarHBondContact O-N 3.4Å; E38-R40 PolarHBondContact O-N 2.73Å; E38-R41 PolarHBondContact O-N 2.87Å; E38-R41 VanDerWaalsContact O-N 3.15Å; E38-R41 WeakPolarHBondContact OE2-CD 3.42Å; E38-R41 IonicContact OE2-CZ 3.64Å; E38-R41 IonicContact OE2-NE 3.9Å; E38-R41 IonicContact OE2-NH1 2.7Å; E38-R41 PolarHBondContact OE2-NH1 3.16Å; E38-Q42 WeakPolarHBondContact O-CB 3.42Å; E38-Q42 PolarHBondContact O-N 3.46Å
39	R	74.2	Confident	66.1	Low	172 Å²	172	107 Å²	107	65%	0.649	55%	0.55	S	S	*	*	H	α-helix	trans	-56.6	-39.1	169.4	-173.2	-179.3	-64.7	-127.3	0.3	112	G35 A43	G35-R39 WeakPolarHBondContact O-CB 3.42Å; G35-R39 PolarHBondContact O-N 3.43Å; G35-R39 VanDerWaalsContact O-N 3.09Å; R39-A43 VanDerWaalsContact O-CB 3.32Å; R39-A43 WeakPolarHBondContact O-CB 3.38Å; R39-A43 PolarHBondContact O-N 2.85Å
40	R	74.7	Confident	67.9	Low	202 Å²	202	107.8 Å²	107.8	76%	0.762	55%	0.546	S	S	*	.	H	α-helix	trans	-71.2	-37.6	176.9	-174.1	176.1	-179.8	-174.3	0	112.6	G36 S37 E38 E44	G36-R40 WeakPolarHBondContact O-CB 3.48Å; G36-R40 PolarHBondContact O-N 2.96Å; G36-R40 VanDerWaalsContact O-N 3.08Å; S37-R40 PolarHBondContact O-N 3.41Å; E38-R40 PolarHBondContact O-N 2.73Å; R40-E44 WeakPolarHBondContact O-CB 3.49Å; R40-E44 PolarHBondContact O-N 3.01Å
41	R	75.6	Confident	70	Confident	168 Å²	168	101.1 Å²	101.1	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-63.6	-46.4	172.4	-76.9	166.7	165.2	-174.9	-6.4	111.7	S37 E38 E44 R45	S37-R41 WeakPolarHBondContact O-CG 3.03Å; S37-R41 PolarHBondContact O-N 3.32Å; E38-R41 PolarHBondContact O-N 2.87Å; E38-R41 VanDerWaalsContact O-N 3.15Å; E38-R41 WeakPolarHBondContact OE2-CD 3.42Å; E38-R41 IonicContact OE2-CZ 3.64Å; E38-R41 IonicContact OE2-NE 3.9Å; E38-R41 IonicContact OE2-NH1 2.7Å; E38-R41 PolarHBondContact OE2-NH1 3.16Å; R41-E44 PolarHBondContact O-N 2.81Å; R41-R45 WeakPolarHBondContact O-CB 3.44Å; R41-R45 PolarHBondContact O-N 2.96Å
42	Q	78.4	Confident	72.1	Confident	126 Å²	126	97.1 Å²	97.1	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-62.4	-44	177.4	-167.9	177.6	24.9	0	0	111.6	E38 R45 L46	E38-Q42 WeakPolarHBondContact O-CB 3.42Å; E38-Q42 PolarHBondContact O-N 3.46Å; Q42-R45 PolarHBondContact O-N 2.88Å; Q42-L46 HydrophobicContact CG-CD1 4.36Å; Q42-L46 WeakPolarHBondContact O-CB 3.2Å; Q42-L46 VanDerWaalsContact O-CG 3.32Å; Q42-L46 WeakPolarHBondContact O-CG 3.31Å; Q42-L46 PolarHBondContact O-N 3.33Å
43	A	78.9	Confident	74	Confident	55 Å²	55	99.1 Å²	99.1	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-42	175.5	0	0	0	0	0	113	R39 L46 R47	R39-A43 VanDerWaalsContact O-CB 3.32Å; R39-A43 WeakPolarHBondContact O-CB 3.38Å; R39-A43 PolarHBondContact O-N 2.85Å; A43-L46 PolarHBondContact O-N 3.39Å; A43-R47 VanDerWaalsContact O-CB 3.3Å; A43-R47 WeakPolarHBondContact O-CB 3.35Å; A43-R47 PolarHBondContact O-N 3.49Å
44	E	81.8	Confident	75.6	Confident	63 Å²	63	96.2 Å²	96.2	29%	0.294	47%	0.471	S	S	.	.	H	α-helix	trans	-71.1	-30.2	176.8	174.5	63.6	-174.4	0	0	112.4	R40 R41 R47 R48	R40-E44 WeakPolarHBondContact O-CB 3.49Å; R40-E44 PolarHBondContact O-N 3.01Å; R41-E44 PolarHBondContact O-N 2.81Å; E44-R47 IonicContact OE1-NH1 3.8Å; E44-R47 IonicContact OE2-CZ 3.52Å; E44-R47 IonicContact OE2-NH1 3.23Å; E44-R47 PolarHBondContact OE2-NH1 3.36Å; E44-R48 WeakPolarHBondContact O-CG 3.4Å; E44-R48 PolarHBondContact O-N 3.09Å; E44-R48 IonicContact OE1-CZ 3.67Å; E44-R48 IonicContact OE1-NE 2.69Å; E44-R48 PolarHBondContact OE1-NE 2.84Å; E44-R48 IonicContact OE1-NH2 3.77Å; E44-R48 PolarHBondContact OE1-NH2 2.81Å
45	R	81.1	Confident	77.1	Confident	135 Å²	135	93.9 Å²	93.9	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-66.8	-50.2	169.5	177.1	179.4	166.3	147.9	9.7	111.3	R41 Q42 R47 R48 E49	R41-R45 WeakPolarHBondContact O-CB 3.44Å; R41-R45 PolarHBondContact O-N 2.96Å; Q42-R45 PolarHBondContact O-N 2.88Å; R45-R47 VanDerWaalsContact C-N 3.26Å; R45-R47 PolarHBondContact O-N 3.37Å; R45-R48 WeakPolarHBondContact O-CA 3.2Å; R45-R48 WeakPolarHBondContact O-CB 3.44Å; R45-R48 PolarHBondContact O-N 3.36Å; R45-E49 IonicContact CZ-OE1 2.67Å; R45-E49 IonicContact NE-OE1 3.53Å; R45-E49 PolarHBondContact NE-OE1 3.24Å; R45-E49 IonicContact NH2-OE1 3.33Å; R45-E49 PolarHBondContact NH2-OE1 2.77Å; R45-E49 VanDerWaalsContact NH2-OE1 3.08Å; R45-E49 PolarHBondContact O-N 3.06Å
46	L	81.5	Confident	78.8	Confident	87 Å²	87	93.8 Å²	93.8	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-56.7	-41.8	176.1	-73.7	167.6	0	0	0	111.2	Q42 A43 R48 E49 E50	Q42-L46 HydrophobicContact CG-CD1 4.36Å; Q42-L46 WeakPolarHBondContact O-CB 3.2Å; Q42-L46 VanDerWaalsContact O-CG 3.32Å; Q42-L46 WeakPolarHBondContact O-CG 3.31Å; Q42-L46 PolarHBondContact O-N 3.33Å; A43-L46 PolarHBondContact O-N 3.39Å; L46-R48 VanDerWaalsContact C-N 3.27Å; L46-R48 PolarHBondContact O-N 3Å; L46-E49 CarbonylContact O-C 3.53Å; L46-E49 PolarHBondContact O-N 3.23Å; L46-E49 VanDerWaalsContact O-N 3.09Å; L46-E50 WeakPolarHBondContact O-CG 3.48Å; L46-E50 PolarHBondContact O-N 3.48Å
47	R	80.8	Confident	80.1	Confident	159 Å²	159	98.4 Å²	98.4	60%	0.6	45%	0.449	S	S	*	.	H	α-helix	trans	-61.2	-30.1	174.6	-178	172.9	170.1	-96.9	-11.5	113.7	A43 E44 R45 A51	A43-R47 VanDerWaalsContact O-CB 3.3Å; A43-R47 WeakPolarHBondContact O-CB 3.35Å; A43-R47 PolarHBondContact O-N 3.49Å; E44-R47 IonicContact OE1-NH1 3.8Å; E44-R47 IonicContact OE2-CZ 3.52Å; E44-R47 IonicContact OE2-NH1 3.23Å; E44-R47 PolarHBondContact OE2-NH1 3.36Å; R45-R47 VanDerWaalsContact C-N 3.26Å; R45-R47 PolarHBondContact O-N 3.37Å; R47-A51 WeakPolarHBondContact O-CB 3.43Å; R47-A51 PolarHBondContact O-N 3.42Å; R47-A51 VanDerWaalsContact O-N 3.15Å
48	R	82.7	Confident	81.3	Confident	94 Å²	94	101.1 Å²	101.1	36%	0.355	45%	0.454	S	S	.	.	H	α-helix	trans	-77.8	-37	171.1	-70.1	176.2	-162.8	141.4	7.2	112.4	E44 R45 L46 A51 Y52	E44-R48 WeakPolarHBondContact O-CG 3.4Å; E44-R48 PolarHBondContact O-N 3.09Å; E44-R48 IonicContact OE1-CZ 3.67Å; E44-R48 IonicContact OE1-NE 2.69Å; E44-R48 PolarHBondContact OE1-NE 2.84Å; E44-R48 IonicContact OE1-NH2 3.77Å; E44-R48 PolarHBondContact OE1-NH2 2.81Å; R45-R48 WeakPolarHBondContact O-CA 3.2Å; R45-R48 WeakPolarHBondContact O-CB 3.44Å; R45-R48 PolarHBondContact O-N 3.36Å; L46-R48 VanDerWaalsContact C-N 3.27Å; L46-R48 PolarHBondContact O-N 3Å; R48-A51 PolarHBondContact O-N 3.03Å; R48-Y52 WeakPolarHBondContact O-CB 3.14Å; R48-Y52 PolarHBondContact O-N 2.94Å
49	E	83.1	Confident	82.4	Confident	41 Å²	41	97.3 Å²	97.3	19%	0.192	44%	0.436	C	S	.	.	H	α-helix	trans	-63.5	-42	173.5	-66.7	174.4	-174.4	0	0	110.7	R45 L46 Y52 Y53	R45-E49 IonicContact CZ-OE1 2.67Å; R45-E49 IonicContact NE-OE1 3.53Å; R45-E49 PolarHBondContact NE-OE1 3.24Å; R45-E49 IonicContact NH2-OE1 3.33Å; R45-E49 PolarHBondContact NH2-OE1 2.77Å; R45-E49 VanDerWaalsContact NH2-OE1 3.08Å; R45-E49 PolarHBondContact O-N 3.06Å; L46-E49 CarbonylContact O-C 3.53Å; L46-E49 PolarHBondContact O-N 3.23Å; L46-E49 VanDerWaalsContact O-N 3.09Å; E49-Y52 WeakPolarHBondContact O-CB 3.37Å; E49-Y52 PolarHBondContact O-N 3.05Å; E49-Y53 WeakPolarHBondContact O-CD2 3.48Å; E49-Y53 PolarHBondContact O-N 2.89Å
50	E	84.8	Confident	83.1	Confident	136 Å²	136	91.6 Å²	91.6	64%	0.636	42%	0.422	S	S	*	.	H	α-helix	trans	-60.6	-48.6	171.8	-72.6	173.6	170.5	0	0	112	L46 Y52 Y53 N54	L46-E50 WeakPolarHBondContact O-CG 3.48Å; L46-E50 PolarHBondContact O-N 3.48Å; E50-Y52 VanDerWaalsContact C-N 3.31Å; E50-Y52 PolarHBondContact O-N 3.01Å; E50-Y53 PolarHBondContact O-N 3.39Å; E50-N54 WeakPolarHBondContact O-CB 3.26Å; E50-N54 PolarHBondContact O-N 2.8Å
51	A	82.3	Confident	83.7	Confident	39 Å²	39	87.3 Å²	87.3	32%	0.322	41%	0.411	S	S	.	.	H	α-helix	trans	-64.1	-34.7	177.6	0	0	0	0	0	112.9	R47 R48 F55 A81	R47-A51 WeakPolarHBondContact O-CB 3.43Å; R47-A51 PolarHBondContact O-N 3.42Å; R47-A51 VanDerWaalsContact O-N 3.15Å; R48-A51 PolarHBondContact O-N 3.03Å; A51-F55 VanDerWaalsContact O-CB 3.31Å; A51-F55 WeakPolarHBondContact O-CB 3.27Å; A51-F55 PolarHBondContact O-N 3.22Å; A51-A81 HydrophobicContact CB-CB 4.11Å
52	Y	86.1	Confident	84.2	Confident	17 Å²	17	86.5 Å²	86.5	7%	0.067	41%	0.414	C	S	.	.	H	α-helix	trans	-62.7	-50.6	174.7	174.4	-79.7	0	0	0	111.4	R48 E49 E50 F55 I56 L73 P76 L84	R48-Y52 WeakPolarHBondContact O-CB 3.14Å; R48-Y52 PolarHBondContact O-N 2.94Å; E49-Y52 WeakPolarHBondContact O-CB 3.37Å; E49-Y52 PolarHBondContact O-N 3.05Å; E50-Y52 VanDerWaalsContact C-N 3.31Å; E50-Y52 PolarHBondContact O-N 3.01Å; Y52-F55 PolarHBondContact O-N 2.79Å; Y52-I56 HydrophobicContact CD1-CD1 3.96Å; Y52-I56 HydrophobicContact CE1-CD1 3.34Å; Y52-I56 HydrophobicContact CE2-CD1 4.41Å; Y52-I56 WeakPolarHBondContact O-CG1 3.48Å; Y52-I56 PolarHBondContact O-N 2.98Å; Y52-I56 VanDerWaalsContact O-N 3.09Å; Y52-L73 WeakPolarHBondContact CE2-O 3.33Å; Y52-P76 HydrophobicContact CD1-CB 3.94Å; Y52-P76 HydrophobicContact CD1-CG 4.21Å; Y52-P76 HydrophobicContact CD2-CB 4.41Å; Y52-P76 HydrophobicContact CE1-CB 3.93Å; Y52-P76 HydrophobicContact CE1-CG 3.67Å; Y52-P76 HydrophobicContact CE2-CB 4.39Å; Y52-P76 HydrophobicContact CE2-CG 4.31Å; Y52-P76 HydrophobicContact CG-CB 4.23Å; Y52-L84 HydrophobicContact CD2-CD1 3.62Å; Y52-L84 HydrophobicContact CE2-CD1 4.02Å; Y52-L84 HydrophobicContact CG-CD1 4.42Å
53	Y	83.6	Confident	84.7	Confident	129 Å²	129	82.5 Å²	82.5	51%	0.506	40%	0.396	S	S	.	.	H	α-helix	trans	-69.9	-36.3	178.9	-69.7	-61.9	0	0	0	112.3	E49 E50 I56 N57	E49-Y53 WeakPolarHBondContact O-CD2 3.48Å; E49-Y53 PolarHBondContact O-N 2.89Å; E50-Y53 PolarHBondContact O-N 3.39Å; Y53-I56 PolarHBondContact O-N 3.28Å; Y53-N57 PolarHBondContact O-N 3.3Å; Y53-N57 VanDerWaalsContact O-N 3.08Å; Y53-N57 PolarHBondContact O-ND2 3.05Å
54	N	85.8	Confident	85.1	Confident	83 Å²	83	83.2 Å²	83.2	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-47.1	174	-167.8	81.8	0	0	0	111.2	E50 I56 N57 E58	E50-N54 WeakPolarHBondContact O-CB 3.26Å; E50-N54 PolarHBondContact O-N 2.8Å; N54-I56 PolarHBondContact O-N 3.37Å; N54-N57 PolarHBondContact O-N 3.17Å; N54-N57 VanDerWaalsContact O-N 3.15Å; N54-E58 PolarHBondContact ND2-OE1 2.91Å; N54-E58 PolarHBondContact ND2-OE2 3.28Å; N54-E58 WeakPolarHBondContact O-CG 3.42Å; N54-E58 PolarHBondContact O-N 3.26Å
55	F	86.6	Confident	85.3	Confident	13 Å²	13	86 Å²	86	6%	0.057	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-45.2	176.8	176.2	-111.3	0	0	0	112.4	A51 Y52 N57 E58 L59 M67 A81 L84 R85 L88	A51-F55 VanDerWaalsContact O-CB 3.31Å; A51-F55 WeakPolarHBondContact O-CB 3.27Å; A51-F55 PolarHBondContact O-N 3.22Å; Y52-F55 PolarHBondContact O-N 2.79Å; F55-N57 VanDerWaalsContact C-N 3.28Å; F55-N57 PolarHBondContact O-N 3.36Å; F55-E58 PolarHBondContact O-N 3.33Å; F55-L59 HydrophobicContact CE1-CD1 4.27Å; F55-L59 HydrophobicContact CE1-CD2 3.94Å; F55-L59 HydrophobicContact CE1-CG 4.29Å; F55-L59 HydrophobicContact CE2-CD2 3.86Å; F55-L59 HydrophobicContact CZ-CD2 3.51Å; F55-L59 HydrophobicContact CZ-CG 4.3Å; F55-L59 WeakPolarHBondContact O-CG 3.21Å; F55-L59 PolarHBondContact O-N 2.76Å; F55-L59 VanDerWaalsContact O-N 3.16Å; F55-M67 HydrophobicContact CE1-CE 4.14Å; F55-M67 HydrophobicContact CE1-SD 3.78Å; F55-M67 HydrophobicContact CZ-SD 4.18Å; F55-A81 HydrophobicContact CB-CB 4.47Å; F55-L84 HydrophobicContact CD1-CB 3.73Å; F55-L84 HydrophobicContact CD1-CD1 3.89Å; F55-L84 HydrophobicContact CD1-CG 4.46Å; F55-L84 HydrophobicContact CE1-CB 3.51Å; F55-L84 HydrophobicContact CE1-CD1 4.4Å; F55-L84 HydrophobicContact CZ-CB 4.3Å; F55-R85 HydrophobicContact CD2-CG 3.95Å; F55-R85 HydrophobicContact CE2-CG 3.31Å; F55-R85 HydrophobicContact CZ-CG 3.77Å; F55-L88 HydrophobicContact CZ-CD2 4.14Å
56	I	86.3	Confident	85.6	Confident	35 Å²	35	81.8 Å²	81.8	18%	0.179	38%	0.383	C	S	.	.	H	α-helix	trans	-62.3	-34.6	177.4	-71.5	177	0	0	0	112.2	Y52 Y53 N54 E58 Y64 L73	Y52-I56 HydrophobicContact CD1-CD1 3.96Å; Y52-I56 HydrophobicContact CE1-CD1 3.34Å; Y52-I56 HydrophobicContact CE2-CD1 4.41Å; Y52-I56 WeakPolarHBondContact O-CG1 3.48Å; Y52-I56 PolarHBondContact O-N 2.98Å; Y52-I56 VanDerWaalsContact O-N 3.09Å; Y53-I56 PolarHBondContact O-N 3.28Å; N54-I56 PolarHBondContact O-N 3.37Å; I56-E58 VanDerWaalsContact C-N 3.3Å; I56-Y64 HydrophobicContact CG2-CD2 4.17Å; I56-Y64 HydrophobicContact CG2-CE2 4.15Å; I56-L73 HydrophobicContact CD1-CD2 4.13Å; I56-L73 HydrophobicContact CG1-CD2 4.19Å
57	N	85.9	Confident	85.8	Confident	133 Å²	133	77.7 Å²	77.7	71%	0.711	36%	0.361	S	S	*	.	H	α-helix	trans	-74.3	-19.6	175.7	-66.2	-26.2	0	0	0	113.4	Y53 N54 F55	Y53-N57 PolarHBondContact O-N 3.3Å; Y53-N57 VanDerWaalsContact O-N 3.08Å; Y53-N57 PolarHBondContact O-ND2 3.05Å; N54-N57 PolarHBondContact O-N 3.17Å; N54-N57 VanDerWaalsContact O-N 3.15Å; F55-N57 VanDerWaalsContact C-N 3.28Å; F55-N57 PolarHBondContact O-N 3.36Å
58	E	87.1	Confident	86	Confident	135 Å²	135	76.7 Å²	76.7	63%	0.631	36%	0.357	S	S	*	.	H	α-helix	trans	-90	-12.4	176.4	-72.7	172.3	169.2	0	0	113.2	N54 F55 I56	N54-E58 PolarHBondContact ND2-OE1 2.91Å; N54-E58 PolarHBondContact ND2-OE2 3.28Å; N54-E58 WeakPolarHBondContact O-CG 3.42Å; N54-E58 PolarHBondContact O-N 3.26Å; F55-E58 PolarHBondContact O-N 3.33Å; I56-E58 VanDerWaalsContact C-N 3.3Å
59	L	89.4	Confident	86.1	Confident	22 Å²	22	78.2 Å²	78.2	12%	0.115	37%	0.372	C	S	.	.	S	Bend	trans	-67	142.5	174.1	-68.1	-179.6	0	0	0	111.8	F55 E63 Y64 M67 L88	F55-L59 HydrophobicContact CE1-CD1 4.27Å; F55-L59 HydrophobicContact CE1-CD2 3.94Å; F55-L59 HydrophobicContact CE1-CG 4.29Å; F55-L59 HydrophobicContact CE2-CD2 3.86Å; F55-L59 HydrophobicContact CZ-CD2 3.51Å; F55-L59 HydrophobicContact CZ-CG 4.3Å; F55-L59 WeakPolarHBondContact O-CG 3.21Å; F55-L59 PolarHBondContact O-N 2.76Å; F55-L59 VanDerWaalsContact O-N 3.16Å; L59-E63 HydrophobicContact CD2-CB 4.15Å; L59-Y64 HydrophobicContact CD1-CD2 4.33Å; L59-M67 HydrophobicContact CD1-SD 3.8Å; L59-M67 HydrophobicContact CD2-SD 4.27Å; L59-L88 HydrophobicContact CD2-CD2 3.64Å
60	S	88.8	Confident	86	Confident	51 Å²	51	78.3 Å²	78.3	36%	0.357	38%	0.384	S	S	.	.			trans	-68.6	154.4	160.8	68.3	0	0	0	0	111.1	E62 E63 Y64	S60-E62 PolarHBondContact O-N 3.08Å; S60-E62 VanDerWaalsContact O-N 3.13Å; S60-E63 WeakPolarHBondContact CB-OE2 3.26Å; S60-E63 PolarHBondContact N-OE2 2.93Å; S60-E63 VanDerWaalsContact N-OE2 3.15Å; S60-E63 PolarHBondContact O-N 3.09Å; S60-E63 VanDerWaalsContact O-N 3.08Å; S60-E63 VanDerWaalsContact OG-CD 3.24Å; S60-E63 VanDerWaalsContact OG-CG 3.24Å; S60-E63 WeakPolarHBondContact OG-CG 3.2Å; S60-E63 PolarHBondContact OG-N 3.08Å; S60-E63 PolarHBondContact OG-OE2 3.43Å; S60-Y64 PolarHBondContact O-N 3.32Å
61	E	87.1	Confident	85.9	Confident	112 Å²	112	78.7 Å²	78.7	52%	0.523	39%	0.39	S	S	.	.	H	α-helix	trans	-55.8	-29.1	177.6	171.8	64.6	-162.8	0	0	112.9	R65	E61-R65 WeakPolarHBondContact O-CD 3.37Å; E61-R65 VanDerWaalsContact O-CG 3.22Å; E61-R65 WeakPolarHBondContact O-CG 3.46Å; E61-R65 PolarHBondContact O-N 3.44Å; E61-R65 IonicContact OE1-CZ 2.67Å; E61-R65 IonicContact OE1-NE 2.69Å; E61-R65 PolarHBondContact OE1-NE 2.91Å; E61-R65 IonicContact OE1-NH2 3.95Å; E61-R65 PolarHBondContact OE1-NH2 2.92Å
62	E	87.1	Confident	86	Confident	151 Å²	151	78.5 Å²	78.5	71%	0.706	38%	0.384	S	S	*	.	H	α-helix	trans	-76.4	-41.3	176.9	-62.9	-178	177.2	0	0	111.9	S60 R65 L66	S60-E62 PolarHBondContact O-N 3.08Å; S60-E62 VanDerWaalsContact O-N 3.13Å; E62-R65 PolarHBondContact O-N 2.88Å; E62-L66 WeakPolarHBondContact O-CB 3.21Å; E62-L66 PolarHBondContact O-N 3.29Å
63	E	87.3	Confident	85.7	Confident	42 Å²	42	78.8 Å²	78.8	20%	0.196	39%	0.386	C	S	.	.	H	α-helix	trans	-69.4	-38.8	175.7	-69	167.8	130.1	0	0	111.8	L59 S60 L66 M67 L88 K92	L59-E63 HydrophobicContact CD2-CB 4.15Å; S60-E63 WeakPolarHBondContact CB-OE2 3.26Å; S60-E63 PolarHBondContact N-OE2 2.93Å; S60-E63 VanDerWaalsContact N-OE2 3.15Å; S60-E63 PolarHBondContact O-N 3.09Å; S60-E63 VanDerWaalsContact O-N 3.08Å; S60-E63 VanDerWaalsContact OG-CD 3.24Å; S60-E63 VanDerWaalsContact OG-CG 3.24Å; S60-E63 WeakPolarHBondContact OG-CG 3.2Å; S60-E63 PolarHBondContact OG-N 3.08Å; S60-E63 PolarHBondContact OG-OE2 3.43Å; E63-L66 PolarHBondContact O-N 2.67Å; E63-M67 WeakPolarHBondContact O-CG 3.37Å; E63-M67 PolarHBondContact O-N 3.11Å; E63-L88 HydrophobicContact CB-CD1 3.74Å; E63-L88 HydrophobicContact CB-CD2 4.32Å; E63-L88 HydrophobicContact CG-CD1 4.01Å; E63-L88 HydrophobicContact CG-CD2 4.41Å; E63-K92 HydrophobicContact CG-CD 4.32Å; E63-K92 WeakPolarHBondContact OE1-CE 3.47Å; E63-K92 IonicContact OE1-NZ 2.73Å; E63-K92 PolarHBondContact OE1-NZ 3.39Å
64	Y	87.6	Confident	85.5	Confident	70 Å²	70	74.8 Å²	74.8	28%	0.275	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-45.2	173.5	174.6	-104.2	0	0	0	111.7	I56 L59 S60 M67 R68 L73	I56-Y64 HydrophobicContact CG2-CD2 4.17Å; I56-Y64 HydrophobicContact CG2-CE2 4.15Å; L59-Y64 HydrophobicContact CD1-CD2 4.33Å; S60-Y64 PolarHBondContact O-N 3.32Å; Y64-M67 PolarHBondContact O-N 3.26Å; Y64-R68 WeakPolarHBondContact O-CB 3.43Å; Y64-R68 PolarHBondContact O-N 2.9Å; Y64-L73 HydrophobicContact CD2-CD1 4.46Å; Y64-L73 HydrophobicContact CE2-CD1 3.97Å
65	R	86.6	Confident	85	Confident	121 Å²	121	74.2 Å²	74.2	46%	0.457	38%	0.384	S	S	.	.	H	α-helix	trans	-60.5	-46.8	172.4	-71.3	168.4	-164.9	164.3	2.5	111.4	E61 E62 M67 R68 D69	E61-R65 WeakPolarHBondContact O-CD 3.37Å; E61-R65 VanDerWaalsContact O-CG 3.22Å; E61-R65 WeakPolarHBondContact O-CG 3.46Å; E61-R65 PolarHBondContact O-N 3.44Å; E61-R65 IonicContact OE1-CZ 2.67Å; E61-R65 IonicContact OE1-NE 2.69Å; E61-R65 PolarHBondContact OE1-NE 2.91Å; E61-R65 IonicContact OE1-NH2 3.95Å; E61-R65 PolarHBondContact OE1-NH2 2.92Å; E62-R65 PolarHBondContact O-N 2.88Å; R65-M67 PolarHBondContact O-N 2.95Å; R65-R68 PolarHBondContact O-N 2.91Å; R65-D69 WeakPolarHBondContact O-CB 3.32Å; R65-D69 PolarHBondContact O-N 3.4Å
66	L	87.6	Confident	84.5	Confident	48 Å²	48	75.7 Å²	75.7	25%	0.251	40%	0.395	S	S	.	.	H	α-helix	trans	-60.2	-41.9	-179.8	-178.2	58.1	0	0	0	112.6	E62 E63 G70 A91 K92 V95	E62-L66 WeakPolarHBondContact O-CB 3.21Å; E62-L66 PolarHBondContact O-N 3.29Å; E63-L66 PolarHBondContact O-N 2.67Å; L66-G70 PolarHBondContact O-N 3.23Å; L66-G70 VanDerWaalsContact O-N 3.15Å; L66-A91 HydrophobicContact CD1-CB 4.24Å; L66-A91 HydrophobicContact CD2-CB 3.94Å; L66-A91 HydrophobicContact CG-CB 3.85Å; L66-K92 HydrophobicContact CD2-CG 3.84Å; L66-V95 HydrophobicContact CD1-CG2 3.65Å; L66-V95 HydrophobicContact CD2-CG2 4.06Å
67	M	85.8	Confident	83.5	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-71	-36.8	174.7	-66.8	-166.5	81.3	0	0	113	F55 L59 E63 Y64 R65 N71 L72 L73 L84 R87 L88	F55-M67 HydrophobicContact CE1-CE 4.14Å; F55-M67 HydrophobicContact CE1-SD 3.78Å; F55-M67 HydrophobicContact CZ-SD 4.18Å; L59-M67 HydrophobicContact CD1-SD 3.8Å; L59-M67 HydrophobicContact CD2-SD 4.27Å; E63-M67 WeakPolarHBondContact O-CG 3.37Å; E63-M67 PolarHBondContact O-N 3.11Å; Y64-M67 PolarHBondContact O-N 3.26Å; R65-M67 PolarHBondContact O-N 2.95Å; M67-N71 PolarHBondContact O-N 2.86Å; M67-L72 HydrophobicContact CB-CB 4.31Å; M67-L72 HydrophobicContact CE-CB 4.12Å; M67-L72 PolarHBondContact O-N 3.27Å; M67-L73 HydrophobicContact CB-CD2 3.74Å; M67-L73 HydrophobicContact CB-CG 3.92Å; M67-L73 HydrophobicContact CE-CD2 4.05Å; M67-L73 HydrophobicContact CG-CD2 4.49Å; M67-L73 HydrophobicContact SD-CD2 3.94Å; M67-L84 HydrophobicContact CE-CB 4.18Å; M67-L84 HydrophobicContact CE-CD2 4.07Å; M67-L84 VanDerWaalsContact CE-O 3.23Å; M67-L84 WeakPolarHBondContact CE-O 3.41Å; M67-R87 HydrophobicContact CE-CB 4.43Å; M67-L88 HydrophobicContact CE-CB 4.2Å; M67-L88 HydrophobicContact CG-CB 4.17Å; M67-L88 HydrophobicContact CG-CD1 3.65Å; M67-L88 HydrophobicContact CG-CG 4.47Å; M67-L88 HydrophobicContact SD-CB 3.81Å; M67-L88 HydrophobicContact SD-CD1 4.07Å; M67-L88 HydrophobicContact SD-CG 4.35Å
68	R	85.4	Confident	82.9	Confident	139 Å²	139	74.5 Å²	74.5	53%	0.525	39%	0.386	S	S	.	.	H	α-helix	trans	-67.8	-52.8	179.2	172.5	178.8	169.9	145.7	-2.9	111.8	Y64 R65 G70 N71 L73	Y64-R68 WeakPolarHBondContact O-CB 3.43Å; Y64-R68 PolarHBondContact O-N 2.9Å; R65-R68 PolarHBondContact O-N 2.91Å; R68-G70 VanDerWaalsContact C-N 3.25Å; R68-G70 PolarHBondContact O-N 2.92Å; R68-N71 PolarHBondContact O-N 3.32Å; R68-N71 PolarHBondContact O-OD1 2.96Å; R68-L73 HydrophobicContact CB-CD1 4.25Å
69	D	83.6	Confident	82.4	Confident	126 Å²	126	68.5 Å²	68.5	67%	0.674	36%	0.358	S	S	*	.	H	α-helix	trans	-73.8	-21.5	-176.4	-62.5	-20.6	0	0	0	111.5	R65	R65-D69 WeakPolarHBondContact O-CB 3.32Å; R65-D69 PolarHBondContact O-N 3.4Å
70	G	81.4	Confident	81.9	Confident	42 Å²	42	69.7 Å²	69.7	43%	0.433	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	1.3	166.5	0	0	0	0	0	115.6	L66 R68 L72	L66-G70 PolarHBondContact O-N 3.23Å; L66-G70 VanDerWaalsContact O-N 3.15Å; R68-G70 VanDerWaalsContact C-N 3.25Å; R68-G70 PolarHBondContact O-N 2.92Å; G70-L72 WeakPolarHBondContact O-CD2 3.43Å; G70-L72 WeakPolarHBondContact O-CG 3.47Å; G70-L72 PolarHBondContact O-N 3.46Å
71	N	82.3	Confident	81.5	Confident	144 Å²	144	67.6 Å²	67.6	77%	0.77	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	25	-174.3	-67.8	-19.5	0	0	0	115.3	M67 R68	M67-N71 PolarHBondContact O-N 2.86Å; R68-N71 PolarHBondContact O-N 3.32Å; R68-N71 PolarHBondContact O-OD1 2.96Å
72	L	83.6	Confident	81.3	Confident	35 Å²	35	67.7 Å²	67.7	18%	0.183	35%	0.353	C	S	.	.			trans	-81	-19.7	-169.7	-59.7	178.5	0	0	0	114.6	M67 G70 G74 R87 A91	M67-L72 HydrophobicContact CB-CB 4.31Å; M67-L72 HydrophobicContact CE-CB 4.12Å; M67-L72 PolarHBondContact O-N 3.27Å; G70-L72 WeakPolarHBondContact O-CD2 3.43Å; G70-L72 WeakPolarHBondContact O-CG 3.47Å; G70-L72 PolarHBondContact O-N 3.46Å; L72-G74 PolarHBondContact O-N 3.05Å; L72-R87 HydrophobicContact CB-CB 4.23Å; L72-R87 HydrophobicContact CD1-CB 4.43Å; L72-R87 WeakPolarHBondContact O-CD 3.29Å; L72-R87 PolarHBondContact O-NH1 2.83Å; L72-A91 HydrophobicContact CD1-CB 3.63Å
73	L	80.1	Confident	81.1	Confident	23 Å²	23	64.1 Å²	64.1	12%	0.12	34%	0.336	C	S	.	.	S	Bend	trans	-63.8	-35.1	-175.2	-65.3	172	0	0	0	113.2	Y52 I56 Y64 M67 R68 L84	Y52-L73 WeakPolarHBondContact CE2-O 3.33Å; I56-L73 HydrophobicContact CD1-CD2 4.13Å; I56-L73 HydrophobicContact CG1-CD2 4.19Å; Y64-L73 HydrophobicContact CD2-CD1 4.46Å; Y64-L73 HydrophobicContact CE2-CD1 3.97Å; M67-L73 HydrophobicContact CB-CD2 3.74Å; M67-L73 HydrophobicContact CB-CG 3.92Å; M67-L73 HydrophobicContact CE-CD2 4.05Å; M67-L73 HydrophobicContact CG-CD2 4.49Å; M67-L73 HydrophobicContact SD-CD2 3.94Å; R68-L73 HydrophobicContact CB-CD1 4.25Å; L73-L84 WeakPolarHBondContact O-CD2 3.27Å
74	G	79.1	Confident	81	Confident	45 Å²	45	62.1 Å²	62.1	46%	0.464	33%	0.327	S	S	.	.			trans	62.7	-152.4	176.8	0	0	0	0	0	114.9	L72	L72-G74 PolarHBondContact O-N 3.05Å
75	T	76.6	Confident	80.9	Confident	71 Å²	71	63.5 Å²	63.5	44%	0.436	33%	0.332	S	S	.	.			trans	-96	128.2	-175.4	28.5	0	0	0	0	112.1	G77 E78 V79	T75-G77 PolarHBondContact O-N 2.67Å; T75-E78 WeakPolarHBondContact CB-OE2 3.38Å; T75-E78 PolarHBondContact O-N 3.36Å; T75-E78 PolarHBondContact OG1-OE2 3.1Å; T75-V79 PolarHBondContact O-N 3.43Å
76	P	75.1	Confident	81	Confident	45 Å²	45	64.8 Å²	64.8	29%	0.292	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	135.1	175.4	-21.3	30.2	0	0	0	112.3	Y52 E78	Y52-P76 HydrophobicContact CD1-CB 3.94Å; Y52-P76 HydrophobicContact CD1-CG 4.21Å; Y52-P76 HydrophobicContact CD2-CB 4.41Å; Y52-P76 HydrophobicContact CE1-CB 3.93Å; Y52-P76 HydrophobicContact CE1-CG 3.67Å; Y52-P76 HydrophobicContact CE2-CB 4.39Å; Y52-P76 HydrophobicContact CE2-CG 4.31Å; Y52-P76 HydrophobicContact CG-CB 4.23Å; P76-E78 PolarHBondContact O-N 2.82Å
77	G	66.1	Low	80.9	Confident	5 Å²	5	66.1 Å²	66.1	5%	0.052	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-20.6	176.2	0	0	0	0	0	115.7	T75	T75-G77 PolarHBondContact O-N 2.67Å
78	E	72.9	Confident	81	Confident	137 Å²	137	66.5 Å²	66.5	64%	0.64	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-44.7	173.9	-62.3	-175.3	151.9	0	0	111.5	T75 P76	T75-E78 WeakPolarHBondContact CB-OE2 3.38Å; T75-E78 PolarHBondContact O-N 3.36Å; T75-E78 PolarHBondContact OG1-OE2 3.1Å; P76-E78 PolarHBondContact O-N 2.82Å
79	V	76.3	Confident	81	Confident	9 Å²	9	64.1 Å²	64.1	6%	0.055	34%	0.344	C	S	.	.	S	Bend	trans	-83.3	137.1	177	-164.4	0	0	0	0	110.6	T75 E83 L84	T75-V79 PolarHBondContact O-N 3.43Å; V79-E83 HydrophobicContact CG1-CB 4.09Å; V79-E83 HydrophobicContact CG1-CG 4.21Å; V79-L84 HydrophobicContact CB-CD2 4.31Å; V79-L84 HydrophobicContact CB-CG 4.39Å; V79-L84 HydrophobicContact CG1-CD2 3.72Å; V79-L84 HydrophobicContact CG1-CG 3.78Å
80	T	79.1	Confident	81.3	Confident	48 Å²	48	59.1 Å²	59.1	29%	0.294	32%	0.322	S	S	.	.			trans	-80.4	152	174.8	62.9	0	0	0	0	111.9	E82 E83 L84	T80-E82 PolarHBondContact O-N 3.16Å; T80-E83 PolarHBondContact O-N 3.23Å; T80-E83 VanDerWaalsContact OG1-CB 3.24Å; T80-E83 WeakPolarHBondContact OG1-CB 3.42Å; T80-E83 PolarHBondContact OG1-N 3.19Å; T80-L84 WeakPolarHBondContact O-CG 3.3Å; T80-L84 PolarHBondContact O-N 3.27Å
81	A	80	Confident	81.4	Confident	7 Å²	7	57.4 Å²	57.4	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-28.6	177.5	0	0	0	0	0	111.9	A51 F55 R85	A51-A81 HydrophobicContact CB-CB 4.11Å; F55-A81 HydrophobicContact CB-CB 4.47Å; A81-R85 WeakPolarHBondContact O-CG 3.39Å; A81-R85 PolarHBondContact O-N 3.06Å; A81-R85 PolarHBondContact O-NH1 2.92Å
82	E	82.8	Confident	81.7	Confident	113 Å²	113	54.5 Å²	54.5	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-46.7	173.3	-65.6	56.5	-124.7	0	0	111.1	T80 R85 Q86	T80-E82 PolarHBondContact O-N 3.16Å; E82-R85 PolarHBondContact O-N 3.15Å; E82-R85 IonicContact OE1-CZ 3.62Å; E82-R85 IonicContact OE1-NH1 2.67Å; E82-R85 IonicContact OE1-NH2 3.71Å; E82-R85 PolarHBondContact OE1-NH2 3.37Å; E82-Q86 PolarHBondContact O-N 3.41Å
83	E	84.9	Confident	81.8	Confident	76 Å²	76	59.2 Å²	59.2	36%	0.355	31%	0.306	S	S	.	.	H	α-helix	trans	-70.5	-35.7	177.9	-170.1	-174.6	167	0	0	112	V79 T80 Q86 R87	V79-E83 HydrophobicContact CG1-CB 4.09Å; V79-E83 HydrophobicContact CG1-CG 4.21Å; T80-E83 PolarHBondContact O-N 3.23Å; T80-E83 VanDerWaalsContact OG1-CB 3.24Å; T80-E83 WeakPolarHBondContact OG1-CB 3.42Å; T80-E83 PolarHBondContact OG1-N 3.19Å; E83-Q86 PolarHBondContact O-N 3.2Å; E83-R87 WeakPolarHBondContact O-CB 3.24Å; E83-R87 VanDerWaalsContact O-CG 3.24Å; E83-R87 WeakPolarHBondContact O-CG 3.32Å; E83-R87 PolarHBondContact O-N 3.34Å; E83-R87 IonicContact OE1-CZ 3.57Å; E83-R87 IonicContact OE1-NE 3.1Å; E83-R87 PolarHBondContact OE1-NE 3.37Å; E83-R87 IonicContact OE1-NH2 3.67Å; E83-R87 PolarHBondContact OE1-NH2 3.41Å
84	L	85	Confident	81.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-40.9	172.2	-69.8	177.4	0	0	0	112.3	Y52 F55 M67 L73 V79 T80 R87 L88	Y52-L84 HydrophobicContact CD2-CD1 3.62Å; Y52-L84 HydrophobicContact CE2-CD1 4.02Å; Y52-L84 HydrophobicContact CG-CD1 4.42Å; F55-L84 HydrophobicContact CD1-CB 3.73Å; F55-L84 HydrophobicContact CD1-CD1 3.89Å; F55-L84 HydrophobicContact CD1-CG 4.46Å; F55-L84 HydrophobicContact CE1-CB 3.51Å; F55-L84 HydrophobicContact CE1-CD1 4.4Å; F55-L84 HydrophobicContact CZ-CB 4.3Å; M67-L84 HydrophobicContact CE-CB 4.18Å; M67-L84 HydrophobicContact CE-CD2 4.07Å; M67-L84 VanDerWaalsContact CE-O 3.23Å; M67-L84 WeakPolarHBondContact CE-O 3.41Å; L73-L84 WeakPolarHBondContact O-CD2 3.27Å; V79-L84 HydrophobicContact CB-CD2 4.31Å; V79-L84 HydrophobicContact CB-CG 4.39Å; V79-L84 HydrophobicContact CG1-CD2 3.72Å; V79-L84 HydrophobicContact CG1-CG 3.78Å; T80-L84 WeakPolarHBondContact O-CG 3.3Å; T80-L84 PolarHBondContact O-N 3.27Å; L84-R87 PolarHBondContact O-N 2.77Å; L84-L88 WeakPolarHBondContact O-CB 3.39Å; L84-L88 PolarHBondContact O-N 3.06Å
85	R	85.1	Confident	81.8	Confident	100 Å²	100	68.5 Å²	68.5	38%	0.377	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-48.1	171.2	-74.3	-175.2	-59.9	-89.4	7.7	111.6	F55 A81 E82 R87 L88 D89	F55-R85 HydrophobicContact CD2-CG 3.95Å; F55-R85 HydrophobicContact CE2-CG 3.31Å; F55-R85 HydrophobicContact CZ-CG 3.77Å; A81-R85 WeakPolarHBondContact O-CG 3.39Å; A81-R85 PolarHBondContact O-N 3.06Å; A81-R85 PolarHBondContact O-NH1 2.92Å; E82-R85 PolarHBondContact O-N 3.15Å; E82-R85 IonicContact OE1-CZ 3.62Å; E82-R85 IonicContact OE1-NH1 2.67Å; E82-R85 IonicContact OE1-NH2 3.71Å; E82-R85 PolarHBondContact OE1-NH2 3.37Å; R85-R87 VanDerWaalsContact C-N 3.3Å; R85-R87 PolarHBondContact O-N 3.42Å; R85-L88 WeakPolarHBondContact O-CB 3.32Å; R85-L88 PolarHBondContact O-N 3.18Å; R85-L88 VanDerWaalsContact O-N 3.09Å; R85-D89 PolarHBondContact O-N 3.47Å
86	Q	87.3	Confident	81.7	Confident	148 Å²	148	70.2 Å²	70.2	69%	0.692	35%	0.348	S	S	*	.	H	α-helix	trans	-60.9	-37.2	178.3	-167.8	175.8	18.8	0	0	112.9	E82 E83 G90	E82-Q86 PolarHBondContact O-N 3.41Å; E83-Q86 PolarHBondContact O-N 3.2Å; Q86-G90 PolarHBondContact O-N 2.98Å; Q86-G90 VanDerWaalsContact O-N 3.09Å
87	R	85.9	Confident	81.5	Confident	76 Å²	76	72.2 Å²	72.2	29%	0.287	36%	0.364	S	S	.	.	H	α-helix	trans	-67	-41.3	173.3	-69.7	169.7	-174.7	-165.4	4	111.9	M67 L72 E83 L84 R85 A91	M67-R87 HydrophobicContact CE-CB 4.43Å; L72-R87 HydrophobicContact CB-CB 4.23Å; L72-R87 HydrophobicContact CD1-CB 4.43Å; L72-R87 WeakPolarHBondContact O-CD 3.29Å; L72-R87 PolarHBondContact O-NH1 2.83Å; E83-R87 WeakPolarHBondContact O-CB 3.24Å; E83-R87 VanDerWaalsContact O-CG 3.24Å; E83-R87 WeakPolarHBondContact O-CG 3.32Å; E83-R87 PolarHBondContact O-N 3.34Å; E83-R87 IonicContact OE1-CZ 3.57Å; E83-R87 IonicContact OE1-NE 3.1Å; E83-R87 PolarHBondContact OE1-NE 3.37Å; E83-R87 IonicContact OE1-NH2 3.67Å; E83-R87 PolarHBondContact OE1-NH2 3.41Å; L84-R87 PolarHBondContact O-N 2.77Å; R85-R87 VanDerWaalsContact C-N 3.3Å; R85-R87 PolarHBondContact O-N 3.42Å; R87-A91 PolarHBondContact O-N 3.04Å; R87-A91 VanDerWaalsContact O-N 3.1Å
88	L	87.7	Confident	81.1	Confident	8 Å²	8	78.8 Å²	78.8	4%	0.042	39%	0.393	C	S	.	.	H	α-helix	trans	-61.4	-50.1	175.3	174.1	64.6	0	0	0	111.5	F55 L59 E63 M67 L84 R85 G90 A91 K92	F55-L88 HydrophobicContact CZ-CD2 4.14Å; L59-L88 HydrophobicContact CD2-CD2 3.64Å; E63-L88 HydrophobicContact CB-CD1 3.74Å; E63-L88 HydrophobicContact CB-CD2 4.32Å; E63-L88 HydrophobicContact CG-CD1 4.01Å; E63-L88 HydrophobicContact CG-CD2 4.41Å; M67-L88 HydrophobicContact CE-CB 4.2Å; M67-L88 HydrophobicContact CG-CB 4.17Å; M67-L88 HydrophobicContact CG-CD1 3.65Å; M67-L88 HydrophobicContact CG-CG 4.47Å; M67-L88 HydrophobicContact SD-CB 3.81Å; M67-L88 HydrophobicContact SD-CD1 4.07Å; M67-L88 HydrophobicContact SD-CG 4.35Å; L84-L88 WeakPolarHBondContact O-CB 3.39Å; L84-L88 PolarHBondContact O-N 3.06Å; R85-L88 WeakPolarHBondContact O-CB 3.32Å; R85-L88 PolarHBondContact O-N 3.18Å; R85-L88 VanDerWaalsContact O-N 3.09Å; L88-G90 PolarHBondContact O-N 2.82Å; L88-A91 WeakPolarHBondContact O-CA 3.37Å; L88-A91 WeakPolarHBondContact O-CB 3.24Å; L88-A91 PolarHBondContact O-N 3.12Å; L88-K92 HydrophobicContact CD1-CD 3.82Å; L88-K92 HydrophobicContact CD1-CG 4.15Å; L88-K92 HydrophobicContact CD2-CD 4.26Å; L88-K92 HydrophobicContact CG-CD 3.68Å; L88-K92 HydrophobicContact CG-CG 4.4Å; L88-K92 WeakPolarHBondContact O-CG 3.39Å; L88-K92 PolarHBondContact O-N 3.24Å
89	D	87.3	Confident	79.9	Confident	89 Å²	89	77.7 Å²	77.7	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-63.7	-42.5	-177.9	-68.5	-36.5	0	0	0	111.1	R85 A91 K92 E93	R85-D89 PolarHBondContact O-N 3.47Å; D89-A91 PolarHBondContact O-N 2.8Å; D89-K92 PolarHBondContact O-N 3.38Å; D89-E93 WeakPolarHBondContact O-CB 3.49Å; D89-E93 PolarHBondContact O-N 2.61Å
90	G	87.9	Confident	78.2	Confident	21 Å²	21	84.8 Å²	84.8	22%	0.216	43%	0.43	C	S	.	.	H	α-helix	trans	-65.9	-14.8	172	0	0	0	0	0	114.9	Q86 L88 R94	Q86-G90 PolarHBondContact O-N 2.98Å; Q86-G90 VanDerWaalsContact O-N 3.09Å; L88-G90 PolarHBondContact O-N 2.82Å; G90-R94 VanDerWaalsContact O-CD 3.28Å; G90-R94 WeakPolarHBondContact O-CD 3.46Å; G90-R94 VanDerWaalsContact O-CG 3.27Å; G90-R94 WeakPolarHBondContact O-CG 3.42Å; G90-R94 PolarHBondContact O-NE 3.09Å; G90-R94 VanDerWaalsContact O-NE 3.14Å
91	A	85.4	Confident	76.3	Confident	6 Å²	6	87.6 Å²	87.6	5%	0.05	46%	0.458	C	S	.	.	H	α-helix	trans	-87.4	-42.7	169.2	0	0	0	0	0	111.5	L66 L72 R87 L88 D89 E93 R94 V95	L66-A91 HydrophobicContact CD1-CB 4.24Å; L66-A91 HydrophobicContact CD2-CB 3.94Å; L66-A91 HydrophobicContact CG-CB 3.85Å; L72-A91 HydrophobicContact CD1-CB 3.63Å; R87-A91 PolarHBondContact O-N 3.04Å; R87-A91 VanDerWaalsContact O-N 3.1Å; L88-A91 WeakPolarHBondContact O-CA 3.37Å; L88-A91 WeakPolarHBondContact O-CB 3.24Å; L88-A91 PolarHBondContact O-N 3.12Å; D89-A91 PolarHBondContact O-N 2.8Å; A91-E93 VanDerWaalsContact C-N 3.3Å; A91-E93 PolarHBondContact O-N 2.69Å; A91-R94 WeakPolarHBondContact O-CB 3.32Å; A91-R94 PolarHBondContact O-N 2.85Å; A91-R94 VanDerWaalsContact O-N 3.14Å; A91-V95 PolarHBondContact O-N 3.16Å
92	K	87.1	Confident	74.5	Confident	83 Å²	83	93.3 Å²	93.3	36%	0.361	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-38.9	175.9	-70.8	164.6	68.8	175.5	0	111.3	E63 L66 L88 D89 R94 V95 S96	E63-K92 HydrophobicContact CG-CD 4.32Å; E63-K92 WeakPolarHBondContact OE1-CE 3.47Å; E63-K92 IonicContact OE1-NZ 2.73Å; E63-K92 PolarHBondContact OE1-NZ 3.39Å; L66-K92 HydrophobicContact CD2-CG 3.84Å; L88-K92 HydrophobicContact CD1-CD 3.82Å; L88-K92 HydrophobicContact CD1-CG 4.15Å; L88-K92 HydrophobicContact CD2-CD 4.26Å; L88-K92 HydrophobicContact CG-CD 3.68Å; L88-K92 HydrophobicContact CG-CG 4.4Å; L88-K92 WeakPolarHBondContact O-CG 3.39Å; L88-K92 PolarHBondContact O-N 3.24Å; D89-K92 PolarHBondContact O-N 3.38Å; K92-R94 PolarHBondContact O-N 3.13Å; K92-V95 PolarHBondContact O-N 3.35Å; K92-S96 VanDerWaalsContact O-CB 3.31Å; K92-S96 WeakPolarHBondContact O-CB 3.31Å; K92-S96 PolarHBondContact O-N 3.42Å
93	E	85.9	Confident	72.5	Confident	133 Å²	133	95.8 Å²	95.8	62%	0.621	50%	0.495	S	S	*	.	H	α-helix	trans	-60.3	-42.6	172.9	-174.2	179.8	-158.6	0	0	112.1	D89 A91 S96 S97	D89-E93 WeakPolarHBondContact O-CB 3.49Å; D89-E93 PolarHBondContact O-N 2.61Å; A91-E93 VanDerWaalsContact C-N 3.3Å; A91-E93 PolarHBondContact O-N 2.69Å; E93-S96 PolarHBondContact O-N 3.09Å; E93-S97 VanDerWaalsContact O-CB 3.29Å; E93-S97 WeakPolarHBondContact O-CB 3.42Å; E93-S97 PolarHBondContact O-N 2.69Å; E93-S97 PolarHBondContact O-OG 3.15Å
94	R	80.4	Confident	69.9	Low	184 Å²	184	102.4 Å²	102.4	69%	0.694	52%	0.517	S	S	*	.	H	α-helix	trans	-65.7	-41.4	178	-68.1	168.2	-165.8	179.5	4.4	112.2	G90 A91 K92 S97 Q98	G90-R94 VanDerWaalsContact O-CD 3.28Å; G90-R94 WeakPolarHBondContact O-CD 3.46Å; G90-R94 VanDerWaalsContact O-CG 3.27Å; G90-R94 WeakPolarHBondContact O-CG 3.42Å; G90-R94 PolarHBondContact O-NE 3.09Å; G90-R94 VanDerWaalsContact O-NE 3.14Å; A91-R94 WeakPolarHBondContact O-CB 3.32Å; A91-R94 PolarHBondContact O-N 2.85Å; A91-R94 VanDerWaalsContact O-N 3.14Å; K92-R94 PolarHBondContact O-N 3.13Å; R94-S97 PolarHBondContact O-N 3.19Å; R94-Q98 PolarHBondContact O-N 3.45Å
95	V	78.1	Confident	67.4	Low	79 Å²	79	107.4 Å²	107.4	48%	0.479	55%	0.552	S	S	.	*	H	α-helix	trans	-65.5	-45.2	174.4	175.8	0	0	0	0	110.4	L66 A91 K92 S97 Q98	L66-V95 HydrophobicContact CD1-CG2 3.65Å; L66-V95 HydrophobicContact CD2-CG2 4.06Å; A91-V95 PolarHBondContact O-N 3.16Å; K92-V95 PolarHBondContact O-N 3.35Å; V95-S97 PolarHBondContact O-N 2.96Å; V95-Q98 WeakPolarHBondContact O-CB 3.43Å; V95-Q98 PolarHBondContact O-N 3.08Å; V95-Q98 VanDerWaalsContact O-N 3.11Å
96	S	76.5	Confident	65	Low	107 Å²	107	111.4 Å²	111.4	75%	0.748	58%	0.575	S	S	*	*	H	α-helix	trans	-66	-19.1	176.7	-170.8	0	0	0	0	113.9	K92 E93	K92-S96 VanDerWaalsContact O-CB 3.31Å; K92-S96 WeakPolarHBondContact O-CB 3.31Å; K92-S96 PolarHBondContact O-N 3.42Å; E93-S96 PolarHBondContact O-N 3.09Å
97	S	69.6	Low	62.4	Low	87 Å²	87	109.4 Å²	109.4	61%	0.608	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-4.7	176.3	-58.4	0	0	0	0	113.2	E93 R94 V95	E93-S97 VanDerWaalsContact O-CB 3.29Å; E93-S97 WeakPolarHBondContact O-CB 3.42Å; E93-S97 PolarHBondContact O-N 2.69Å; E93-S97 PolarHBondContact O-OG 3.15Å; R94-S97 PolarHBondContact O-N 3.19Å; V95-S97 PolarHBondContact O-N 2.96Å
98	Q	58.1	Low	59.7	Low	144 Å²	144	111.1 Å²	111.1	67%	0.673	60%	0.603	S	S	*	*	S	Bend	trans	-82.3	121.8	-177.3	-170.2	171.2	-7.1	0	0	110.6	R94 V95	R94-Q98 PolarHBondContact O-N 3.45Å; V95-Q98 WeakPolarHBondContact O-CB 3.43Å; V95-Q98 PolarHBondContact O-N 3.08Å; V95-Q98 VanDerWaalsContact O-N 3.11Å
99	P	46.9	Very low	56.9	Low	114 Å²	114	118 Å²	118	74%	0.74	64%	0.64	S	S	*	*			trans	-68.2	138.1	-176.9	26.5	-34	0	0	0	112.1	A101	P99-A101 PolarHBondContact O-N 3.05Å
100	H	41.6	Very low	54.3	Low	158 Å²	158	119.2 Å²	119.2	73%	0.731	66%	0.656	S	S	*	*			trans	-69.7	91.1	-170.1	-152	-71	0	0	0	112.6	E102	H100-E102 IonicContact CE1-OE2 3.84Å; H100-E102 PolarHBondContact CE1-OE2 2.84Å; H100-E102 IonicContact ND1-OE2 3.08Å; H100-E102 PolarHBondContact O-N 3.37Å; H100-E102 VanDerWaalsContact O-N 3.15Å
101	A	38.6	Very low	51.5	Low	107 Å²	107	121.6 Å²	121.6	88%	0.884	68%	0.68	S	S	*	*			trans	-86.1	72.7	177.4	0	0	0	0	0	111.5	P99	P99-A101 PolarHBondContact O-N 3.05Å
102	E	42	Very low	49	Very low	127 Å²	127	129 Å²	129	59%	0.593	71%	0.714	S	S	*	*			trans	-85.8	147.9	-177.2	-122.6	-166.1	148.2	0	0	114.8	H100	H100-E102 IonicContact CE1-OE2 3.84Å; H100-E102 PolarHBondContact CE1-OE2 2.84Å; H100-E102 IonicContact ND1-OE2 3.08Å; H100-E102 PolarHBondContact O-N 3.37Å; H100-E102 VanDerWaalsContact O-N 3.15Å
103	Q	41.3	Very low	46.3	Very low	164 Å²	164	132 Å²	132	77%	0.766	73%	0.729	S	S	*	*			trans	38.5	102.7	154.8	-63.1	176.6	31.1	0	0	118.7
104	R	30	Very low	43.6	Very low	215 Å²	215	134.8 Å²	134.8	81%	0.811	74%	0.742	S	S	*	*			trans	-141.5	88.7	135.9	-162.1	170.3	-172.6	-174.8	1.3	113.8	T107	R104-T107 PolarHBondContact NH2-OG1 3.38Å
105	S	32.7	Very low	41	Very low	106 Å²	106	131.4 Å²	131.4	74%	0.741	75%	0.746	S	S	*	*			trans	-94.7	135.1	162	-65.1	0	0	0	0	109.8
106	Q	35	Very low	38.7	Very low	184 Å²	184	132.9 Å²	132.9	86%	0.86	76%	0.76	S	S	*	*			trans	59	103.9	164.7	-53.7	177.4	22.7	0	0	118.2
107	T	31.9	Very low	36.4	Very low	106 Å²	106	133.1 Å²	133.1	65%	0.65	76%	0.762	S	S	*	*			trans	-172.9	110.3	137.2	48.7	0	0	0	0	109.6	R104	R104-T107 PolarHBondContact NH2-OG1 3.38Å
108	A	29	Very low	34.3	Very low	111 Å²	111	134.9 Å²	134.9	92%	0.917	77%	0.774	S	S	*	*			trans	158.8	128.2	148.9	0	0	0	0	0	110.6
109	D	30.4	Very low	33.1	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	79%	0.785	S	S	*	*			trans	-126.3	171.9	169.5	179.6	27	0	0	0	107.7
110	S	32.9	Very low	32.3	Very low	114 Å²	114	131.5 Å²	131.5	80%	0.797	79%	0.788	S	S	*	*			trans	89.9	140.8	174.5	-38.8	0	0	0	0	118.3
111	G	29	Very low	31.9	Very low	71 Å²	71	132.6 Å²	132.6	73%	0.732	79%	0.794	S	S	*	*			trans	95.5	74.7	160.5	0	0	0	0	0	115.7
112	E	31.3	Very low	31.6	Very low	161 Å²	161	136.9 Å²	136.9	75%	0.752	80%	0.795	S	S	*	*				83.8	124.5	73.4	-74	-146.6	92.5	0	0	117.2
113	Q	30.6	Very low	31.1	Very low	147 Å²	147	141.8 Å²	141.8	69%	0.687	81%	0.808	S	S	*	*			trans	47	119.2	148.3	-51.4	-178.6	43.9	0	0	120.9
114	Q	30	Very low	30.5	Very low	190 Å²	190	138 Å²	138	89%	0.888	81%	0.813	S	S	*	*				-170.7	171.5	96.6	-101.8	171.4	69.1	0	0	113.6
115	S	26.2	Very low	30.5	Very low	113 Å²	113	133 Å²	133	79%	0.79	82%	0.818	S	S	*	*			trans	-112.2	-172.7	-161.6	-55.6	0	0	0	0	113.5
116	S	28.5	Very low	30.3	Very low	110 Å²	110	132 Å²	132	77%	0.769	82%	0.824	S	S	*	*			trans	76.9	131.9	176.1	76	0	0	0	0	115.7
117	S	27.9	Very low	29.9	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	82%	0.823	S	S	*	*			cis	93	102.7	18	86.4	0	0	0	0	116.9
118	S	27.3	Very low	29.8	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	84%	0.838	S	S	*	*			trans	-159.5	147.3	147.1	54.2	0	0	0	0	110.2
119	A	32.2	Very low	29.6	Very low	110 Å²	110	132.8 Å²	132.8	91%	0.909	83%	0.833	S	S	*	*			trans	-90.5	163.8	171	0	0	0	0	0	111
120	G	29.7	Very low	29.4	Very low	77 Å²	77	129.4 Å²	129.4	79%	0.794	84%	0.835	S	S	*	*			trans	-168.1	91.4	176	0	0	0	0	0	111.7
121	E	34.3	Very low	29.4	Very low	182 Å²	182	129.3 Å²	129.3	85%	0.85	84%	0.841	S	S	*	*			trans	-72.7	148.1	161.2	-65.3	171.8	73.7	0	0	109.5
122	E	31.9	Very low	29.2	Very low	196 Å²	196	129.2 Å²	129.2	92%	0.916	84%	0.84	S	S	*	*				-158.9	175.3	123.6	-120.3	-172	161.6	0	0	113.9
123	R	31.3	Very low	29.3	Very low	231 Å²	231	128.4 Å²	128.4	87%	0.872	85%	0.847	S	S	*	*			trans	-111.6	152.9	-170.8	-54.5	166.8	175.9	-178.8	-2.2	110.4
124	G	28.3	Very low	29.3	Very low	83 Å²	83	127.8 Å²	127.8	86%	0.856	85%	0.853	S	S	*	*			trans	-168.4	108.8	168.9	0	0	0	0	0	113.2
125	A	30.6	Very low	29.2	Very low	111 Å²	111	128 Å²	128	92%	0.917	85%	0.854	S	S	*	*			trans	-96.2	149.3	-172.5	0	0	0	0	0	114
126	G	27.9	Very low	29.4	Very low	84 Å²	84	127.3 Å²	127.3	87%	0.866	86%	0.855	S	S	*	*			trans	117.5	122.2	140.5	0	0	0	0	0	117.6
127	G	26.8	Very low	29.3	Very low	82 Å²	82	125.6 Å²	125.6	85%	0.845	85%	0.854	S	S	*	*			trans	176.3	121.7	168.4	0	0	0	0	0	111.3
128	R	29.5	Very low	29.9	Very low	257 Å²	257	125.3 Å²	125.3	97%	0.97	86%	0.859	S	S	*	*			trans	-98.8	148.4	177.2	-70.6	172.8	162.7	-166.6	-4.3	110.4
129	G	26.2	Very low	30.1	Very low	79 Å²	79	126.1 Å²	126.1	81%	0.814	85%	0.854	S	S	*	*			trans	168.9	128.5	154.4	0	0	0	0	0	116.4
130	G	25.8	Very low	30.3	Very low	84 Å²	84	126 Å²	126	87%	0.866	85%	0.847	S	S	*	*			trans	81.6	125.5	153.2	0	0	0	0	0	117.7
131	A	32.2	Very low	30.5	Very low	112 Å²	112	127 Å²	127	93%	0.926	84%	0.841	S	S	*	*			trans	-95	145.6	157	0	0	0	0	0	108.9
132	G	25.6	Very low	30.7	Very low	69 Å²	69	124.8 Å²	124.8	71%	0.711	84%	0.835	S	S	*	*			trans	-163.9	70	-176.7	0	0	0	0	0	111.5	T134	G132-T134 PolarHBondContact O-N 3.15Å
133	T	32.1	Very low	31	Very low	144 Å²	144	117.8 Å²	117.8	88%	0.883	82%	0.816	S	S	*	*			trans	-73.6	104.7	170.3	44.7	0	0	0	0	109.8
134	T	30.1	Very low	31.1	Very low	134 Å²	134	112.8 Å²	112.8	82%	0.822	81%	0.807	S	S	*	*			trans	-125.3	123.2	163.3	47	0	0	0	0	106.9	G132	G132-T134 PolarHBondContact O-N 3.15Å
135	E	28.7	Very low	32.2	Very low	195 Å²	195	110.5 Å²	110.5	91%	0.911	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-79	134.5	-171.2	-53.4	-159.6	137.7	0	0	110.9
136	A	30.2	Very low	32.7	Very low	97 Å²	97	106.9 Å²	106.9	80%	0.802	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-82.9	131	169.3	0	0	0	0	0	108.6
137	G	26.6	Very low	33.4	Very low	74 Å²	74	107.7 Å²	107.7	76%	0.763	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.1	141.8	-176.1	0	0	0	0	0	113	D139	G137-D139 PolarHBondContact O-N 2.81Å
138	A	41.6	Very low	34.4	Very low	107 Å²	107	109.7 Å²	109.7	88%	0.884	71%	0.714	S	S	*	*			trans	-84.3	96.5	-178.2	0	0	0	0	0	111.1
139	D	30	Very low	35.3	Very low	140 Å²	140	98.3 Å²	98.3	75%	0.749	67%	0.671	S	S	*	*			trans	-117.8	109.4	173.5	-97.7	-57.9	0	0	0	113	G137 S141	G137-D139 PolarHBondContact O-N 2.81Å; D139-S141 PolarHBondContact O-N 2.95Å
140	S	36.4	Very low	36.1	Very low	109 Å²	109	95.6 Å²	95.6	76%	0.762	64%	0.637	S	S	*	*			trans	59.5	19.5	141.6	-58.5	0	0	0	0	121	N142	S140-N142 PolarHBondContact O-N 3.09Å
141	S	34.6	Very low	36.9	Very low	98 Å²	98	95.3 Å²	95.3	69%	0.685	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	19.4	179.1	63.6	0	0	0	0	116.8	D139 G143	D139-S141 PolarHBondContact O-N 2.95Å; S141-G143 VanDerWaalsContact C-N 3.25Å; S141-G143 PolarHBondContact O-N 2.78Å; S141-G143 VanDerWaalsContact O-N 3.16Å
142	N	39	Very low	37.5	Very low	134 Å²	134	93 Å²	93	72%	0.717	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-14.8	-173.6	-93.1	-37.7	0	0	0	115.5	S140	S140-N142 PolarHBondContact O-N 3.09Å
143	G	36.9	Very low	38.1	Very low	50 Å²	50	91.7 Å²	91.7	52%	0.515	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.9	-49.5	-177.7	0	0	0	0	0	114.8	S141 S145 L146	S141-G143 VanDerWaalsContact C-N 3.25Å; S141-G143 PolarHBondContact O-N 2.78Å; S141-G143 VanDerWaalsContact O-N 3.16Å; G143-S145 PolarHBondContact O-N 3.3Å; G143-L146 PolarHBondContact O-N 3.4Å
144	D	34.1	Very low	38.6	Very low	126 Å²	126	91.4 Å²	91.4	67%	0.674	55%	0.548	S	S	*	.	H	α-helix	trans	-64.5	-40.6	-166.8	-73.6	-43.7	0	0	0	113.3	L146 L147 E148	D144-L146 PolarHBondContact O-N 3.47Å; D144-L146 VanDerWaalsContact O-N 3.08Å; D144-L147 PolarHBondContact O-N 3.22Å; D144-E148 PolarHBondContact O-N 2.9Å
145	S	51.7	Low	39.1	Very low	35 Å²	35	95.4 Å²	95.4	25%	0.245	55%	0.548	C	S	.	.	H	α-helix	trans	-72.1	-4.2	-176.1	-157.9	0	0	0	0	113.6	G143 W149 R161	G143-S145 PolarHBondContact O-N 3.3Å; S145-W149 WeakPolarHBondContact O-CB 3.19Å; S145-R161 PolarHBondContact O-NH1 3.39Å; S145-R161 PolarHBondContact OG-NE 3.09Å; S145-R161 PolarHBondContact OG-NH2 3.47Å
146	L	39.9	Very low	39.8	Very low	34 Å²	34	90 Å²	90	18%	0.178	53%	0.529	C	S	.	.	H	α-helix	trans	-86.3	-42.4	165.6	-164.7	83	0	0	0	111.8	G143 D144 W149 L150 R545 M548	G143-L146 PolarHBondContact O-N 3.4Å; D144-L146 PolarHBondContact O-N 3.47Å; D144-L146 VanDerWaalsContact O-N 3.08Å; L146-W149 PolarHBondContact O-N 2.98Å; L146-L150 WeakPolarHBondContact O-CG 3.03Å; L146-L150 PolarHBondContact O-N 3.33Å; L146-R545 HydrophobicContact CD2-CG 4.26Å; L146-M548 HydrophobicContact CD1-CE 3.64Å; L146-M548 HydrophobicContact CD1-SD 4.27Å
147	L	42.6	Very low	40.8	Very low	102 Å²	102	86.3 Å²	86.3	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-69.3	-39.6	177.1	-87.8	68.2	0	0	0	111.2	D144 L150 N151	D144-L147 PolarHBondContact O-N 3.22Å; L147-L150 PolarHBondContact O-N 2.93Å; L147-N151 PolarHBondContact O-N 2.9Å
148	E	48.6	Very low	42.1	Very low	124 Å²	124	86.8 Å²	86.8	58%	0.579	49%	0.485	S	S	*	.	H	α-helix	trans	-61.6	-42	172.5	-171.8	-174.9	-150	0	0	111.6	D144 N151 T152	D144-E148 PolarHBondContact O-N 2.9Å; E148-N151 PolarHBondContact O-N 3.46Å; E148-T152 WeakPolarHBondContact O-CB 3.39Å; E148-T152 PolarHBondContact O-N 2.88Å; E148-T152 PolarHBondContact O-OG1 3.47Å
149	W	48.1	Very low	42.8	Very low	18 Å²	18	82 Å²	82	7%	0.068	45%	0.445	C	S	.	.	H	α-helix	trans	-63.3	-44.6	173.9	174.5	77.4	0	0	0	111.8	S145 L146 N151 T152 F153 M548	S145-W149 WeakPolarHBondContact O-CB 3.19Å; L146-W149 PolarHBondContact O-N 2.98Å; W149-N151 PolarHBondContact O-N 3.05Å; W149-T152 PolarHBondContact O-N 3.08Å; W149-T152 VanDerWaalsContact O-N 3.17Å; W149-F153 HydrophobicContact CZ2-CD2 4.43Å; W149-F153 WeakPolarHBondContact O-CB 3.47Å; W149-F153 PolarHBondContact O-N 2.74Å; W149-M548 HydrophobicContact CZ3-SD 4.26Å
150	L	43.7	Very low	43.9	Very low	21 Å²	21	79.4 Å²	79.4	11%	0.11	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-28.9	175.1	-77.2	171	0	0	0	112.9	L146 L147 R154 R541	L146-L150 WeakPolarHBondContact O-CG 3.03Å; L146-L150 PolarHBondContact O-N 3.33Å; L147-L150 PolarHBondContact O-N 2.93Å; L150-R154 WeakPolarHBondContact O-CG 3.47Å; L150-R154 PolarHBondContact O-NE 3.35Å; L150-R541 HydrophobicContact CD2-CG 4.45Å
151	N	42.7	Very low	44.5	Very low	79 Å²	79	77.2 Å²	77.2	42%	0.422	41%	0.41	S	S	.	.	H	α-helix	trans	-83.4	-30.1	173.7	-77.6	-21.6	0	0	0	113.1	L147 E148 W149 R154	L147-N151 PolarHBondContact O-N 2.9Å; E148-N151 PolarHBondContact O-N 3.46Å; W149-N151 PolarHBondContact O-N 3.05Å; N151-R154 PolarHBondContact OD1-NE 3.35Å
152	T	44	Very low	45.7	Very low	62 Å²	62	76.2 Å²	76.2	38%	0.38	40%	0.403	S	S	.	.	H	α-helix	trans	-70.2	-40.9	173.2	-58.8	0	0	0	0	111.1	E148 W149 R154 R155 T156	E148-T152 WeakPolarHBondContact O-CB 3.39Å; E148-T152 PolarHBondContact O-N 2.88Å; E148-T152 PolarHBondContact O-OG1 3.47Å; W149-T152 PolarHBondContact O-N 3.08Å; W149-T152 VanDerWaalsContact O-N 3.17Å; T152-R154 VanDerWaalsContact C-N 3.26Å; T152-R154 PolarHBondContact O-N 2.86Å; T152-R155 PolarHBondContact O-N 2.99Å; T152-T156 PolarHBondContact O-N 2.85Å
153	F	38	Very low	46.3	Very low	42 Å²	42	70.9 Å²	70.9	18%	0.184	38%	0.379	C	S	.	.	H	α-helix	trans	-53	-42.4	174	-178.3	-102.8	0	0	0	112.3	W149 R155 G157 F183	W149-F153 HydrophobicContact CZ2-CD2 4.43Å; W149-F153 WeakPolarHBondContact O-CB 3.47Å; W149-F153 PolarHBondContact O-N 2.74Å; F153-R155 PolarHBondContact O-N 2.97Å; F153-G157 PolarHBondContact O-N 3.15Å; F153-F183 AromaticContact CE2-CE2 3.65Å; F153-F183 HydrophobicContact CE2-CE2 3.65Å; F153-F183 AromaticContact CE2-CZ 3.67Å; F153-F183 HydrophobicContact CE2-CZ 3.67Å; F153-F183 AromaticContact CZ-CE2 3.82Å; F153-F183 HydrophobicContact CZ-CE2 3.82Å; F153-F183 AromaticContact CZ-CZ 3.87Å; F153-F183 HydrophobicContact CZ-CZ 3.87Å
154	R	42.7	Very low	46.7	Very low	138 Å²	138	74.2 Å²	74.2	52%	0.521	38%	0.381	S	S	.	.	H	α-helix	trans	-63	-22.7	175.9	-64.8	170.8	-160.5	-128.9	16	114.3	L150 N151 T152	L150-R154 WeakPolarHBondContact O-CG 3.47Å; L150-R154 PolarHBondContact O-NE 3.35Å; N151-R154 PolarHBondContact OD1-NE 3.35Å; T152-R154 VanDerWaalsContact C-N 3.26Å; T152-R154 PolarHBondContact O-N 2.86Å
155	R	40.7	Very low	47.2	Very low	218 Å²	218	72 Å²	72	82%	0.823	38%	0.376	S	S	*	.	H	α-helix	trans	-96.9	-25.3	-169.2	-72.6	-179.7	176.5	-179.6	0.1	114.8	T152 F153	T152-R155 PolarHBondContact O-N 2.99Å; F153-R155 PolarHBondContact O-N 2.97Å
156	T	44.3	Very low	47.5	Very low	83 Å²	83	72 Å²	72	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-133	-16	-172.4	64.7	0	0	0	0	115.6	T152 N158	T152-T156 PolarHBondContact O-N 2.85Å; T156-N158 PolarHBondContact O-N 2.89Å; T156-N158 PolarHBondContact OG1-N 3.35Å; T156-N158 PolarHBondContact OG1-O 2.97Å
157	G	51.1	Low	48	Very low	18 Å²	18	72.5 Å²	72.5	19%	0.186	38%	0.384	C	S	.	.	S	Bend	trans	61.7	0.1	-170.5	0	0	0	0	0	115.1	F153 R175 T176	F153-G157 PolarHBondContact O-N 3.15Å; G157-R175 CarbonylContact O-C 3.53Å; G157-T176 WeakPolarHBondContact O-CB 3.45Å; G157-T176 PolarHBondContact O-N 2.92Å; G157-T176 VanDerWaalsContact O-N 3.07Å; G157-T176 PolarHBondContact O-OG1 2.77Å
158	N	54.2	Low	48.1	Very low	84 Å²	84	69.5 Å²	69.5	45%	0.449	37%	0.368	S	S	.	.			trans	-136.5	92.2	-174.2	-72.6	-22.1	0	0	0	107.9	T156 S174 R175 T176	T156-N158 PolarHBondContact O-N 2.89Å; T156-N158 PolarHBondContact OG1-N 3.35Å; T156-N158 PolarHBondContact OG1-O 2.97Å; N158-S174 WeakPolarHBondContact CA-O 3.45Å; N158-R175 WeakPolarHBondContact OD1-CA 3.44Å; N158-T176 PolarHBondContact OD1-N 3.48Å
159	A	54.7	Low	48.3	Very low	7 Å²	7	65.6 Å²	65.6	6%	0.058	35%	0.352	C	S	.	.			trans	-123.8	136.2	178.6	0	0	0	0	0	111.1	S174	A159-S174 PolarHBondContact N-O 3.08Å; A159-S174 PolarHBondContact N-OG 3.23Å; A159-S174 PolarHBondContact O-N 3.28Å; A159-S174 PolarHBondContact O-OG 2.97Å
160	T	53.1	Low	48.6	Very low	86 Å²	86	67.6 Å²	67.6	53%	0.528	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.9	171.7	-64.7	0	0	0	0	108.4	A172 V173	T160-A172 WeakPolarHBondContact CA-O 3.32Å; T160-V173 HydrophobicContact CG2-CG2 4.03Å
161	R	50.1	Low	49.2	Very low	63 Å²	63	71.9 Å²	71.9	24%	0.238	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.3	171.7	-174.4	172.6	177.3	-128.3	-17.9	109.2	S145 W170 A172	S145-R161 PolarHBondContact O-NH1 3.39Å; S145-R161 PolarHBondContact OG-NE 3.09Å; S145-R161 PolarHBondContact OG-NH2 3.47Å; R161-W170 HydrophobicContact CB-CZ3 4.44Å; R161-W170 HydrophobicContact CG-CH2 4.08Å; R161-W170 HydrophobicContact CG-CZ3 4.24Å; R161-A172 PolarHBondContact N-O 2.78Å; R161-A172 PolarHBondContact O-N 3.46Å
162	S	59.7	Low	49.9	Very low	77 Å²	77	68.3 Å²	68.3	54%	0.538	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.6	169.3	46	0	0	0	0	110	W170	S162-W170 CarbonylContact C-O 3.59Å; S162-W170 WeakPolarHBondContact CA-O 3.24Å; S162-W170 WeakPolarHBondContact CB-O 3.41Å
163	G	51	Low	50.6	Low	21 Å²	21	66.7 Å²	66.7	22%	0.216	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	169.5	177	0	0	0	0	0	111.5	T169 W170	G163-T169 WeakPolarHBondContact O-CA 3.44Å; G163-W170 PolarHBondContact N-O 2.98Å; G163-W170 PolarHBondContact O-N 3.08Å
164	Q	46.6	Very low	51.5	Low	120 Å²	120	64.8 Å²	64.8	56%	0.561	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	143.8	173.8	-175.8	163.3	-11.2	0	0	108.8	G166 Q168 T169	Q164-G166 PolarHBondContact NE2-O 3.38Å; Q164-Q168 CarbonylContact C-O 3.35Å; Q164-Q168 VanDerWaalsContact CA-O 3.29Å; Q164-Q168 WeakPolarHBondContact CA-O 3.41Å; Q164-Q168 WeakPolarHBondContact CG-O 3.2Å; Q164-T169 HydrophobicContact CB-CG2 3.93Å; Q164-T169 HydrophobicContact CG-CG2 3.66Å
165	S	43.3	Very low	52	Low	80 Å²	80	66.5 Å²	66.5	56%	0.559	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	106.6	177.6	-169.5	0	0	0	0	107.5	N167 Q168	S165-N167 PolarHBondContact O-N 2.82Å; S165-Q168 PolarHBondContact N-O 3.27Å; S165-Q168 PolarHBondContact O-N 3.46Å
166	G	59.3	Low	52.4	Low	36 Å²	36	58.5 Å²	58.5	37%	0.371	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	-128.5	-168.8	0	0	0	0	0	111.8	Q164 Q168	Q164-G166 PolarHBondContact NE2-O 3.38Å; G166-Q168 PolarHBondContact O-N 2.69Å
167	N	49.2	Very low	52.6	Low	43 Å²	43	57.8 Å²	57.8	23%	0.23	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-4.1	178	72.4	16.7	0	0	0	115.2	S165 N192	S165-N167 PolarHBondContact O-N 2.82Å; N167-N192 VanDerWaalsContact CB-O 3.31Å; N167-N192 WeakPolarHBondContact CB-O 3.48Å; N167-N192 VanDerWaalsContact CG-O 3.25Å; N167-N192 PolarHBondContact ND2-O 2.8Å; N167-N192 WeakPolarHBondContact O-CB 3.49Å; N167-N192 PolarHBondContact O-N 3.25Å
168	Q	44.9	Very low	52.6	Low	40 Å²	40	62.4 Å²	62.4	19%	0.187	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	130.7	-176.6	-46.4	-165.7	26.5	0	0	112.3	Q164 S165 G166 N190 I191	Q164-Q168 CarbonylContact C-O 3.35Å; Q164-Q168 VanDerWaalsContact CA-O 3.29Å; Q164-Q168 WeakPolarHBondContact CA-O 3.41Å; Q164-Q168 WeakPolarHBondContact CG-O 3.2Å; S165-Q168 PolarHBondContact N-O 3.27Å; S165-Q168 PolarHBondContact O-N 3.46Å; G166-Q168 PolarHBondContact O-N 2.69Å; Q168-N190 WeakPolarHBondContact CA-O 3.34Å; Q168-I191 HydrophobicContact CB-CG1 4.42Å; Q168-I191 HydrophobicContact CG-CD1 4.44Å; Q168-I191 HydrophobicContact CG-CG1 3.96Å; Q168-I191 HydrophobicContact CG-CG2 4.26Å
169	T	52.7	Low	52	Low	42 Å²	42	65.6 Å²	65.6	26%	0.258	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.1	168.2	53.1	0	0	0	0	110.1	G163 Q164 N190	G163-T169 WeakPolarHBondContact O-CA 3.44Å; Q164-T169 HydrophobicContact CB-CG2 3.93Å; Q164-T169 HydrophobicContact CG-CG2 3.66Å; T169-N190 PolarHBondContact N-O 3.1Å; T169-N190 PolarHBondContact O-N 3.42Å; T169-N190 WeakPolarHBondContact OG1-CB 3.44Å
170	W	53.6	Low	51.9	Low	59 Å²	59	68.4 Å²	68.4	22%	0.223	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.9	-178.3	59.6	-98	0	0	0	112.3	R161 S162 G163 A172 E188 I189	R161-W170 HydrophobicContact CB-CZ3 4.44Å; R161-W170 HydrophobicContact CG-CH2 4.08Å; R161-W170 HydrophobicContact CG-CZ3 4.24Å; S162-W170 CarbonylContact C-O 3.59Å; S162-W170 WeakPolarHBondContact CA-O 3.24Å; S162-W170 WeakPolarHBondContact CB-O 3.41Å; G163-W170 PolarHBondContact N-O 2.98Å; G163-W170 PolarHBondContact O-N 3.08Å; W170-A172 HydrophobicContact CZ3-CB 4.44Å; W170-E188 CarbonylContact C-O 3.49Å; W170-E188 VanDerWaalsContact CA-O 3.29Å; W170-E188 WeakPolarHBondContact CA-O 3.48Å; W170-I189 HydrophobicContact CB-CG1 4.1Å
171	R	58	Low	51.6	Low	111 Å²	111	66.4 Å²	66.4	42%	0.419	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	111.8	-178.5	-174.9	169.2	175.8	-79.5	-9.6	111.6	E188	R171-E188 HydrophobicContact CB-CB 4.47Å; R171-E188 PolarHBondContact N-O 3.3Å; R171-E188 PolarHBondContact O-N 3.19Å
172	A	57.3	Low	51.2	Low	4 Å²	4	66.6 Å²	66.6	3%	0.033	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136	174.5	0	0	0	0	0	111	T160 R161 W170 F185 L187	T160-A172 WeakPolarHBondContact CA-O 3.32Å; R161-A172 PolarHBondContact N-O 2.78Å; R161-A172 PolarHBondContact O-N 3.46Å; W170-A172 HydrophobicContact CZ3-CB 4.44Å; A172-F185 HydrophobicContact CB-CE2 4.25Å; A172-F185 HydrophobicContact CB-CZ 4.31Å; A172-L187 HydrophobicContact CB-CD1 4.07Å
173	V	58.4	Low	50.5	Low	28 Å²	28	64.8 Å²	64.8	17%	0.17	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.5	171.4	-178.4	0	0	0	0	109	T160 R175 S186	T160-V173 HydrophobicContact CG2-CG2 4.03Å; V173-R175 HydrophobicContact CG1-CG 4.42Å; V173-S186 PolarHBondContact N-O 3.21Å; V173-S186 PolarHBondContact O-N 2.98Å
174	S	56.1	Low	50.4	Low	2 Å²	2	69 Å²	69	1%	0.014	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	140.9	166	54.1	0	0	0	0	109.8	N158 A159	N158-S174 WeakPolarHBondContact CA-O 3.45Å; A159-S174 PolarHBondContact N-O 3.08Å; A159-S174 PolarHBondContact N-OG 3.23Å; A159-S174 PolarHBondContact O-N 3.28Å; A159-S174 PolarHBondContact O-OG 2.97Å
175	R	53.8	Low	50.4	Low	175 Å²	175	64 Å²	64	66%	0.66	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.2	133	169.5	-80.7	-173.1	160.4	-154.8	-8.4	111.5	G157 N158 V173 R184	G157-R175 CarbonylContact O-C 3.53Å; N158-R175 WeakPolarHBondContact OD1-CA 3.44Å; V173-R175 HydrophobicContact CG1-CG 4.42Å; R175-R184 PolarHBondContact N-O 3.04Å; R175-R184 PolarHBondContact O-N 2.89Å
176	T	48.3	Very low	50.6	Low	49 Å²	49	62.6 Å²	62.6	30%	0.301	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.3	172.7	-49	0	0	0	0	108.8	G157 N158 P178 F183	G157-T176 WeakPolarHBondContact O-CB 3.45Å; G157-T176 PolarHBondContact O-N 2.92Å; G157-T176 VanDerWaalsContact O-N 3.07Å; G157-T176 PolarHBondContact O-OG1 2.77Å; N158-T176 PolarHBondContact OD1-N 3.48Å; T176-P178 WeakPolarHBondContact O-CD 3.44Å; T176-F183 WeakPolarHBondContact OG1-CD2 3.4Å
177	N	49.4	Very low	50.1	Low	68 Å²	68	61.8 Å²	61.8	36%	0.364	32%	0.321	S	S	.	.			trans	-84.9	110.1	170.1	-176.8	-6.8	0	0	0	109.5	N179 S180 G181 E182	N177-N179 PolarHBondContact O-N 3.17Å; N177-N179 VanDerWaalsContact O-N 3.16Å; N177-N179 PolarHBondContact OD1-N 3.18Å; N177-N179 VanDerWaalsContact OD1-N 3.12Å; N177-S180 WeakPolarHBondContact CB-OG 3.22Å; N177-S180 PolarHBondContact ND2-OG 3.31Å; N177-S180 VanDerWaalsContact ND2-OG 3.13Å; N177-S180 PolarHBondContact O-N 2.89Å; N177-G181 PolarHBondContact O-N 2.94Å; N177-E182 HydrophobicContact CB-CB 4.35Å; N177-E182 PolarHBondContact N-O 3.28Å
178	P	50.5	Low	50.1	Low	115 Å²	115	62 Å²	62	75%	0.747	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.6	-176.3	26.9	-35.1	0	0	0	112.9	T176	T176-P178 WeakPolarHBondContact O-CD 3.44Å
179	N	41.8	Very low	50.1	Low	152 Å²	152	61.9 Å²	61.9	81%	0.813	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-9.2	-174.5	-61.1	1.4	0	0	0	113.4	N177	N177-N179 PolarHBondContact O-N 3.17Å; N177-N179 VanDerWaalsContact O-N 3.16Å; N177-N179 PolarHBondContact OD1-N 3.18Å; N177-N179 VanDerWaalsContact OD1-N 3.12Å
180	S	52.3	Low	49.9	Very low	65 Å²	65	62.2 Å²	62.2	46%	0.455	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-9	-179.6	68.6	0	0	0	0	114.9	N177 E182	N177-S180 WeakPolarHBondContact CB-OG 3.22Å; N177-S180 PolarHBondContact ND2-OG 3.31Å; N177-S180 VanDerWaalsContact ND2-OG 3.13Å; N177-S180 PolarHBondContact O-N 2.89Å; S180-E182 PolarHBondContact O-N 3.09Å; S180-E182 VanDerWaalsContact OG-CB 3.24Å; S180-E182 WeakPolarHBondContact OG-CB 3.43Å; S180-E182 PolarHBondContact OG-N 3.03Å
181	G	48.3	Very low	49.6	Very low	45 Å²	45	64.1 Å²	64.1	46%	0.464	34%	0.335	S	S	.	.			trans	66	9.9	-171.1	0	0	0	0	0	113.7	N177 F183	N177-G181 PolarHBondContact O-N 2.94Å; G181-F183 PolarHBondContact O-N 3.4Å
182	E	41.8	Very low	49	Very low	67 Å²	67	62.6 Å²	62.6	31%	0.313	34%	0.335	S	S	.	.			trans	-72.6	102.1	178.2	-170.2	-171.2	160.8	0	0	109.6	N177 S180 R184	N177-E182 HydrophobicContact CB-CB 4.35Å; N177-E182 PolarHBondContact N-O 3.28Å; S180-E182 PolarHBondContact O-N 3.09Å; S180-E182 VanDerWaalsContact OG-CB 3.24Å; S180-E182 WeakPolarHBondContact OG-CB 3.43Å; S180-E182 PolarHBondContact OG-N 3.03Å; E182-R184 HydrophobicContact CG-CG 4.04Å; E182-R184 VanDerWaalsContact OE1-CD 3.28Å; E182-R184 WeakPolarHBondContact OE1-CD 3.13Å; E182-R184 IonicContact OE1-CZ 3.42Å; E182-R184 IonicContact OE1-NE 3.78Å; E182-R184 IonicContact OE1-NH1 2.86Å; E182-R184 PolarHBondContact OE1-NH1 3.38Å
183	F	44.4	Very low	48.3	Very low	38 Å²	38	70.2 Å²	70.2	17%	0.167	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.8	168.1	-173	-99.2	0	0	0	110	F153 T176 G181 F185 I457 M458	F153-F183 AromaticContact CE2-CE2 3.65Å; F153-F183 HydrophobicContact CE2-CE2 3.65Å; F153-F183 AromaticContact CE2-CZ 3.67Å; F153-F183 HydrophobicContact CE2-CZ 3.67Å; F153-F183 AromaticContact CZ-CE2 3.82Å; F153-F183 HydrophobicContact CZ-CE2 3.82Å; F153-F183 AromaticContact CZ-CZ 3.87Å; F153-F183 HydrophobicContact CZ-CZ 3.87Å; T176-F183 WeakPolarHBondContact OG1-CD2 3.4Å; G181-F183 PolarHBondContact O-N 3.4Å; F183-F185 HydrophobicContact CE1-CB 3.82Å; F183-F185 HydrophobicContact CZ-CB 4.41Å; F183-I457 HydrophobicContact CB-CG1 4.41Å; F183-I457 HydrophobicContact CB-CG2 4.48Å; F183-I457 HydrophobicContact CD1-CG2 3.82Å; F183-M458 PolarHBondContact O-N 3.36Å
184	R	47.7	Very low	47.4	Very low	109 Å²	109	74.7 Å²	74.7	41%	0.411	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125	176.9	-57.6	-173.9	70.2	104.9	0.2	109.3	R175 E182	R175-R184 PolarHBondContact N-O 3.04Å; R175-R184 PolarHBondContact O-N 2.89Å; E182-R184 HydrophobicContact CG-CG 4.04Å; E182-R184 VanDerWaalsContact OE1-CD 3.28Å; E182-R184 WeakPolarHBondContact OE1-CD 3.13Å; E182-R184 IonicContact OE1-CZ 3.42Å; E182-R184 IonicContact OE1-NE 3.78Å; E182-R184 IonicContact OE1-NH1 2.86Å; E182-R184 PolarHBondContact OE1-NH1 3.38Å
185	F	48	Very low	46.5	Very low	17 Å²	17	79.5 Å²	79.5	8%	0.075	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.1	172.6	-179.7	-97.4	0	0	0	109.9	A172 F183 L187 M458 D460	A172-F185 HydrophobicContact CB-CE2 4.25Å; A172-F185 HydrophobicContact CB-CZ 4.31Å; F183-F185 HydrophobicContact CE1-CB 3.82Å; F183-F185 HydrophobicContact CZ-CB 4.41Å; F185-L187 HydrophobicContact CE1-CB 3.75Å; F185-L187 HydrophobicContact CZ-CB 4.09Å; F185-M458 PolarHBondContact N-O 2.93Å; F185-D460 PolarHBondContact O-N 3.42Å
186	S	46.8	Very low	45.8	Very low	50 Å²	50	76.5 Å²	76.5	35%	0.35	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.8	176.5	-60.8	0	0	0	0	109.1	V173	V173-S186 PolarHBondContact N-O 3.21Å; V173-S186 PolarHBondContact O-N 2.98Å
187	L	49.9	Very low	45	Very low	18 Å²	18	81 Å²	81	9%	0.094	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.7	173.9	175.8	62.1	0	0	0	108.1	A172 F185 I189 L461	A172-L187 HydrophobicContact CB-CD1 4.07Å; F185-L187 HydrophobicContact CE1-CB 3.75Å; F185-L187 HydrophobicContact CZ-CB 4.09Å; L187-I189 HydrophobicContact CD1-CG1 4.28Å; L187-I189 HydrophobicContact CD2-CD1 4.14Å; L187-I189 HydrophobicContact CD2-CG1 4.46Å; L187-I189 HydrophobicContact CG-CD1 4.29Å; L187-I189 HydrophobicContact CG-CG1 4.07Å; L187-L461 HydrophobicContact CB-CD1 4.02Å; L187-L461 HydrophobicContact CD2-CD1 4.43Å
188	E	48	Very low	44.4	Very low	47 Å²	47	83.8 Å²	83.8	22%	0.22	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.3	176.1	180	166.5	-137.6	0	0	107.2	W170 R171	W170-E188 CarbonylContact C-O 3.49Å; W170-E188 VanDerWaalsContact CA-O 3.29Å; W170-E188 WeakPolarHBondContact CA-O 3.48Å; R171-E188 HydrophobicContact CB-CB 4.47Å; R171-E188 PolarHBondContact N-O 3.3Å; R171-E188 PolarHBondContact O-N 3.19Å
189	I	45.7	Very low	43.4	Very low	38 Å²	38	81.4 Å²	81.4	20%	0.195	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.1	178.1	-54.2	175.7	0	0	0	107.5	W170 L187 I191	W170-I189 HydrophobicContact CB-CG1 4.1Å; L187-I189 HydrophobicContact CD1-CG1 4.28Å; L187-I189 HydrophobicContact CD2-CD1 4.14Å; L187-I189 HydrophobicContact CD2-CG1 4.46Å; L187-I189 HydrophobicContact CG-CD1 4.29Å; L187-I189 HydrophobicContact CG-CG1 4.07Å; I189-I191 HydrophobicContact CG2-CG1 4.36Å
190	N	47.1	Very low	42.9	Very low	49 Å²	49	83.6 Å²	83.6	26%	0.262	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.6	-178	-67.4	33.8	0	0	0	108	Q168 T169	Q168-N190 WeakPolarHBondContact CA-O 3.34Å; T169-N190 PolarHBondContact N-O 3.1Å; T169-N190 PolarHBondContact O-N 3.42Å; T169-N190 WeakPolarHBondContact OG1-CB 3.44Å
191	I	48.4	Very low	42.1	Very low	100 Å²	100	89.1 Å²	89.1	51%	0.513	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.5	177.3	-56	-179.3	0	0	0	107.7	Q168 I189	Q168-I191 HydrophobicContact CB-CG1 4.42Å; Q168-I191 HydrophobicContact CG-CD1 4.44Å; Q168-I191 HydrophobicContact CG-CG1 3.96Å; Q168-I191 HydrophobicContact CG-CG2 4.26Å; I189-I191 HydrophobicContact CG2-CG1 4.36Å
192	N	45.5	Very low	41.3	Very low	78 Å²	78	93.5 Å²	93.5	42%	0.417	49%	0.489	S	S	.	.			trans	-82.2	152.9	168.1	-57.1	-35.6	0	0	0	108.4	N167	N167-N192 VanDerWaalsContact CB-O 3.31Å; N167-N192 WeakPolarHBondContact CB-O 3.48Å; N167-N192 VanDerWaalsContact CG-O 3.25Å; N167-N192 PolarHBondContact ND2-O 2.8Å; N167-N192 WeakPolarHBondContact O-CB 3.49Å; N167-N192 PolarHBondContact O-N 3.25Å
193	H	41.1	Very low	40.7	Very low	165 Å²	165	99.8 Å²	99.8	76%	0.764	52%	0.518	S	S	*	.	S	Bend	trans	-107.6	-23.2	177	-155.2	-7.1	0	0	0	113.2	Q195	H193-Q195 PolarHBondContact O-N 3.45Å
194	D	39.9	Very low	40.1	Very low	121 Å²	121	103.2 Å²	103.2	65%	0.647	54%	0.542	S	S	*	.	S	Bend	trans	-96.7	29.7	-164	-40.7	-73.5	0	0	0	114.3	P468	D194-P468 WeakPolarHBondContact OD2-CG 3.23Å
195	Q	37.7	Very low	39.3	Very low	104 Å²	104	105.1 Å²	105.1	49%	0.486	57%	0.566	S	S	.	*			trans	-121.8	102	176.7	-170.8	169.6	5.7	0	0	110	H193	H193-Q195 PolarHBondContact O-N 3.45Å
196	P	39.3	Very low	38.4	Very low	111 Å²	111	110.8 Å²	110.8	72%	0.721	60%	0.597	S	S	*	*			trans	-71.4	150.6	171.3	30.2	-33.9	0	0	0	111
197	E	31.4	Very low	37.5	Very low	144 Å²	144	113.9 Å²	113.9	67%	0.673	62%	0.619	S	S	*	*			trans	-67.9	141.7	179.5	-70.7	-62.3	138.7	0	0	112	G199	E197-G199 PolarHBondContact O-N 3.38Å
198	P	35.9	Very low	36.7	Very low	126 Å²	126	119.1 Å²	119.1	82%	0.818	65%	0.651	S	S	*	*	S	Bend	trans	-88.8	87.3	-174.6	35.1	-34.8	0	0	0	113.1
199	G	30.8	Very low	35.7	Very low	65 Å²	65	124 Å²	124	67%	0.67	68%	0.679	S	S	*	*			trans	131.9	109.1	144	0	0	0	0	0	118.1	E197	E197-G199 PolarHBondContact O-N 3.38Å
200	E	31.5	Very low	34.9	Very low	199 Å²	199	126.1 Å²	126.1	93%	0.93	70%	0.702	S	S	*	*			trans	-122.1	145.9	140.6	-71	-160.1	129.7	0	0	108.9
201	H	33.9	Very low	34.7	Very low	180 Å²	180	129.7 Å²	129.7	83%	0.833	73%	0.727	S	S	*	*			trans	-100.1	121.7	-167.7	-103.1	-101.8	0	0	0	113.2
202	I	33.3	Very low	33.6	Very low	138 Å²	138	133.6 Å²	133.6	71%	0.708	74%	0.743	S	S	*	*			trans	-1.4	124.5	151.2	-51.4	169.1	0	0	0	116.5	T204	I202-T204 HydrophobicContact CG2-CG2 3.57Å
203	E	29.1	Very low	32.8	Very low	199 Å²	199	137.5 Å²	137.5	93%	0.93	76%	0.763	S	S	*	*			trans	-113.6	145.1	140.6	-74.4	-151.3	139.1	0	0	110.8
204	T	31.3	Very low	32.8	Very low	109 Å²	109	135 Å²	135	67%	0.669	76%	0.762	S	S	*	*			trans	-118.2	135.6	-174.3	52.5	0	0	0	0	112.7	I202	I202-T204 HydrophobicContact CG2-CG2 3.57Å
205	V	30.5	Very low	32.3	Very low	149 Å²	149	135.7 Å²	135.7	90%	0.903	77%	0.77	S	S	*	*			trans	-134.8	148.4	158.4	-154.6	0	0	0	0	109.6
206	N	28.8	Very low	31.7	Very low	137 Å²	137	136.6 Å²	136.6	73%	0.733	78%	0.783	S	S	*	*			trans	-102.4	173.8	-159.2	-64.7	-64.2	0	0	0	115.4
207	S	29	Very low	32.3	Very low	115 Å²	115	136.7 Å²	136.7	80%	0.804	78%	0.783	S	S	*	*			trans	86.5	141.8	149.5	-61.2	0	0	0	0	118.8
208	V	31.6	Very low	32.1	Very low	127 Å²	127	136.9 Å²	136.9	77%	0.77	79%	0.788	S	S	*	*			cis	-166	149	-22.2	73.7	0	0	0	0	108.6
209	D	27.6	Very low	31.7	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	79%	0.785	S	S	*	*				-171.3	154.5	123.5	-131.8	-29.4	0	0	0	113.3
210	A	28.8	Very low	31.6	Very low	82 Å²	82	140.2 Å²	140.2	68%	0.678	79%	0.789	S	S	*	*			trans	-164.1	141.9	171.7	0	0	0	0	0	110.9
211	P	44.2	Very low	31.4	Very low	123 Å²	123	136 Å²	136	80%	0.799	78%	0.781	S	S	*	*				-132.8	-178.2	102.2	9	14.6	0	0	0	112.3
212	E	25.1	Very low	31.1	Very low	182 Å²	182	131.7 Å²	131.7	85%	0.85	78%	0.776	S	S	*	*			cis	-146.8	174.8	21.8	-147.7	172.8	153.8	0	0	112.8
213	L	27.5	Very low	30.9	Very low	160 Å²	160	136.2 Å²	136.2	84%	0.838	79%	0.785	S	S	*	*			trans	-113.6	-163.4	-171.1	-66.1	176.1	0	0	0	109.6
214	P	42.5	Very low	30.9	Very low	114 Å²	114	133.4 Å²	133.4	74%	0.74	78%	0.781	S	S	*	*			cis	-149	-174.5	6.7	38.3	-13.1	0	0	0	120
215	V	28.7	Very low	30.7	Very low	134 Å²	134	132.8 Å²	132.8	81%	0.812	79%	0.787	S	S	*	*			trans	83.8	134.4	158.1	-135.9	0	0	0	0	121
216	T	24.3	Very low	30.6	Very low	124 Å²	124	131.3 Å²	131.3	76%	0.761	78%	0.784	S	S	*	*			trans	-117.5	-154.2	178.6	55.4	0	0	0	0	109.4
217	P	52.3	Low	31.4	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	78%	0.782	S	S	*	*				-118	-163.4	-53.5	33.5	-16	0	0	0	111.2
218	L	26.7	Very low	31.4	Very low	148 Å²	148	132.1 Å²	132.1	78%	0.775	78%	0.784	S	S	*	*				156.3	99.5	115.5	-168.2	71.3	0	0	0	116.2
219	N	28.6	Very low	31.2	Very low	140 Å²	140	131 Å²	131	75%	0.749	78%	0.782	S	S	*	*				54.1	160.1	127.6	-150.1	16.9	0	0	0	125
220	T	27.2	Very low	31.3	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	78%	0.783	S	S	*	*			trans	101.6	152	151.4	-24.6	0	0	0	0	118.9
221	S	27.4	Very low	31.3	Very low	109 Å²	109	131 Å²	131	76%	0.762	79%	0.789	S	S	*	*			trans	-124	158	-158.3	-44.2	0	0	0	0	115.8
222	A	29.5	Very low	30.6	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	79%	0.789	S	S	*	*			trans	56.4	122.8	143.3	0	0	0	0	0	122.3
223	R	27.3	Very low	31.3	Very low	234 Å²	234	132.8 Å²	132.8	88%	0.883	79%	0.789	S	S	*	*				173.1	116.7	125	-90.6	163.2	92	-152	5.6	108.2
224	T	29.9	Very low	31.4	Very low	139 Å²	139	129.1 Å²	129.1	85%	0.853	78%	0.776	S	S	*	*				68.3	90.8	70.3	-48.8	0	0	0	0	113.8
225	A	26.6	Very low	30.8	Very low	97 Å²	97	128.4 Å²	128.4	80%	0.802	78%	0.781	S	S	*	*			trans	-157.9	150.2	157.6	0	0	0	0	0	112.6
226	S	28.2	Very low	31	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	78%	0.782	S	S	*	*			trans	-148.1	175	166.9	-61	0	0	0	0	105.5
227	P	47.2	Very low	32.3	Very low	107 Å²	107	128 Å²	128	70%	0.695	78%	0.78	S	S	*	*			cis	-141.9	-166.1	11.4	39.2	-16.9	0	0	0	115.5
228	L	28.7	Very low	31.2	Very low	161 Å²	161	134 Å²	134	84%	0.843	79%	0.788	S	S	*	*			trans	71.8	145.1	164.7	-56	168	0	0	0	115.8
229	S	27.4	Very low	32	Very low	104 Å²	104	132.4 Å²	132.4	73%	0.727	79%	0.787	S	S	*	*			cis	-147.6	-178.9	28.9	-56.7	0	0	0	0	114.9
230	S	29.5	Very low	32.3	Very low	120 Å²	120	130 Å²	130	84%	0.839	79%	0.786	S	S	*	*			trans	84.9	146.3	162.6	-55	0	0	0	0	118.1
231	S	29.2	Very low	33.4	Very low	114 Å²	114	130 Å²	130	80%	0.797	79%	0.788	S	S	*	*			trans	-161.7	148.9	-147.9	53.3	0	0	0	0	118.2
232	R	29.6	Very low	33.7	Very low	210 Å²	210	135.2 Å²	135.2	79%	0.792	79%	0.793	S	S	*	*			trans	72.4	156.3	151.4	-143.3	136.8	-175.5	-105.7	-9.6	115.3	S234	R232-S234 PolarHBondContact NE-OG 3.08Å; R232-S234 VanDerWaalsContact NE-OG 3.17Å
233	P	39.3	Very low	34.4	Very low	132 Å²	132	137 Å²	137	86%	0.857	80%	0.797	S	S	*	*			cis	-108.3	-179	29	12.2	12.5	0	0	0	118
234	S	29.9	Very low	34.8	Very low	82 Å²	82	130.9 Å²	130.9	57%	0.573	79%	0.79	S	S	*	*			trans	-139.6	154.4	-166.5	-37.5	0	0	0	0	112.5	R232	R232-S234 PolarHBondContact NE-OG 3.08Å; R232-S234 VanDerWaalsContact NE-OG 3.17Å
235	A	28.8	Very low	35.5	Very low	100 Å²	100	130.3 Å²	130.3	83%	0.826	79%	0.789	S	S	*	*			trans	-164.5	140.6	153.2	0	0	0	0	0	113.8
236	T	32.4	Very low	35.8	Very low	137 Å²	137	136.9 Å²	136.9	84%	0.84	79%	0.793	S	S	*	*			trans	-163.9	-179.9	172.8	48.6	0	0	0	0	108.1
237	P	52.3	Low	36.3	Very low	112 Å²	112	137.7 Å²	137.7	73%	0.727	80%	0.795	S	S	*	*			cis	-133.5	-177.2	-47	36.7	-19.7	0	0	0	114.5
238	R	30.1	Very low	35.5	Very low	238 Å²	238	136.9 Å²	136.9	90%	0.898	80%	0.798	S	S	*	*			trans	68	178.2	164	-116.9	-173.6	165.9	-143.7	-1.8	115.9
239	P	41.8	Very low	35.6	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	79%	0.794	S	S	*	*			cis	-128.7	-148.2	-18	41.1	-21.3	0	0	0	114
240	A	35.6	Very low	35.8	Very low	89 Å²	89	142.4 Å²	142.4	74%	0.736	80%	0.801	S	S	*	*			trans	-122.7	174.5	177.2	0	0	0	0	0	110.7
241	P	49.9	Very low	35.7	Very low	121 Å²	121	145.2 Å²	145.2	79%	0.786	79%	0.793	S	S	*	*			cis	-139.6	-154.3	18.7	43.9	-21.7	0	0	0	117.3
242	Y	35.1	Very low	35.9	Very low	220 Å²	220	146.9 Å²	146.9	86%	0.863	79%	0.792	S	S	*	*			trans	-42	164.3	179.8	-77.3	-75.4	0	0	0	119.6
243	P	43.8	Very low	36.1	Very low	126 Å²	126	143.4 Å²	143.4	82%	0.818	78%	0.784	S	S	*	*			cis	-145.2	-159.1	39.2	43.3	-20.6	0	0	0	119.2
244	S	36.2	Very low	35.7	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	79%	0.787	S	S	*	*			trans	-95.7	179.2	-170.4	57.7	0	0	0	0	115.4
245	P	44.1	Very low	35.7	Very low	126 Å²	126	151.6 Å²	151.6	82%	0.818	80%	0.802	S	S	*	*			cis	-144.6	-158.5	19.9	44.7	-21.7	0	0	0	118.7
246	R	32.5	Very low	35.7	Very low	235 Å²	235	158 Å²	158	89%	0.887	81%	0.805	S	S	*	*			trans	-53.8	158.4	-176.4	-78	-175.9	178.3	-148.1	1	117.7
247	P	39.8	Very low	35.5	Very low	136 Å²	136	157.2 Å²	157.2	88%	0.883	80%	0.8	S	S	*	*				-144.7	-145.2	70.2	40.4	-18.4	0	0	0	117.7
248	A	29.9	Very low	34.3	Very low	90 Å²	90	162.7 Å²	162.7	74%	0.744	81%	0.806	S	S	*	*			trans	-155.6	-170.9	-149.8	0	0	0	0	0	115.5
249	I	30.5	Very low	34.2	Very low	150 Å²	150	155.7 Å²	155.7	77%	0.769	79%	0.794	S	S	*	*			trans	120.8	118.9	155.1	-66.9	170.2	0	0	0	118.6
250	R	31.1	Very low	33.6	Very low	230 Å²	230	155.3 Å²	155.3	87%	0.868	79%	0.794	S	S	*	*			trans	49.8	168.8	145.8	-69.8	176.1	-176.5	175.5	0.9	120.9
251	R	28.7	Very low	33.3	Very low	179 Å²	179	157.3 Å²	157.3	68%	0.675	80%	0.797	S	S	*	*			cis	-173.8	178	-25.4	174.9	173.1	172.7	173.9	2.1	107.3	E253	R251-E253 IonicContact CZ-OE2 3.39Å; R251-E253 IonicContact NE-OE2 2.78Å; R251-E253 PolarHBondContact NE-OE2 2.75Å; R251-E253 VanDerWaalsContact NE-OE2 3.08Å; R251-E253 IonicContact NH2-OE1 3.37Å; R251-E253 IonicContact NH2-OE2 3.38Å; R251-E253 PolarHBondContact NH2-OE2 3.03Å
252	I	32.6	Very low	32.2	Very low	150 Å²	150	157.8 Å²	157.8	77%	0.769	80%	0.798	S	S	*	*			trans	107.9	127.4	158.3	-57.2	160	0	0	0	113.7
253	E	33.9	Very low	31.9	Very low	137 Å²	137	151.2 Å²	151.2	64%	0.64	79%	0.789	S	S	*	*			cis	108.3	103.3	0.3	-161.8	178.6	170.6	0	0	116.9	R251	R251-E253 IonicContact CZ-OE2 3.39Å; R251-E253 IonicContact NE-OE2 2.78Å; R251-E253 PolarHBondContact NE-OE2 2.75Å; R251-E253 VanDerWaalsContact NE-OE2 3.08Å; R251-E253 IonicContact NH2-OE1 3.37Å; R251-E253 IonicContact NH2-OE2 3.38Å; R251-E253 PolarHBondContact NH2-OE2 3.03Å
254	T	31.5	Very low	31.2	Very low	147 Å²	147	153 Å²	153	90%	0.902	79%	0.791	S	S	*	*			trans	-142.8	140.6	165.5	44	0	0	0	0	115.4
255	R	29.6	Very low	30.9	Very low	238 Å²	238	152.9 Å²	152.9	90%	0.898	79%	0.79	S	S	*	*			trans	-75.6	165.6	-168.5	-60.7	163.3	158.5	-172.5	-6.9	117.2
256	R	27.6	Very low	30.2	Very low	235 Å²	235	154.1 Å²	154.1	89%	0.887	80%	0.795	S	S	*	*				-159.7	111.4	124.3	-99.9	166.9	-170.7	-163	1.7	109.6
257	T	28.8	Very low	30	Very low	120 Å²	120	147.4 Å²	147.4	74%	0.736	78%	0.784	S	S	*	*				56.3	134.1	98.2	64.1	0	0	0	0	114.3
258	R	28.1	Very low	29.4	Very low	228 Å²	228	146.6 Å²	146.6	86%	0.86	78%	0.781	S	S	*	*			cis	-177.6	160.1	39.5	-171.9	-173.7	167.7	177.7	-2.2	111.2
259	S	26.8	Very low	29.3	Very low	90 Å²	90	146.2 Å²	146.2	63%	0.629	78%	0.778	S	S	*	*			trans	63.7	145.7	161.6	-73.7	0	0	0	0	118.5
260	S	29.1	Very low	29.1	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	78%	0.782	S	S	*	*			cis	81.8	102.8	9.8	-42.3	0	0	0	0	118.5
261	T	29.3	Very low	29	Very low	131 Å²	131	142.4 Å²	142.4	80%	0.804	78%	0.781	S	S	*	*			trans	175.4	125.8	146.9	34.7	0	0	0	0	108.9
262	T	28.3	Very low	30.4	Very low	131 Å²	131	139.3 Å²	139.3	80%	0.804	78%	0.784	S	S	*	*				56.4	140.9	84.3	41.9	0	0	0	0	116
263	A	27.3	Very low	31.2	Very low	82 Å²	82	137.7 Å²	137.7	68%	0.678	78%	0.784	S	S	*	*			cis	-166	-175.5	-8.3	0	0	0	0	0	112.5
264	L	28.7	Very low	31.1	Very low	165 Å²	165	135.2 Å²	135.2	86%	0.864	79%	0.787	S	S	*	*			trans	71.7	108.1	150.8	-70.8	171	0	0	0	121
265	S	29.8	Very low	31	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	78%	0.784	S	S	*	*			trans	-33.6	149.7	143.7	-34.3	0	0	0	0	117
266	V	29.9	Very low	31.1	Very low	151 Å²	151	132.6 Å²	132.6	92%	0.915	78%	0.778	S	S	*	*			trans	-127.9	148.5	143.6	178.4	0	0	0	0	107.4
267	S	29.1	Very low	31.5	Very low	95 Å²	95	127.7 Å²	127.7	66%	0.664	77%	0.773	S	S	*	*			trans	-110.2	172.8	-160.6	-52	0	0	0	0	114.6
268	S	27.5	Very low	33.1	Very low	118 Å²	118	127.4 Å²	127.4	83%	0.825	77%	0.774	S	S	*	*			trans	84	151	145.1	-61.1	0	0	0	0	119.4
269	A	27.4	Very low	33.5	Very low	82 Å²	82	120.8 Å²	120.8	68%	0.678	77%	0.767	S	S	*	*			cis	-172.3	178	-20.7	0	0	0	0	0	111.3
270	T	25.5	Very low	33.9	Very low	140 Å²	140	121.7 Å²	121.7	86%	0.859	77%	0.769	S	S	*	*			trans	89.2	158.2	148.3	-51.7	0	0	0	0	118.5
271	L	29	Very low	34.2	Very low	160 Å²	160	122.7 Å²	122.7	84%	0.838	77%	0.766	S	S	*	*			trans	-104	-137.1	-164	-67.9	152.6	0	0	0	112.2
272	P	57.8	Low	34.5	Very low	114 Å²	114	123.7 Å²	123.7	74%	0.74	76%	0.762	S	S	*	*				-111.1	-149	-115.4	39.5	-18.7	0	0	0	110.9
273	P	51	Low	34.7	Very low	117 Å²	117	128.1 Å²	128.1	76%	0.76	76%	0.764	S	S	*	*			cis	-142.4	-162.8	-3.2	41.7	-19.4	0	0	0	116.7
274	A	31.3	Very low	34.8	Very low	85 Å²	85	135.6 Å²	135.6	70%	0.702	77%	0.774	S	S	*	*			trans	82.2	99.1	144.2	0	0	0	0	0	122.4
275	E	28.6	Very low	34.9	Very low	182 Å²	182	131.7 Å²	131.7	85%	0.85	77%	0.766	S	S	*	*				60.6	160.6	104.2	-148.1	173.1	-112.1	0	0	123.2
276	I	32.4	Very low	35.2	Very low	148 Å²	148	131.2 Å²	131.2	76%	0.759	76%	0.763	S	S	*	*			trans	99.3	139.1	161.5	-56.1	178.8	0	0	0	117.9
277	V	36.2	Very low	35.3	Very low	131 Å²	131	130.1 Å²	130.1	79%	0.794	76%	0.757	S	S	*	*			trans	-130.9	-167.3	-179.1	-127.2	0	0	0	0	106.7
278	P	62.6	Low	35.3	Very low	115 Å²	115	131.8 Å²	131.8	75%	0.747	76%	0.757	S	S	*	*			cis	-126.4	-175.1	-32.6	39.9	-25	0	0	0	111.9
279	A	35	Very low	35.4	Very low	88 Å²	88	134 Å²	134	73%	0.727	76%	0.755	S	S	*	*			trans	-177.8	147.4	143.9	0	0	0	0	0	112.3
280	T	36.6	Very low	35.5	Very low	110 Å²	110	134.8 Å²	134.8	68%	0.675	76%	0.755	S	S	*	*			cis	-165.1	136.8	-26.1	28.2	0	0	0	0	109.5
281	N	35.6	Very low	35.7	Very low	127 Å²	127	133.5 Å²	133.5	68%	0.679	75%	0.752	S	S	*	*			trans	56.5	155.2	135	-59.9	-31.1	0	0	0	122
282	Q	34.9	Very low	36	Very low	152 Å²	152	130.4 Å²	130.4	71%	0.71	75%	0.749	S	S	*	*			cis	-158.6	150.2	-17.2	-101.5	165.1	42.9	0	0	105.7
283	R	32.1	Very low	35.3	Very low	225 Å²	225	130.8 Å²	130.8	85%	0.849	75%	0.752	S	S	*	*			cis	97.4	95.9	23.7	-169.9	-159.5	-163.6	-147.9	6.3	115.1
284	R	30.7	Very low	34.5	Very low	238 Å²	238	130.6 Å²	130.6	90%	0.898	75%	0.753	S	S	*	*			trans	-177.5	139	146	-106.1	167.9	-178.8	-177.6	-0.4	108
285	A	30.8	Very low	35.5	Very low	83 Å²	83	132.4 Å²	132.4	69%	0.686	76%	0.757	S	S	*	*			cis	73.1	133.1	24	0	0	0	0	0	113.2
286	S	34.8	Very low	35.5	Very low	95 Å²	95	130.3 Å²	130.3	66%	0.664	76%	0.757	S	S	*	*			cis	-161.8	165.4	23.6	-48.1	0	0	0	0	113
287	T	31.5	Very low	35.7	Very low	128 Å²	128	127.5 Å²	127.5	79%	0.785	76%	0.756	S	S	*	*			trans	62.9	157.6	145.2	49	0	0	0	0	120
288	L	30.1	Very low	36.3	Very low	129 Å²	129	127.4 Å²	127.4	68%	0.675	76%	0.758	S	S	*	*			cis	-164.9	166.4	-0.9	-119.5	167.4	0	0	0	111.3
289	H	29.6	Very low	34.9	Very low	166 Å²	166	127.2 Å²	127.2	77%	0.769	76%	0.76	S	S	*	*			trans	63.5	169.4	164.3	-56.1	-60.5	0	0	0	119.2
290	S	30	Very low	36.3	Very low	97 Å²	97	128.3 Å²	128.3	68%	0.678	76%	0.759	S	S	*	*			cis	-172.4	158	-45.5	-172.4	0	0	0	0	111.4
291	S	29.7	Very low	37.4	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	76%	0.76	S	S	*	*			trans	83.2	152.9	154.4	-47.8	0	0	0	0	121.4
292	A	34	Very low	37.6	Very low	94 Å²	94	128 Å²	128	78%	0.777	76%	0.763	S	S	*	*			trans	-116.2	-174.1	169.5	0	0	0	0	0	109.1
293	P	44.4	Very low	37.3	Very low	123 Å²	123	126.3 Å²	126.3	80%	0.799	76%	0.759	S	S	*	*			cis	-146.9	-153.6	39.2	43.6	-20.2	0	0	0	115.8
294	S	34.8	Very low	37.4	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	75%	0.754	S	S	*	*			trans	-98.9	160.4	-172.8	-37.6	0	0	0	0	116.6
295	P	50.7	Low	37.4	Very low	122 Å²	122	117 Å²	117	79%	0.792	75%	0.748	S	S	*	*			trans	-135.7	-149.1	146.7	38.5	-22.7	0	0	0	113
296	T	29.6	Very low	37.2	Very low	138 Å²	138	117.4 Å²	117.4	85%	0.847	75%	0.751	S	S	*	*				-147.3	163.7	-103.4	-60.5	0	0	0	0	111.6
297	A	36	Very low	37.7	Very low	89 Å²	89	118.1 Å²	118.1	74%	0.736	75%	0.753	S	S	*	*			trans	-93.6	176.9	-178.7	0	0	0	0	0	115.3
298	P	48.1	Very low	37.5	Very low	130 Å²	130	116.5 Å²	116.5	84%	0.844	75%	0.747	S	S	*	*			trans	-143.9	164.9	137.9	38.2	-23.3	0	0	0	117.3
299	S	34.4	Very low	37.5	Very low	111 Å²	111	118.1 Å²	118.1	78%	0.776	75%	0.751	S	S	*	*			trans	-160.2	-173	177.9	78.9	0	0	0	0	110
300	P	64.1	Low	37.4	Very low	110 Å²	110	117.5 Å²	117.5	71%	0.714	75%	0.748	S	S	*	*			cis	-104.1	-105.4	9.7	24.7	-0.8	0	0	0	113.4
301	P	60.3	Low	37.3	Very low	108 Å²	108	120.4 Å²	120.4	70%	0.701	75%	0.751	S	S	*	*			cis	-121.2	153.8	6.4	48.2	-34.1	0	0	0	114.7
302	V	38.5	Very low	37.2	Very low	122 Å²	122	120 Å²	120	74%	0.739	74%	0.743	S	S	*	*				80.4	130.8	94.4	178.9	0	0	0	0	115
303	D	30	Very low	37	Very low	117 Å²	117	123 Å²	123	63%	0.626	75%	0.745	S	S	*	*			cis	-150.3	166.2	24.1	-140.7	-17.1	0	0	0	118
304	Q	34.6	Very low	36.2	Very low	160 Å²	160	123.1 Å²	123.1	75%	0.748	74%	0.739	S	S	*	*			trans	26.4	156.4	147.1	-85	167.9	89.5	0	0	123.9
305	S	29.1	Very low	35.9	Very low	109 Å²	109	123 Å²	123	76%	0.762	73%	0.734	S	S	*	*			cis	-162.5	170.5	-0.3	46.1	0	0	0	0	112.3
306	A	27.4	Very low	34.9	Very low	90 Å²	90	125 Å²	125	74%	0.744	73%	0.732	S	S	*	*			trans	-117.3	-169.1	172.6	0	0	0	0	0	109.7
307	P	45.2	Very low	35	Very low	111 Å²	111	122.8 Å²	122.8	72%	0.721	73%	0.728	S	S	*	*			cis	-144.3	-167.2	2.6	42.6	-21.2	0	0	0	117
308	S	27.8	Very low	34.7	Very low	93 Å²	93	125.9 Å²	125.9	65%	0.65	73%	0.727	S	S	*	*			trans	88.1	123	141	-73.7	0	0	0	0	124.8
309	Q	29.3	Very low	33.9	Very low	163 Å²	163	125.1 Å²	125.1	76%	0.762	71%	0.713	S	S	*	*				97.2	134.9	123.3	-79	178.9	8.9	0	0	125.3
310	H	28.4	Very low	33.6	Very low	153 Å²	153	128.1 Å²	128.1	71%	0.708	71%	0.707	S	S	*	*			trans	64	107.8	145.2	-74.1	-67.4	0	0	0	125.1
311	H	26.5	Very low	32.1	Very low	159 Å²	159	132.2 Å²	132.2	74%	0.736	71%	0.708	S	S	*	*				76.7	102	104.5	-147.8	-112	0	0	0	122.4
312	V	27.7	Very low	30.5	Very low	105 Å²	105	133 Å²	133	64%	0.636	71%	0.707	S	S	*	*				88.7	150.7	120.4	151.4	0	0	0	0	123.1
313	L	30.2	Very low	30	Very low	156 Å²	156	135.1 Å²	135.1	82%	0.817	71%	0.708	S	S	*	*			trans	70.9	134.8	-175.9	-54.5	-172.9	0	0	0	116.1
314	N	27.4	Very low	30.1	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	72%	0.715	S	S	*	*			cis	99.1	157	22.5	-162.8	67.6	0	0	0	114.4
315	V	29.8	Very low	30.8	Very low	112 Å²	112	134 Å²	134	68%	0.679	72%	0.718	S	S	*	*			trans	78.6	109.5	-172.3	-172.9	0	0	0	0	111.1
316	E	28.2	Very low	30.9	Very low	163 Å²	163	133.4 Å²	133.4	76%	0.762	72%	0.72	S	S	*	*				90.7	157.6	51.7	-76.8	177.9	83.9	0	0	114.3
317	A	32.6	Very low	31	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	72%	0.719	S	S	*	*			trans	74.6	143.8	164.2	0	0	0	0	0	119
318	E	28.9	Very low	30.4	Very low	153 Å²	153	135.5 Å²	135.5	72%	0.715	72%	0.724	S	S	*	*			cis	-171.7	164.3	-22.5	-114.5	-89.4	71.5	0	0	110.5
319	H	32	Very low	30.4	Very low	115 Å²	115	137.8 Å²	137.8	53%	0.532	73%	0.729	S	S	.	*			trans	56.8	107.8	148.2	-96.8	46.1	0	0	0	125.7
320	R	28	Very low	30.4	Very low	174 Å²	174	135.2 Å²	135.2	66%	0.657	73%	0.728	S	S	*	*				95.3	150.4	105	-143.6	-162.4	-93.8	-152.6	5.3	122
321	R	31.9	Very low	31.3	Very low	195 Å²	195	133.7 Å²	133.7	74%	0.736	73%	0.731	S	S	*	*			trans	89.7	115.3	162.2	-59.2	-177.6	-162.2	-109.5	5.6	115
322	N	27.1	Very low	31.3	Very low	126 Å²	126	137.1 Å²	137.1	67%	0.674	74%	0.738	S	S	*	*				73.5	137.2	76.3	-68.8	42.7	0	0	0	112
323	E	28.2	Very low	31.4	Very low	166 Å²	166	138.2 Å²	138.2	78%	0.776	74%	0.744	S	S	*	*			cis	-160.5	164.3	0.3	-115.8	162.6	134.7	0	0	112.9
324	V	31.8	Very low	31.4	Very low	128 Å²	128	135.6 Å²	135.6	78%	0.776	74%	0.739	S	S	*	*			trans	-26.4	159	153.2	167	0	0	0	0	116.3
325	P	49.7	Very low	32.6	Very low	125 Å²	125	135.4 Å²	135.4	81%	0.812	75%	0.745	S	S	*	*			cis	-133.3	-169.1	16.2	24.2	2.5	0	0	0	117.1
326	A	30.3	Very low	32.8	Very low	96 Å²	96	138.9 Å²	138.9	79%	0.793	75%	0.754	S	S	*	*			trans	-106	177.3	166.3	0	0	0	0	0	112.5
327	A	30.6	Very low	32.8	Very low	88 Å²	88	134 Å²	134	73%	0.727	75%	0.748	S	S	*	*				170.5	158.1	126.9	0	0	0	0	0	115.1
328	L	32.7	Very low	32.5	Very low	158 Å²	158	137 Å²	137	83%	0.827	75%	0.75	S	S	*	*			trans	66.5	155.9	163.9	-50.8	-175.3	0	0	0	117.8
329	D	27	Very low	32.5	Very low	140 Å²	140	135 Å²	135	75%	0.749	75%	0.754	S	S	*	*			cis	-148.8	176.1	2.8	-140.6	-39.2	0	0	0	112.9
330	C	28.7	Very low	32.5	Very low	109 Å²	109	138.3 Å²	138.3	74%	0.736	77%	0.769	S	S	*	*			trans	-109.5	160.7	178.4	-66.9	0	0	0	0	112.1
331	P	47.2	Very low	33.2	Very low	121 Å²	121	134.8 Å²	134.8	79%	0.786	77%	0.769	S	S	*	*				-165	149.6	92.4	42.1	-20	0	0	0	120.9
332	R	26.8	Very low	33.1	Very low	231 Å²	231	133.9 Å²	133.9	87%	0.872	77%	0.773	S	S	*	*				70.8	120.1	123	-165.9	177.2	178.4	135.5	5.1	125.8
333	V	29.9	Very low	33.3	Very low	128 Å²	128	132.4 Å²	132.4	78%	0.776	78%	0.778	S	S	*	*			trans	92.1	144.5	139.2	161.2	0	0	0	0	124.3
334	S	30.4	Very low	33.4	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	79%	0.786	S	S	*	*			trans	-97.4	174.5	-174.5	-24.6	0	0	0	0	115.9
335	P	53	Low	33.2	Very low	122 Å²	122	127 Å²	127	79%	0.792	78%	0.782	S	S	*	*				-141.5	-170.7	109.3	21.8	0.5	0	0	0	112.7
336	Q	33.4	Very low	32.3	Very low	186 Å²	186	129.1 Å²	129.1	87%	0.869	78%	0.781	S	S	*	*			cis	-176.8	148.3	-43	176.4	175.1	-31.5	0	0	109
337	G	28	Very low	32.2	Very low	61 Å²	61	131.9 Å²	131.9	63%	0.629	78%	0.777	S	S	*	*			trans	151.5	109.1	161.2	0	0	0	0	0	118.5
338	D	26	Very low	32.5	Very low	153 Å²	153	133.1 Å²	133.1	82%	0.818	78%	0.78	S	S	*	*				32.5	147.4	129.1	-54.8	-50.4	0	0	0	122.5
339	S	29.5	Very low	32.4	Very low	113 Å²	113	137.8 Å²	137.8	79%	0.79	79%	0.787	S	S	*	*			cis	-169.5	172.7	-6.2	52.7	0	0	0	0	112.5
340	Q	32.1	Very low	32.5	Very low	183 Å²	183	136.2 Å²	136.2	86%	0.855	79%	0.787	S	S	*	*			trans	-79.4	-178.1	176.9	-108.7	179.8	-77.2	0	0	113.4
341	P	44	Very low	32.6	Very low	100 Å²	100	136.6 Å²	136.6	65%	0.649	79%	0.791	S	S	*	*			cis	-152.8	-170.1	31.7	47	-25.6	0	0	0	119.4
342	Q	28.9	Very low	31.9	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	80%	0.799	S	S	*	*			trans	61.2	142.9	155.9	-73.5	168	-5.3	0	0	120.6
343	A	30.2	Very low	32.1	Very low	94 Å²	94	138.6 Å²	138.6	78%	0.777	80%	0.798	S	S	*	*			cis	98.8	93.8	9.2	0	0	0	0	0	118.3
344	A	31	Very low	32.3	Very low	113 Å²	113	144.5 Å²	144.5	93%	0.934	81%	0.807	S	S	*	*			trans	-171.7	166.2	153.1	0	0	0	0	0	109.6
345	G	28.6	Very low	32.4	Very low	67 Å²	67	145 Å²	145	69%	0.691	81%	0.811	S	S	*	*			trans	-160.3	167.7	173.5	0	0	0	0	0	113.2
346	H	30.1	Very low	31.6	Very low	171 Å²	171	151.5 Å²	151.5	79%	0.792	82%	0.819	S	S	*	*			trans	-162.1	136.2	166.5	-116.4	-90.6	0	0	0	113.5
347	E	28.7	Very low	31.4	Very low	154 Å²	154	146 Å²	146	72%	0.72	81%	0.812	S	S	*	*			trans	24.8	122.5	148.1	-63.4	179.3	115.4	0	0	124.1
348	S	36	Very low	31.6	Very low	113 Å²	113	155.1 Å²	155.1	79%	0.79	83%	0.828	S	S	*	*				38.9	120	116.5	-52.5	0	0	0	0	121.9
349	R	31.8	Very low	31.8	Very low	256 Å²	256	152 Å²	152	97%	0.966	82%	0.823	S	S	*	*			trans	-158.1	146.1	144	-122.3	169.8	-176.9	176.3	2.2	114.8
350	S	28.2	Very low	31.9	Very low	107 Å²	107	158.7 Å²	158.7	75%	0.748	83%	0.831	S	S	*	*			trans	-105.4	164.1	-168.9	-39.8	0	0	0	0	114.8
351	S	31.8	Very low	31.8	Very low	117 Å²	117	162 Å²	162	82%	0.818	84%	0.836	S	S	*	*			trans	68.9	123	146.6	-58	0	0	0	0	120.3
352	R	32	Very low	31.3	Very low	254 Å²	254	162.1 Å²	162.1	96%	0.958	85%	0.845	S	S	*	*			trans	-150.6	119.6	142.6	-115.3	169.1	-172.6	169.3	3.6	111.9
353	T	31.5	Very low	31.4	Very low	140 Å²	140	158.6 Å²	158.6	86%	0.859	85%	0.846	S	S	*	*			trans	-98.1	162.1	174.2	52.9	0	0	0	0	110.9
354	R	33.3	Very low	31.5	Very low	252 Å²	252	159.5 Å²	159.5	95%	0.951	85%	0.854	S	S	*	*			trans	-151.5	144.4	163.2	-133.3	176	-176.6	-171.1	0.8	111.6
355	S	31.4	Very low	31.4	Very low	113 Å²	113	158 Å²	158	79%	0.79	85%	0.849	S	S	*	*			trans	-141.8	144.4	-162.7	53.4	0	0	0	0	113.9
356	R	37.5	Very low	31.4	Very low	257 Å²	257	158.9 Å²	158.9	97%	0.97	86%	0.859	S	S	*	*			trans	-155.1	140.6	161.5	-70.7	-172.7	170.8	166.2	-5.4	108.1
357	G	28.6	Very low	31.3	Very low	70 Å²	70	154.4 Å²	154.4	72%	0.722	86%	0.858	S	S	*	*			cis	151.4	112.7	-15.1	0	0	0	0	0	114.2
358	R	32.2	Very low	31.4	Very low	254 Å²	254	153.9 Å²	153.9	96%	0.958	87%	0.865	S	S	*	*			trans	65	156.8	170.7	-78.9	-170.5	164.8	-164.6	-3.8	116.9
359	A	30.6	Very low	31	Very low	87 Å²	87	152.4 Å²	152.4	72%	0.719	86%	0.86	S	S	*	*			cis	-158.1	155	-17.6	0	0	0	0	0	110.8
360	R	31.8	Very low	30.9	Very low	254 Å²	254	146 Å²	146	96%	0.958	85%	0.854	S	S	*	*			trans	-84	157.4	167.6	-67.4	-178.5	175.9	-177.6	-1.7	111.2
361	R	29.9	Very low	30.9	Very low	252 Å²	252	152.9 Å²	152.9	95%	0.951	86%	0.864	S	S	*	*			trans	-139.4	142.1	160.9	-154.4	-174.1	-61.3	-128.6	7.4	108
362	A	32.7	Very low	30.7	Very low	102 Å²	102	152 Å²	152	84%	0.843	86%	0.864	S	S	*	*			trans	-145.1	145.1	-176.5	0	0	0	0	0	110.8
363	A	32.1	Very low	30.5	Very low	104 Å²	104	144.6 Å²	144.6	86%	0.86	85%	0.851	S	S	*	*			trans	-156.7	136.4	170	0	0	0	0	0	112.1
364	A	32.3	Very low	30.5	Very low	112 Å²	112	149.2 Å²	149.2	93%	0.926	85%	0.852	S	S	*	*			trans	-16.2	159	169.9	0	0	0	0	0	122.7
365	G	29.1	Very low	30.1	Very low	82 Å²	82	148.4 Å²	148.4	85%	0.845	85%	0.85	S	S	*	*			trans	136	107.2	153.8	0	0	0	0	0	114.6
366	G	27.8	Very low	29.8	Very low	86 Å²	86	148.2 Å²	148.2	89%	0.887	85%	0.848	S	S	*	*			trans	-106.3	158.1	175.4	0	0	0	0	0	113.3
367	G	27.2	Very low	29.7	Very low	76 Å²	76	147.8 Å²	147.8	78%	0.784	85%	0.846	S	S	*	*			trans	-172.7	88.6	-177.2	0	0	0	0	0	116.8
368	V	31	Very low	29.6	Very low	143 Å²	143	150.3 Å²	150.3	87%	0.867	85%	0.853	S	S	*	*			trans	15.9	112.2	149.5	-165.6	0	0	0	0	120.4
369	A	28.5	Very low	29.7	Very low	83 Å²	83	144.2 Å²	144.2	69%	0.686	85%	0.846	S	S	*	*			trans	50.8	136	137.7	0	0	0	0	0	124.5
370	S	29.3	Very low	29.7	Very low	120 Å²	120	147.5 Å²	147.5	84%	0.839	85%	0.851	S	S	*	*			trans	59.2	109.4	135.7	-64.1	0	0	0	0	121.3
371	R	29.2	Very low	29.5	Very low	253 Å²	253	142.9 Å²	142.9	96%	0.955	85%	0.845	S	S	*	*			trans	-145.6	129.9	144.6	-129	171.8	-179.9	179.3	-0.9	112
372	A	26.5	Very low	29.3	Very low	99 Å²	99	142.4 Å²	142.4	82%	0.818	84%	0.843	S	S	*	*			trans	-93.8	156.9	174.6	0	0	0	0	0	111.3
373	S	28.7	Very low	28.9	Very low	97 Å²	97	143.1 Å²	143.1	68%	0.678	84%	0.838	S	S	*	*			trans	-168.1	114.5	145.7	-164	0	0	0	0	115.1
374	R	30.3	Very low	29.8	Very low	237 Å²	237	144 Å²	144	89%	0.894	84%	0.835	S	S	*	*			trans	64.4	124.1	137.5	-63	171.5	-161.2	-86.7	-5.9	122.3
375	R	25.7	Very low	29.4	Very low	236 Å²	236	144.1 Å²	144.1	89%	0.891	83%	0.828	S	S	*	*			trans	-72.1	-174.9	151.8	-63.1	171.6	160.7	-170.7	-6	111.8
376	S	25.8	Very low	29.3	Very low	108 Å²	108	147 Å²	147	76%	0.755	83%	0.829	S	S	*	*			trans	83.2	124	165.4	-12.9	0	0	0	0	113.4
377	R	33.7	Very low	29.4	Very low	248 Å²	248	147.7 Å²	147.7	94%	0.936	82%	0.821	S	S	*	*				64.8	117.8	56.9	-70.4	-168.2	174.1	-165.5	-0.8	112.8
378	S	26.7	Very low	29.4	Very low	123 Å²	123	150.6 Å²	150.6	86%	0.86	82%	0.823	S	S	*	*			trans	-130.6	160.5	170.7	-73.3	0	0	0	0	110
379	P	35.4	Very low	29.4	Very low	127 Å²	127	151.1 Å²	151.1	83%	0.825	82%	0.82	S	S	*	*			trans	-124.3	-177.3	-140.5	42.8	-31.3	0	0	0	116.4
380	L	30.3	Very low	30.6	Very low	155 Å²	155	152.1 Å²	152.1	81%	0.812	82%	0.82	S	S	*	*			trans	-66.9	147.8	167.4	-63.9	164.9	0	0	0	112.4
381	N	27.8	Very low	32.1	Very low	157 Å²	157	151.6 Å²	151.6	84%	0.84	81%	0.814	S	S	*	*				175.7	137.9	124.7	-95.5	-23.2	0	0	0	113.6
382	R	24.3	Very low	32.1	Very low	242 Å²	242	145.8 Å²	145.8	91%	0.913	81%	0.807	S	S	*	*			trans	-156.4	144.7	145.8	-151.2	173.6	-173.7	-179.9	2.4	111.2
383	T	25.1	Very low	32.2	Very low	118 Å²	118	144.1 Å²	144.1	72%	0.724	80%	0.799	S	S	*	*			trans	-154.8	-175.4	-172.3	49.8	0	0	0	0	108.3
384	P	50.2	Low	32.4	Very low	122 Å²	122	145.5 Å²	145.5	79%	0.792	81%	0.809	S	S	*	*			cis	-131.7	177.7	-45.7	33.8	-17.1	0	0	0	114.2
385	S	24.1	Very low	32.4	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	81%	0.806	S	S	*	*			trans	-163.6	160.4	163.6	62.5	0	0	0	0	109.2
386	V	28.7	Very low	33.7	Very low	142 Å²	142	134.4 Å²	134.4	86%	0.861	80%	0.801	S	S	*	*			cis	-151.5	169.7	-14.4	108.1	0	0	0	0	110
387	S	28.8	Very low	34.1	Very low	101 Å²	101	137.2 Å²	137.2	71%	0.706	81%	0.807	S	S	*	*			trans	-76.4	150.9	-174.5	-43.2	0	0	0	0	116.7
388	T	26.5	Very low	33.8	Very low	137 Å²	137	129 Å²	129	84%	0.84	80%	0.8	S	S	*	*				169.1	161.6	102.3	-58.7	0	0	0	0	112.2
389	L	31.9	Very low	34.1	Very low	154 Å²	154	129.1 Å²	129.1	81%	0.806	80%	0.801	S	S	*	*			trans	-139.9	-173	-172.1	-99.3	163.5	0	0	0	108.7
390	P	53.2	Low	33.9	Very low	105 Å²	105	129.9 Å²	129.9	68%	0.682	80%	0.795	S	S	*	*			cis	-129.2	-155	-8.6	42.8	-24.2	0	0	0	111.8
391	P	60.4	Low	33.9	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	79%	0.789	S	S	*	*			cis	-110.9	-142.4	-19.9	21.2	5	0	0	0	109.7
392	T	29.4	Very low	34.1	Very low	131 Å²	131	128.1 Å²	128.1	80%	0.804	78%	0.781	S	S	*	*			cis	-160.7	156.1	2.8	-28	0	0	0	0	106.6
393	G	29.6	Very low	34.2	Very low	64 Å²	64	123 Å²	123	66%	0.66	78%	0.777	S	S	*	*			cis	167.5	-168.2	-6.3	0	0	0	0	0	111
394	S	31.9	Very low	34.3	Very low	126 Å²	126	121.1 Å²	121.1	88%	0.881	78%	0.78	S	S	*	*			trans	52.5	103.5	165.4	-58	0	0	0	0	121.6
395	S	31.1	Very low	33.2	Very low	118 Å²	118	123.9 Å²	123.9	83%	0.825	78%	0.782	S	S	*	*			trans	-86.6	177.9	152.4	-66.7	0	0	0	0	110
396	P	53	Low	34.4	Very low	122 Å²	122	123.3 Å²	123.3	79%	0.792	78%	0.776	S	S	*	*			cis	-153	-162.4	32.6	46	-22.2	0	0	0	118.9
397	N	33.7	Very low	34.4	Very low	166 Å²	166	122 Å²	122	89%	0.888	77%	0.773	S	S	*	*			trans	-56.5	157.1	-176.8	-51	-17.7	0	0	0	117.6
398	G	27.9	Very low	34.4	Very low	77 Å²	77	120.3 Å²	120.3	79%	0.794	77%	0.772	S	S	*	*			trans	-169.5	162.9	162.9	0	0	0	0	0	111.6
399	S	33.8	Very low	34.4	Very low	125 Å²	125	120.3 Å²	120.3	87%	0.874	77%	0.771	S	S	*	*			trans	-155	161.1	-173.4	-168.8	0	0	0	0	115.6
400	M	31.3	Very low	34.3	Very low	142 Å²	142	118.8 Å²	118.8	70%	0.7	77%	0.769	S	S	*	*			trans	86.1	135.1	152.2	-169.4	168.8	169.2	0	0	120.3
401	I	29.4	Very low	33	Very low	135 Å²	135	119.6 Å²	119.6	69%	0.692	77%	0.772	S	S	*	*				173.7	116.7	123.4	-84.9	-72.6	0	0	0	111.8
402	Q	31.8	Very low	31.3	Very low	141 Å²	141	118.8 Å²	118.8	66%	0.659	77%	0.769	S	S	*	*				17.7	153.3	127.2	-96.8	167.2	-21.7	0	0	121.9
403	T	26.2	Very low	31.1	Very low	135 Å²	135	117.2 Å²	117.2	83%	0.828	76%	0.759	S	S	*	*			cis	-166.3	168.2	-1.5	-18.1	0	0	0	0	110.5
404	G	26.9	Very low	31	Very low	77 Å²	77	116.7 Å²	116.7	79%	0.794	75%	0.745	S	S	*	*			trans	130.5	141.1	144.1	0	0	0	0	0	119.4
405	E	28.1	Very low	31	Very low	180 Å²	180	114 Å²	114	84%	0.841	72%	0.719	S	S	*	*			trans	-130.8	-176.6	170.3	-123.8	-148.2	129.9	0	0	107.6
406	P	49.8	Very low	31.1	Very low	102 Å²	102	113.5 Å²	113.5	66%	0.662	70%	0.704	S	S	*	*			cis	-139.4	-178.6	8.3	42.3	-22.9	0	0	0	117.4
407	S	28.5	Very low	30.4	Very low	115 Å²	115	114.2 Å²	114.2	80%	0.804	71%	0.707	S	S	*	*			trans	49.5	132.4	144.1	-64.9	0	0	0	0	124.8
408	G	27.6	Very low	30.5	Very low	66 Å²	66	110.1 Å²	110.1	68%	0.68	70%	0.703	S	S	*	*				139.3	97.5	116.7	0	0	0	0	0	123
409	V	27.9	Very low	30.9	Very low	136 Å²	136	109.9 Å²	109.9	82%	0.824	70%	0.701	S	S	*	*			trans	64.1	148.9	139.2	-135.8	0	0	0	0	122.4
410	T	28.7	Very low	30.7	Very low	122 Å²	122	112.1 Å²	112.1	75%	0.748	70%	0.701	S	S	*	*			trans	73.9	157.3	165.5	69.1	0	0	0	0	117.6
411	T	26.7	Very low	30.7	Very low	123 Å²	123	111.7 Å²	111.7	76%	0.755	71%	0.706	S	S	*	*			cis	-172.8	169.9	-18.3	27.3	0	0	0	0	107.8
412	S	25.1	Very low	30.5	Very low	92 Å²	92	110 Å²	110	64%	0.643	71%	0.707	S	S	*	*			cis	176.6	165.1	-37.9	57.9	0	0	0	0	109.6
413	V	24.6	Very low	30.2	Very low	97 Å²	97	111.5 Å²	111.5	59%	0.588	71%	0.714	S	S	*	*			trans	72.6	144	161.9	169.1	0	0	0	0	116.9	E433	V413-E433 HydrophobicContact CG1-CB 4.16Å
414	S	26.7	Very low	30.9	Very low	54 Å²	54	109.9 Å²	109.9	38%	0.378	71%	0.705	S	S	.	*			cis	-155.5	-100	-24.7	-90.9	0	0	0	0	114.2	E433 V435	S414-E433 WeakPolarHBondContact CA-OE2 3.4Å; S414-E433 VanDerWaalsContact CB-CB 3.41Å; S414-E433 WeakPolarHBondContact CB-OE2 3.24Å; S414-E433 PolarHBondContact N-OE2 2.73Å; S414-V435 VanDerWaalsContact OG-CG2 3.28Å; S414-V435 WeakPolarHBondContact OG-CG2 3.5Å
415	M	32.3	Very low	30.6	Very low	68 Å²	68	112.9 Å²	112.9	34%	0.335	70%	0.703	S	S	.	*			trans	-168.3	165.3	-178.4	-48.4	164.8	131	0	0	108.2	E433 T434 V435 E436	M415-E433 PolarHBondContact N-OE2 2.75Å; M415-E433 WeakPolarHBondContact O-CB 3.35Å; M415-E433 VanDerWaalsContact O-CG 3.26Å; M415-E433 WeakPolarHBondContact O-CG 3.46Å; M415-E433 VanDerWaalsContact O-OE2 3.09Å; M415-T434 HydrophobicContact CB-CG2 4.12Å; M415-T434 PolarHBondContact O-OG1 3.22Å; M415-T434 HydrophobicContact SD-CG2 3.97Å; M415-V435 HydrophobicContact CB-CG2 4.47Å; M415-V435 HydrophobicContact CG-CG1 4.25Å; M415-V435 HydrophobicContact CG-CG2 3.93Å; M415-V435 HydrophobicContact SD-CB 4.29Å; M415-V435 HydrophobicContact SD-CG1 3.96Å; M415-V435 HydrophobicContact SD-CG2 4.19Å; M415-E436 HydrophobicContact CE-CB 4.44Å; M415-E436 WeakPolarHBondContact CE-O 3.48Å; M415-E436 HydrophobicContact SD-CB 3.97Å
416	E	33.1	Very low	30.6	Very low	109 Å²	109	108 Å²	108	51%	0.509	69%	0.694	S	S	.	*			cis	-159.3	167.7	22.5	60.9	-173.5	113.9	0	0	114.9	T434 R437	E416-T434 WeakPolarHBondContact OE1-CG2 3.4Å; E416-R437 IonicContact OE1-CZ 3.79Å; E416-R437 IonicContact OE1-NH1 2.86Å; E416-R437 IonicContact OE1-NH2 2.8Å; E416-R437 PolarHBondContact OE1-NH2 2.88Å; E416-R437 IonicContact OE2-CZ 4Å; E416-R437 IonicContact OE2-NH1 2.95Å; E416-R437 PolarHBondContact OE2-NH1 3.21Å; E416-R437 IonicContact OE2-NH2 3.39Å
417	T	38	Very low	30	Very low	137 Å²	137	109.5 Å²	109.5	84%	0.84	70%	0.701	S	S	*	*			trans	8.7	116.9	154.6	-38.7	0	0	0	0	121.1
418	G	36.1	Very low	30.6	Very low	79 Å²	79	110.9 Å²	110.9	81%	0.814	70%	0.698	S	S	*	*			trans	-174.8	132.5	161.1	0	0	0	0	0	111.5
419	G	37.3	Very low	31	Very low	73 Å²	73	115.9 Å²	115.9	75%	0.753	70%	0.704	S	S	*	*			trans	-125	-171.5	-164.8	0	0	0	0	0	117
420	I	29.7	Very low	31.1	Very low	172 Å²	172	115 Å²	115	88%	0.882	70%	0.704	S	S	*	*			trans	84.6	117.6	175.4	-51.5	176.1	0	0	0	116.2
421	V	29.6	Very low	31.2	Very low	132 Å²	132	113.3 Å²	113.3	80%	0.8	70%	0.703	S	S	*	*			trans	-122.1	138.4	154.6	170.3	0	0	0	0	103.2
422	S	25.9	Very low	31.4	Very low	101 Å²	101	113.7 Å²	113.7	71%	0.706	70%	0.704	S	S	*	*			cis	-129.4	129	36.8	-46.3	0	0	0	0	115.6
423	E	26.3	Very low	31.6	Very low	171 Å²	171	114 Å²	114	80%	0.799	70%	0.696	S	S	*	*			trans	50.5	149.8	136.3	-73.7	-102.2	88.7	0	0	121.5
424	P	39.3	Very low	32	Very low	101 Å²	101	112.6 Å²	112.6	66%	0.656	69%	0.687	S	S	*	*			cis	-126.4	179.2	12.3	42	-27.8	0	0	0	116.4
425	D	21.3	Very low	32.2	Very low	140 Å²	140	113.9 Å²	113.9	75%	0.749	69%	0.693	S	S	*	*			trans	69.2	95	153.1	-78.6	-50.4	0	0	0	121.2
426	A	28.5	Very low	32.2	Very low	78 Å²	78	116 Å²	116	65%	0.645	70%	0.702	S	S	*	*				68.9	120.9	109.9	0	0	0	0	0	123.2
427	V	37	Very low	32.2	Very low	134 Å²	134	117.4 Å²	117.4	81%	0.812	70%	0.703	S	S	*	*			trans	75.7	110.7	145.5	179.4	0	0	0	0	116.9
428	L	41.5	Very low	32	Very low	143 Å²	143	115.2 Å²	115.2	75%	0.749	70%	0.698	S	S	*	*				-174.9	141	60.8	-167.9	65.7	0	0	0	114.7
429	E	35.5	Very low	31.7	Very low	172 Å²	172	117 Å²	117	80%	0.804	70%	0.698	S	S	*	*			trans	35.3	128	155.1	-61.2	-173.2	123.4	0	0	127.4
430	S	31	Very low	31.4	Very low	117 Å²	117	122.9 Å²	122.9	82%	0.818	71%	0.706	S	S	*	*				127.6	98.7	117.6	-146.6	0	0	0	0	122.4
431	A	29.7	Very low	31.3	Very low	87 Å²	87	120.1 Å²	120.1	72%	0.719	70%	0.702	S	S	*	*				75.6	114.4	127.7	0	0	0	0	0	127.3
432	V	30.6	Very low	32.1	Very low	131 Å²	131	119.6 Å²	119.6	79%	0.794	70%	0.701	S	S	*	*			trans	76.1	161.1	145.7	-118.9	0	0	0	0	124.1
433	E	29.8	Very low	32.1	Very low	98 Å²	98	119.3 Å²	119.3	46%	0.458	71%	0.705	S	S	.	*			trans	-154.8	164.8	-150	-56.2	164	-116.8	0	0	113.2	V413 S414 M415	V413-E433 HydrophobicContact CG1-CB 4.16Å; S414-E433 WeakPolarHBondContact CA-OE2 3.4Å; S414-E433 VanDerWaalsContact CB-CB 3.41Å; S414-E433 WeakPolarHBondContact CB-OE2 3.24Å; S414-E433 PolarHBondContact N-OE2 2.73Å; M415-E433 PolarHBondContact N-OE2 2.75Å; M415-E433 WeakPolarHBondContact O-CB 3.35Å; M415-E433 VanDerWaalsContact O-CG 3.26Å; M415-E433 WeakPolarHBondContact O-CG 3.46Å; M415-E433 VanDerWaalsContact O-OE2 3.09Å
434	T	32.2	Very low	32.1	Very low	67 Å²	67	116.4 Å²	116.4	41%	0.411	71%	0.71	S	S	.	*			cis	-144.8	-100	-31.5	-66.4	0	0	0	0	109.7	M415 E416	M415-T434 HydrophobicContact CB-CG2 4.12Å; M415-T434 PolarHBondContact O-OG1 3.22Å; M415-T434 HydrophobicContact SD-CG2 3.97Å; E416-T434 WeakPolarHBondContact OE1-CG2 3.4Å
435	V	31.5	Very low	31.4	Very low	82 Å²	82	115.1 Å²	115.1	50%	0.497	72%	0.715	S	S	.	*			cis	-165	123.8	-12.2	174.7	0	0	0	0	105.7	S414 M415	S414-V435 VanDerWaalsContact OG-CG2 3.28Å; S414-V435 WeakPolarHBondContact OG-CG2 3.5Å; M415-V435 HydrophobicContact CB-CG2 4.47Å; M415-V435 HydrophobicContact CG-CG1 4.25Å; M415-V435 HydrophobicContact CG-CG2 3.93Å; M415-V435 HydrophobicContact SD-CB 4.29Å; M415-V435 HydrophobicContact SD-CG1 3.96Å; M415-V435 HydrophobicContact SD-CG2 4.19Å
436	E	33	Very low	31.6	Very low	112 Å²	112	114 Å²	114	52%	0.523	73%	0.726	S	S	.	*			cis	86.3	134	4.7	-65.2	-80.7	-101.7	0	0	116.9	M415	M415-E436 HydrophobicContact CE-CB 4.44Å; M415-E436 WeakPolarHBondContact CE-O 3.48Å; M415-E436 HydrophobicContact SD-CB 3.97Å
437	R	33.5	Very low	31.4	Very low	139 Å²	139	114 Å²	114	53%	0.525	73%	0.733	S	S	.	*			cis	-147	149.4	-4.1	-73.5	126.6	-168.7	152.6	18.7	106.9	E416	E416-R437 IonicContact OE1-CZ 3.79Å; E416-R437 IonicContact OE1-NH1 2.86Å; E416-R437 IonicContact OE1-NH2 2.8Å; E416-R437 PolarHBondContact OE1-NH2 2.88Å; E416-R437 IonicContact OE2-CZ 4Å; E416-R437 IonicContact OE2-NH1 2.95Å; E416-R437 PolarHBondContact OE2-NH1 3.21Å; E416-R437 IonicContact OE2-NH2 3.39Å
438	A	33.1	Very low	31	Very low	91 Å²	91	113.9 Å²	113.9	75%	0.752	74%	0.738	S	S	*	*			cis	87.2	149.2	45.2	0	0	0	0	0	117.4
439	S	30.4	Very low	30.5	Very low	115 Å²	115	112.2 Å²	112.2	80%	0.804	74%	0.739	S	S	*	*			trans	86	105.1	154.6	-51.3	0	0	0	0	125
440	E	30.3	Very low	30.4	Very low	198 Å²	198	108.4 Å²	108.4	93%	0.925	74%	0.736	S	S	*	*			trans	48.7	172.7	131.4	-58.1	-166.3	114.4	0	0	125.8
441	S	27.8	Very low	30.6	Very low	113 Å²	113	108.5 Å²	108.5	79%	0.79	73%	0.732	S	S	*	*			trans	-106	-177.3	-152.2	-47	0	0	0	0	114.3
442	P	46.6	Very low	30.8	Very low	121 Å²	121	115 Å²	115	79%	0.786	74%	0.738	S	S	*	*			cis	-143.1	-179.8	3.1	43.5	-24.5	0	0	0	119
443	A	24.8	Very low	30.9	Very low	95 Å²	95	120 Å²	120	79%	0.785	74%	0.742	S	S	*	*			trans	96.7	124.3	146.8	0	0	0	0	0	122.6
444	A	26.6	Very low	30.9	Very low	111 Å²	111	120.8 Å²	120.8	92%	0.917	75%	0.746	S	S	*	*			trans	57.2	132	161.3	0	0	0	0	0	120.4
445	G	24	Very low	30.9	Very low	73 Å²	73	121.3 Å²	121.3	75%	0.753	75%	0.75	S	S	*	*			cis	175.5	168	-6.1	0	0	0	0	0	114.4
446	A	26.2	Very low	31	Very low	118 Å²	118	120.6 Å²	120.6	98%	0.975	75%	0.746	S	S	*	*			trans	68.2	123.3	174.9	0	0	0	0	0	119
447	G	24.3	Very low	31.1	Very low	78 Å²	78	117.5 Å²	117.5	80%	0.804	73%	0.733	S	S	*	*			trans	166.6	67	172.1	0	0	0	0	0	118.9
448	S	29	Very low	31.1	Very low	130 Å²	130	112.5 Å²	112.5	91%	0.909	72%	0.716	S	S	*	*			trans	66	128.7	165.6	-157.1	0	0	0	0	119.3
449	S	31.2	Very low	31.1	Very low	109 Å²	109	110 Å²	110	76%	0.762	69%	0.69	S	S	*	*			trans	-100.1	112.3	-177.5	-178.8	0	0	0	0	112.8
450	A	32.9	Very low	31.4	Very low	91 Å²	91	106.8 Å²	106.8	75%	0.752	66%	0.663	S	S	*	*			trans	-84.9	108.6	172.5	0	0	0	0	0	111.2	R452	A450-R452 PolarHBondContact O-N 3.24Å
451	V	34.4	Very low	31.6	Very low	120 Å²	120	100.2 Å²	100.2	73%	0.727	63%	0.634	S	S	*	*			trans	-68.9	94.3	-175.3	-177.6	0	0	0	0	111.9	R453	V451-R453 PolarHBondContact O-N 2.83Å
452	R	35.1	Very low	32.1	Very low	223 Å²	223	97.2 Å²	97.2	84%	0.842	61%	0.608	S	S	*	*			trans	-68	96.9	170.9	-74.1	-164.7	175.9	-146.3	0.8	111.1	A450 H454	A450-R452 PolarHBondContact O-N 3.24Å; R452-H454 PolarHBondContact O-CE1 3.14Å; R452-H454 PolarHBondContact O-N 3.27Å; R452-H454 PolarHBondContact O-ND1 3Å
453	R	31.5	Very low	31.5	Very low	235 Å²	235	95 Å²	95	89%	0.887	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-66.3	125.6	167.8	-66.6	-177.1	175.5	-169.1	-4.3	109.1	V451	V451-R453 PolarHBondContact O-N 2.83Å
454	H	29.7	Very low	32	Very low	116 Å²	116	93.5 Å²	93.5	54%	0.537	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-84.4	148.2	-177.2	-65.2	39.5	0	0	0	110.4	R452 T456	R452-H454 PolarHBondContact O-CE1 3.14Å; R452-H454 PolarHBondContact O-N 3.27Å; R452-H454 PolarHBondContact O-ND1 3Å; H454-T456 PolarHBondContact O-N 3.36Å; H454-T456 PolarHBondContact O-OG1 2.93Å
455	P	33.1	Very low	32.3	Very low	77 Å²	77	98.6 Å²	98.6	50%	0.5	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-59.3	137.4	173.1	26.6	-33.7	0	0	0	109.4	L524	P455-L524 HydrophobicContact CG-CD1 4.26Å; P455-L524 WeakPolarHBondContact O-CD1 3.09Å
456	T	33.3	Very low	32.8	Very low	67 Å²	67	98.9 Å²	98.9	41%	0.411	54%	0.544	S	S	.	.			trans	-119.3	121.5	-178.9	-51.1	0	0	0	0	108.5	H454	H454-T456 PolarHBondContact O-N 3.36Å; H454-T456 PolarHBondContact O-OG1 2.93Å
457	I	34.6	Very low	32.9	Very low	47 Å²	47	103.1 Å²	103.1	24%	0.241	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.5	179.2	-61.3	179.4	0	0	0	109.2	F183 L459 L524	F183-I457 HydrophobicContact CB-CG1 4.41Å; F183-I457 HydrophobicContact CB-CG2 4.48Å; F183-I457 HydrophobicContact CD1-CG2 3.82Å; I457-L459 HydrophobicContact CG2-CD1 3.81Å; I457-L459 HydrophobicContact CG2-CG 4.47Å; I457-L524 HydrophobicContact CD1-CD2 4.3Å; I457-L524 HydrophobicContact CG1-CD2 4.38Å
458	M	33.5	Very low	33.2	Very low	35 Å²	35	103.9 Å²	103.9	17%	0.172	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	104.5	-179.1	-70.7	-70.6	-62.7	0	0	109.6	F183 F185 T519 R521	F183-M458 PolarHBondContact O-N 3.36Å; F185-M458 PolarHBondContact N-O 2.93Å; M458-T519 HydrophobicContact CE-CG2 3.75Å; M458-R521 HydrophobicContact CE-CG 4.23Å; M458-R521 HydrophobicContact SD-CG 3.8Å
459	L	33.1	Very low	33.7	Very low	39 Å²	39	101.8 Å²	101.8	20%	0.204	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.6	169.9	-64	94.8	0	0	0	108.5	I457 T519 I520 I522	I457-L459 HydrophobicContact CG2-CD1 3.81Å; I457-L459 HydrophobicContact CG2-CG 4.47Å; L459-T519 CarbonylContact O-C 3.53Å; L459-I520 HydrophobicContact CB-CB 4.33Å; L459-I520 PolarHBondContact N-O 2.9Å; L459-I520 VanDerWaalsContact N-O 3.15Å; L459-I520 PolarHBondContact O-N 2.88Å; L459-I520 VanDerWaalsContact O-O 3.1Å; L459-I522 HydrophobicContact CD1-CD1 3.8Å; L459-I522 HydrophobicContact CD1-CG1 4.11Å
460	D	36.8	Very low	34.2	Very low	46 Å²	46	104 Å²	104	25%	0.246	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	95.5	179.4	-153.8	17.8	0	0	0	108.9	F185 T519	F185-D460 PolarHBondContact O-N 3.42Å; D460-T519 WeakPolarHBondContact OD1-CA 3.13Å; D460-T519 VanDerWaalsContact OD1-CB 3.32Å; D460-T519 WeakPolarHBondContact OD1-CB 3.42Å; D460-T519 PolarHBondContact OD1-OG1 2.86Å
461	L	35.5	Very low	34.2	Very low	60 Å²	60	106.4 Å²	106.4	31%	0.314	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112.7	-174.8	-163	72.7	0	0	0	109.2	L187 V463 S518	L187-L461 HydrophobicContact CB-CD1 4.02Å; L187-L461 HydrophobicContact CD2-CD1 4.43Å; L461-V463 HydrophobicContact CG-CG2 4.43Å; L461-S518 PolarHBondContact N-O 2.84Å; L461-S518 VanDerWaalsContact N-O 3.17Å; L461-S518 PolarHBondContact O-N 3.46Å
462	Q	38.8	Very low	34.4	Very low	51 Å²	51	110.8 Å²	110.8	24%	0.238	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	103.2	-176.8	179.3	161	98.8	0	0	110.3	R464 V517	Q462-R464 HydrophobicContact CG-CG 4.22Å; Q462-R464 VanDerWaalsContact OE1-NE 3.17Å; Q462-V517 HydrophobicContact CG-CG2 4.33Å; Q462-V517 VanDerWaalsContact NE2-CG2 3.32Å
463	V	33.5	Very low	34.8	Very low	73 Å²	73	108.1 Å²	108.1	44%	0.442	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	130.1	-179.9	-176.9	0	0	0	0	109.1	L461 Y516	L461-V463 HydrophobicContact CG-CG2 4.43Å; V463-Y516 PolarHBondContact N-O 3.2Å; V463-Y516 PolarHBondContact O-N 3.43Å; V463-Y516 VanDerWaalsContact O-N 3.14Å
464	R	35.9	Very low	35.1	Very low	64 Å²	64	107 Å²	107	24%	0.242	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	116.5	-175.6	-61.8	-176.3	175.2	-148.4	0.8	110.5	Q462 I466 T515	Q462-R464 HydrophobicContact CG-CG 4.22Å; Q462-R464 VanDerWaalsContact OE1-NE 3.17Å; R464-I466 HydrophobicContact CB-CG1 4.32Å; R464-T515 HydrophobicContact CG-CG2 4.34Å
465	R	32	Very low	35.5	Very low	219 Å²	219	106.8 Å²	106.8	83%	0.826	53%	0.528	S	S	*	.			trans	-89.5	126.1	155.7	-72.1	-167.9	179.7	-146	5.9	108
466	I	33.7	Very low	35.9	Very low	78 Å²	78	107 Å²	107	40%	0.4	53%	0.532	S	S	.	.			trans	-119.5	138.4	177.4	-57.9	176.9	0	0	0	106.5	R464	R464-I466 HydrophobicContact CB-CG1 4.32Å
467	R	28.3	Very low	36.1	Very low	207 Å²	207	106.9 Å²	106.9	78%	0.781	53%	0.528	S	S	*	.			trans	-85	143.5	173.8	-71.7	-176.1	173.7	-175.1	-4.3	109.9
468	P	30.4	Very low	36.2	Very low	95 Å²	95	108.6 Å²	108.6	62%	0.617	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	141.8	175.9	-24.5	34.5	0	0	0	112.3	D194	D194-P468 WeakPolarHBondContact OD2-CG 3.23Å
469	G	40.7	Very low	36.4	Very low	85 Å²	85	109.9 Å²	109.9	88%	0.876	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.8	-24.5	165.5	0	0	0	0	0	118.2
470	E	41.1	Very low	36.6	Very low	155 Å²	155	115.5 Å²	115.5	72%	0.724	58%	0.58	S	S	*	*			trans	-107.1	41.4	-173.9	-151	-178.6	169.8	0	0	114.7
471	N	33.7	Very low	36.6	Very low	143 Å²	143	118.8 Å²	118.8	77%	0.765	60%	0.601	S	S	*	*			trans	-95.5	117.6	169.5	-85	-15	0	0	0	111.4
472	R	38	Very low	36.6	Very low	211 Å²	211	127.2 Å²	127.2	80%	0.796	63%	0.629	S	S	*	*			trans	-120.7	135.4	156.4	-69.6	-170.7	66.5	143.2	5.1	108.7	R474 D475	R472-R474 PolarHBondContact O-N 2.86Å; R472-D475 PolarHBondContact O-N 3.23Å
473	D	43.2	Very low	36.1	Very low	167 Å²	167	129.4 Å²	129.4	89%	0.893	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	12.8	-165.7	-47.7	-77.9	0	0	0	116.5
474	R	37.6	Very low	36.2	Very low	211 Å²	211	136.2 Å²	136.2	80%	0.796	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-19.9	179.1	-77.2	-173.4	55.8	176.2	-6.7	114.6	R472 S479	R472-R474 PolarHBondContact O-N 2.86Å; R474-S479 PolarHBondContact O-OG 3.06Å
475	D	39.1	Very low	36	Very low	113 Å²	113	137.9 Å²	137.9	60%	0.604	70%	0.695	S	S	*	*			trans	-98.5	20.9	-172.2	-83.5	-58.4	0	0	0	115	R472 I477	R472-D475 PolarHBondContact O-N 3.23Å; D475-I477 PolarHBondContact O-N 2.9Å
476	S	41.1	Very low	36	Very low	82 Å²	82	138.5 Å²	138.5	57%	0.573	70%	0.697	S	S	*	*			trans	-54.2	133.6	166.2	179.5	0	0	0	0	111.2	A478 S479	S476-A478 PolarHBondContact O-N 3.11Å; S476-S479 PolarHBondContact O-N 3.39Å; S476-S479 PolarHBondContact O-OG 2.72Å
477	I	37.8	Very low	36	Very low	64 Å²	64	140.9 Å²	140.9	33%	0.328	72%	0.715	S	S	.	*	H	α-helix	trans	-54.1	-32.5	-170.2	-53.8	163.1	0	0	0	112	D475 S479 R480 T481	D475-I477 PolarHBondContact O-N 2.9Å; I477-S479 PolarHBondContact O-N 3.34Å; I477-S479 VanDerWaalsContact O-N 3.12Å; I477-R480 PolarHBondContact O-N 3.36Å; I477-T481 PolarHBondContact O-N 2.85Å; I477-T481 PolarHBondContact O-OG1 3.24Å
478	A	37	Very low	36.1	Very low	82 Å²	82	134.7 Å²	134.7	68%	0.678	71%	0.708	S	S	*	*	H	α-helix	trans	-53.3	-29.6	176.5	0	0	0	0	0	114	S476	S476-A478 PolarHBondContact O-N 3.11Å
479	S	37.6	Very low	36.3	Very low	62 Å²	62	138.6 Å²	138.6	43%	0.434	72%	0.718	S	S	.	*	H	α-helix	trans	-77.6	-40.8	176.5	75.2	0	0	0	0	112.4	R474 S476 I477 R482	R474-S479 PolarHBondContact O-OG 3.06Å; S476-S479 PolarHBondContact O-N 3.39Å; S476-S479 PolarHBondContact O-OG 2.72Å; I477-S479 PolarHBondContact O-N 3.34Å; I477-S479 VanDerWaalsContact O-N 3.12Å; S479-R482 PolarHBondContact O-N 3.14Å
480	R	36.2	Very low	35.8	Very low	158 Å²	158	142.1 Å²	142.1	60%	0.596	72%	0.717	S	S	*	*	H	α-helix	trans	-70.8	-32.7	-177	-70.9	177	68.3	159.1	-3	112.8	I477 R482 S483	I477-R480 PolarHBondContact O-N 3.36Å; R480-R482 PolarHBondContact O-N 2.87Å; R480-R482 VanDerWaalsContact O-N 3.14Å; R480-S483 PolarHBondContact O-N 3.44Å; R480-S483 PolarHBondContact O-OG 3.49Å
481	T	37.6	Very low	35.3	Very low	114 Å²	114	140.1 Å²	140.1	70%	0.699	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-18.4	178.3	-50.1	0	0	0	0	113.1	I477	I477-T481 PolarHBondContact O-N 2.85Å; I477-T481 PolarHBondContact O-OG1 3.24Å
482	R	36.2	Very low	35	Very low	238 Å²	238	138.9 Å²	138.9	90%	0.898	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-6.7	179.3	-144	179.7	-162.3	-92.2	3.2	115.1	S479 R480	S479-R482 PolarHBondContact O-N 3.14Å; R480-R482 PolarHBondContact O-N 2.87Å; R480-R482 VanDerWaalsContact O-N 3.14Å
483	S	28.5	Very low	34.5	Very low	96 Å²	96	134.6 Å²	134.6	67%	0.671	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-12.6	-171.6	74.2	0	0	0	0	116.9	R480	R480-S483 PolarHBondContact O-N 3.44Å; R480-S483 PolarHBondContact O-OG 3.49Å
484	R	35.2	Very low	33.7	Very low	216 Å²	216	133.9 Å²	133.9	82%	0.815	70%	0.7	S	S	*	*			trans	-103	47.4	177.2	-81.7	-167.5	169.6	-171.1	-3.1	114.5	R486	R484-R486 PolarHBondContact O-N 3.14Å; R484-R486 VanDerWaalsContact O-N 3.14Å
485	A	31	Very low	33.3	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	70%	0.703	S	S	*	*			trans	-82.7	47	164.5	0	0	0	0	0	112.3
486	R	31.4	Very low	32.8	Very low	231 Å²	231	129.9 Å²	129.9	87%	0.872	69%	0.693	S	S	*	*	S	Bend	trans	-140.9	136.2	165.4	-76.4	-166.5	173.1	165.6	-0.3	109	R484 A488	R484-R486 PolarHBondContact O-N 3.14Å; R484-R486 VanDerWaalsContact O-N 3.14Å; R486-A488 PolarHBondContact O-N 3.18Å
487	V	34.6	Very low	32.2	Very low	128 Å²	128	134.4 Å²	134.4	78%	0.776	71%	0.711	S	S	*	*			trans	-57.7	128.5	-174.3	177.3	0	0	0	0	110.3	E489	V487-E489 HydrophobicContact CG1-CG 4.48Å; V487-E489 PolarHBondContact O-N 3.22Å
488	A	30.3	Very low	32	Very low	77 Å²	77	136 Å²	136	64%	0.636	73%	0.728	S	S	*	*			trans	-86	98.5	167.4	0	0	0	0	0	108.3	R486 N490	R486-A488 PolarHBondContact O-N 3.18Å; A488-N490 VanDerWaalsContact C-N 3.31Å; A488-N490 PolarHBondContact O-N 2.87Å
489	E	34.7	Very low	32.1	Very low	177 Å²	177	135.4 Å²	135.4	83%	0.827	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	84.7	175.8	-65.7	168.3	-175.6	0	0	110.5	V487	V487-E489 HydrophobicContact CG1-CG 4.48Å; V487-E489 PolarHBondContact O-N 3.22Å
490	N	31	Very low	31.7	Very low	160 Å²	160	135.1 Å²	135.1	86%	0.856	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.5	-4.9	165.1	-107.2	-12.9	0	0	0	115.7	A488 V492	A488-N490 VanDerWaalsContact C-N 3.31Å; A488-N490 PolarHBondContact O-N 2.87Å; N490-V492 PolarHBondContact O-N 2.99Å
491	T	30.4	Very low	31.4	Very low	112 Å²	112	135.4 Å²	135.4	69%	0.687	74%	0.742	S	S	*	*			trans	-77.3	100.8	169.2	42.8	0	0	0	0	110.7	T493	T491-T493 PolarHBondContact O-N 3.1Å
492	V	26.8	Very low	31.2	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.715	74%	0.735	S	S	*	*			trans	-72.9	95.9	169.1	-177.2	0	0	0	0	109.1	N490 F494	N490-V492 PolarHBondContact O-N 2.99Å; V492-F494 HydrophobicContact CG1-CD2 3.67Å; V492-F494 HydrophobicContact CG1-CE2 3.7Å; V492-F494 PolarHBondContact O-N 3.46Å; V492-F494 VanDerWaalsContact O-N 3.12Å
493	T	28	Very low	31.1	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	73%	0.732	S	S	*	*			trans	-79.4	85.9	174.3	49.1	0	0	0	0	110.4	T491 E495	T491-T493 PolarHBondContact O-N 3.1Å; T493-E495 PolarHBondContact O-N 2.79Å
494	F	26.2	Very low	31.2	Very low	151 Å²	151	136.4 Å²	136.4	66%	0.662	73%	0.73	S	S	*	*			trans	-72	102	158.1	-87.8	-77.6	0	0	0	109	V492 R502	V492-F494 HydrophobicContact CG1-CD2 3.67Å; V492-F494 HydrophobicContact CG1-CE2 3.7Å; V492-F494 PolarHBondContact O-N 3.46Å; V492-F494 VanDerWaalsContact O-N 3.12Å; F494-R502 PolarHBondContact O-NH1 3.43Å
495	E	28.5	Very low	30.9	Very low	184 Å²	184	132.9 Å²	132.9	86%	0.86	73%	0.725	S	S	*	*			trans	-63	137.9	161	-66.2	-173.8	132.2	0	0	109	T493	T493-E495 PolarHBondContact O-N 2.79Å
496	S	29.3	Very low	31	Very low	56 Å²	56	133 Å²	133	39%	0.392	72%	0.72	S	S	.	*			trans	-160	116.9	-179.3	-44.5	0	0	0	0	105.5	S498 R502	S496-S498 PolarHBondContact O-N 3.4Å; S496-R502 PolarHBondContact OG-NH2 3.26Å
497	D	28.3	Very low	31	Very low	178 Å²	178	132 Å²	132	95%	0.952	72%	0.717	S	S	*	*	S	Bend	trans	-72.8	4.2	-165.5	-62.4	-63.4	0	0	0	115.1
498	S	33.1	Very low	31.1	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	71%	0.711	S	S	*	*	S	Bend	trans	-89.8	96.7	167.1	45.5	0	0	0	0	111.2	S496 G500	S496-S498 PolarHBondContact O-N 3.4Å; S498-G500 PolarHBondContact O-N 3.15Å
499	G	40.1	Very low	31.1	Very low	69 Å²	69	134 Å²	134	71%	0.711	72%	0.715	S	S	*	*			trans	-64.4	111.8	178.7	0	0	0	0	0	113
500	G	28.4	Very low	31.1	Very low	56 Å²	56	136.7 Å²	136.7	58%	0.577	72%	0.717	S	S	*	*			trans	-140.2	163.3	177.9	0	0	0	0	0	113.2	S498 R502	S498-G500 PolarHBondContact O-N 3.15Å; G500-R502 PolarHBondContact O-N 2.81Å
501	F	29.8	Very low	31.2	Very low	164 Å²	164	132.2 Å²	132.2	72%	0.719	70%	0.702	S	S	*	*			trans	-56.3	127.4	175.1	-91.7	-108.4	0	0	0	110.8	I520	F501-I520 HydrophobicContact CE1-CD1 4.28Å; F501-I520 HydrophobicContact CE1-CG1 3.96Å; F501-I520 HydrophobicContact CE1-CG2 4.13Å; F501-I520 HydrophobicContact CE2-CG2 4.42Å; F501-I520 HydrophobicContact CZ-CD1 4.49Å; F501-I520 HydrophobicContact CZ-CG1 4.36Å; F501-I520 HydrophobicContact CZ-CG2 3.73Å
502	R	34.6	Very low	31.3	Very low	149 Å²	149	130.1 Å²	130.1	56%	0.562	70%	0.703	S	S	*	*			trans	-127.8	113	175.9	-72.8	-168.7	175	-153.2	7.2	111.2	F494 S496 G500 T504	F494-R502 PolarHBondContact O-NH1 3.43Å; S496-R502 PolarHBondContact OG-NH2 3.26Å; G500-R502 PolarHBondContact O-N 2.81Å; R502-T504 PolarHBondContact O-N 3.01Å
503	R	32.4	Very low	31.7	Very low	218 Å²	218	128.7 Å²	128.7	82%	0.823	69%	0.691	S	S	*	*			trans	-76.9	113	175.1	-60.9	174.3	178.9	173.3	-2.5	109.5
504	T	31.5	Very low	31.9	Very low	102 Å²	102	131.9 Å²	131.9	63%	0.626	69%	0.689	S	S	*	*			trans	-96.8	86.7	173.9	50.2	0	0	0	0	111.1	R502 S506	R502-T504 PolarHBondContact O-N 3.01Å; T504-S506 PolarHBondContact O-N 3.17Å; T504-S506 VanDerWaalsContact O-N 3.08Å
505	I	29.2	Very low	32.3	Very low	142 Å²	142	128.1 Å²	128.1	73%	0.728	68%	0.678	S	S	*	*			trans	-76.2	95.6	-178.9	-53.7	176	0	0	0	110.2	R507	I505-R507 HydrophobicContact CG2-CG 4.28Å; I505-R507 PolarHBondContact O-N 3.41Å; I505-R507 VanDerWaalsContact O-N 3.07Å
506	S	32.9	Very low	32.5	Very low	103 Å²	103	125.5 Å²	125.5	72%	0.72	66%	0.662	S	S	*	*			trans	-78.2	82.2	170.6	175.8	0	0	0	0	110.8	T504 S508	T504-S506 PolarHBondContact O-N 3.17Å; T504-S506 VanDerWaalsContact O-N 3.08Å; S506-S508 PolarHBondContact O-N 3.36Å
507	R	31.7	Very low	32.7	Very low	210 Å²	210	125.4 Å²	125.4	79%	0.792	66%	0.658	S	S	*	*			trans	-63.1	102	167.1	-82.5	-163.8	179.2	-145.1	7.6	110	I505 E509	I505-R507 HydrophobicContact CG2-CG 4.28Å; I505-R507 PolarHBondContact O-N 3.41Å; I505-R507 VanDerWaalsContact O-N 3.07Å; R507-E509 IonicContact NH1-OE1 2.69Å
508	S	35.3	Very low	32.9	Very low	95 Å²	95	120 Å²	120	66%	0.664	64%	0.635	S	S	*	*			trans	-121	90.9	166.5	60.4	0	0	0	0	110.2	S506 R510	S506-S508 PolarHBondContact O-N 3.36Å; S508-R510 PolarHBondContact O-N 3.18Å
509	E	31.6	Very low	32.9	Very low	151 Å²	151	117.7 Å²	117.7	71%	0.706	62%	0.617	S	S	*	*			trans	-72.3	89	178.9	-70.9	165.1	170	0	0	111.5	R507	R507-E509 IonicContact NH1-OE1 2.69Å
510	R	33.5	Very low	32.6	Very low	234 Å²	234	116.5 Å²	116.5	88%	0.883	59%	0.593	S	S	*	*	S	Bend	trans	-166.4	143.8	154	-120.2	154	-84.9	-144.9	-6.5	110.8	S508	S508-R510 PolarHBondContact O-N 3.18Å
511	A	34.6	Very low	32.8	Very low	65 Å²	65	122.1 Å²	122.1	54%	0.537	60%	0.597	S	S	.	*	S	Bend	trans	61.8	41	177.9	0	0	0	0	0	116.9	I513	A511-I513 WeakPolarHBondContact O-CG1 3.17Å; A511-I513 PolarHBondContact O-N 3.19Å
512	G	32.5	Very low	32.9	Very low	69 Å²	69	117.8 Å²	117.8	71%	0.711	58%	0.581	S	S	*	*	S	Bend	trans	65.6	-13.7	153.8	0	0	0	0	0	120.4	R514	G512-R514 PolarHBondContact O-N 3.12Å
513	I	33.3	Very low	32.6	Very low	88 Å²	88	114.1 Å²	114.1	45%	0.451	58%	0.576	S	S	.	*			trans	-88.8	108.6	-170.5	-62.8	155.6	0	0	0	111	A511 T515	A511-I513 WeakPolarHBondContact O-CG1 3.17Å; A511-I513 PolarHBondContact O-N 3.19Å; I513-T515 PolarHBondContact O-N 3.09Å
514	R	32.7	Very low	32.6	Very low	187 Å²	187	105.8 Å²	105.8	71%	0.706	55%	0.548	S	S	*	.			trans	-76.8	99.2	167.3	-71.6	-172.5	176.6	-178.6	0.8	109.5	G512 Y516	G512-R514 PolarHBondContact O-N 3.12Å; R514-Y516 HydrophobicContact CB-CD2 4.44Å; R514-Y516 HydrophobicContact CB-CE2 3.72Å
515	T	34.5	Very low	32.7	Very low	72 Å²	72	111 Å²	111	44%	0.442	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.5	116.5	176.5	-45.2	0	0	0	0	109.9	R464 I513 V517	R464-T515 HydrophobicContact CG-CG2 4.34Å; I513-T515 PolarHBondContact O-N 3.09Å; T515-V517 HydrophobicContact CG2-CG2 4.14Å
516	Y	33.8	Very low	32.8	Very low	130 Å²	130	114.8 Å²	114.8	51%	0.51	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.2	117.2	176.9	-65.2	-94.8	0	0	0	109.7	V463 R514	V463-Y516 PolarHBondContact N-O 3.2Å; V463-Y516 PolarHBondContact O-N 3.43Å; V463-Y516 VanDerWaalsContact O-N 3.14Å; R514-Y516 HydrophobicContact CB-CD2 4.44Å; R514-Y516 HydrophobicContact CB-CE2 3.72Å
517	V	33.8	Very low	32.9	Very low	53 Å²	53	112.1 Å²	112.1	32%	0.321	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	107.2	176.9	-171.3	0	0	0	0	108.5	Q462 T515	Q462-V517 HydrophobicContact CG-CG2 4.33Å; Q462-V517 VanDerWaalsContact NE2-CG2 3.32Å; T515-V517 HydrophobicContact CG2-CG2 4.14Å
518	S	32.4	Very low	33.1	Very low	66 Å²	66	106.5 Å²	106.5	46%	0.462	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	83.6	-179	-72.2	0	0	0	0	109.1	L461 I520	L461-S518 PolarHBondContact N-O 2.84Å; L461-S518 VanDerWaalsContact N-O 3.17Å; L461-S518 PolarHBondContact O-N 3.46Å; S518-I520 PolarHBondContact O-N 2.67Å; S518-I520 VanDerWaalsContact O-N 3.08Å
519	T	33.2	Very low	33.3	Very low	49 Å²	49	110.3 Å²	110.3	30%	0.301	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	97	172.9	-46.1	0	0	0	0	109.8	M458 L459 D460 R521	M458-T519 HydrophobicContact CE-CG2 3.75Å; L459-T519 CarbonylContact O-C 3.53Å; D460-T519 WeakPolarHBondContact OD1-CA 3.13Å; D460-T519 VanDerWaalsContact OD1-CB 3.32Å; D460-T519 WeakPolarHBondContact OD1-CB 3.42Å; D460-T519 PolarHBondContact OD1-OG1 2.86Å; T519-R521 PolarHBondContact O-N 3.33Å
520	I	33.5	Very low	33.7	Very low	43 Å²	43	107.8 Å²	107.8	22%	0.221	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	112	178.7	-56.6	179	0	0	0	108.8	L459 F501 S518 I522	L459-I520 HydrophobicContact CB-CB 4.33Å; L459-I520 PolarHBondContact N-O 2.9Å; L459-I520 VanDerWaalsContact N-O 3.15Å; L459-I520 PolarHBondContact O-N 2.88Å; L459-I520 VanDerWaalsContact O-O 3.1Å; F501-I520 HydrophobicContact CE1-CD1 4.28Å; F501-I520 HydrophobicContact CE1-CG1 3.96Å; F501-I520 HydrophobicContact CE1-CG2 4.13Å; F501-I520 HydrophobicContact CE2-CG2 4.42Å; F501-I520 HydrophobicContact CZ-CD1 4.49Å; F501-I520 HydrophobicContact CZ-CG1 4.36Å; F501-I520 HydrophobicContact CZ-CG2 3.73Å; S518-I520 PolarHBondContact O-N 2.67Å; S518-I520 VanDerWaalsContact O-N 3.08Å; I520-I522 HydrophobicContact CG2-CD1 4.31Å; I520-I522 HydrophobicContact CG2-CG1 3.87Å
521	R	32.5	Very low	33.9	Very low	174 Å²	174	99.5 Å²	99.5	66%	0.657	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	120	172.2	-57	-170.8	-179.5	179.7	-2.3	108.8	M458 T519 P523	M458-R521 HydrophobicContact CE-CG 4.23Å; M458-R521 HydrophobicContact SD-CG 3.8Å; T519-R521 PolarHBondContact O-N 3.33Å; R521-P523 WeakPolarHBondContact O-CD 3.37Å
522	I	32.4	Very low	34.2	Very low	73 Å²	73	99.1 Å²	99.1	37%	0.374	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	106	177.6	-53.4	-176.4	0	0	0	108.7	L459 I520 I527	L459-I522 HydrophobicContact CD1-CD1 3.8Å; L459-I522 HydrophobicContact CD1-CG1 4.11Å; I520-I522 HydrophobicContact CG2-CD1 4.31Å; I520-I522 HydrophobicContact CG2-CG1 3.87Å; I522-I527 HydrophobicContact CG2-CD1 4.47Å
523	P	27.7	Very low	34.5	Very low	72 Å²	72	99.4 Å²	99.4	47%	0.468	51%	0.513	S	S	.	.			trans	-70.4	129.1	172	-14.6	29.9	0	0	0	110.1	R521 R525	R521-P523 WeakPolarHBondContact O-CD 3.37Å; P523-R525 PolarHBondContact O-N 3.44Å
524	L	31.8	Very low	34.9	Very low	44 Å²	44	101.1 Å²	101.1	23%	0.23	52%	0.519	C	S	.	.	S	Bend	trans	-69.2	14	-174.3	-58.5	-175.1	0	0	0	115.7	P455 I457 R526 I527	P455-L524 HydrophobicContact CG-CD1 4.26Å; P455-L524 WeakPolarHBondContact O-CD1 3.09Å; I457-L524 HydrophobicContact CD1-CD2 4.3Å; I457-L524 HydrophobicContact CG1-CD2 4.38Å; L524-R526 PolarHBondContact O-N 3.2Å; L524-R526 VanDerWaalsContact O-N 3.1Å; L524-I527 HydrophobicContact CD2-CD1 3.78Å; L524-I527 HydrophobicContact CD2-CG2 4.43Å; L524-I527 PolarHBondContact O-N 3.25Å
525	R	34	Very low	35.4	Very low	212 Å²	212	97.4 Å²	97.4	80%	0.8	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	19.5	-174.2	-68.9	-165.2	174.7	-158.3	0.1	115.5	P523	P523-R525 PolarHBondContact O-N 3.44Å
526	R	31.8	Very low	35.6	Very low	220 Å²	220	98.1 Å²	98.1	83%	0.83	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.7	34.5	164.8	-154.8	-160.5	-62.2	-134.7	2.2	111.5	L524	L524-R526 PolarHBondContact O-N 3.2Å; L524-R526 VanDerWaalsContact O-N 3.1Å
527	I	34.1	Very low	36.1	Very low	47 Å²	47	92.7 Å²	92.7	24%	0.241	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	-21.3	-171.7	-68.5	-178.4	0	0	0	110.5	I522 L524 L532	I522-I527 HydrophobicContact CG2-CD1 4.47Å; L524-I527 HydrophobicContact CD2-CD1 3.78Å; L524-I527 HydrophobicContact CD2-CG2 4.43Å; L524-I527 PolarHBondContact O-N 3.25Å; I527-L532 HydrophobicContact CG2-CB 3.49Å; I527-L532 VanDerWaalsContact CG2-CB 3.49Å; I527-L532 HydrophobicContact CG2-CD1 4.19Å; I527-L532 HydrophobicContact CG2-CG 4.47Å; I527-L532 WeakPolarHBondContact O-CB 3.31Å; I527-L532 PolarHBondContact O-N 2.98Å
528	S	37.3	Very low	36.6	Very low	92 Å²	92	95.6 Å²	95.6	64%	0.643	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-31.1	178.6	46.8	0	0	0	0	115.2	T530	S528-T530 VanDerWaalsContact C-N 3.31Å; S528-T530 PolarHBondContact O-N 3.49Å
529	E	37.8	Very low	37	Very low	176 Å²	176	94.3 Å²	94.3	82%	0.822	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.7	-175.4	-69.5	172	145	0	0	113.6
530	T	39.8	Very low	37.5	Very low	97 Å²	97	95.7 Å²	95.7	60%	0.595	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	22.4	-178.8	48	0	0	0	0	113.1	S528 L532	S528-T530 VanDerWaalsContact C-N 3.31Å; S528-T530 PolarHBondContact O-N 3.49Å; T530-L532 PolarHBondContact O-N 3.26Å; T530-L532 VanDerWaalsContact O-N 3.14Å; T530-L532 VanDerWaalsContact OG1-CD1 3.24Å; T530-L532 WeakPolarHBondContact OG1-CD1 3.5Å; T530-L532 WeakPolarHBondContact OG1-CG 3.29Å
531	G	38.4	Very low	38.2	Very low	60 Å²	60	95.9 Å²	95.9	62%	0.619	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	6	175.7	0	0	0	0	0	115.4	G533	G531-G533 PolarHBondContact O-N 3.22Å
532	L	40	Very low	38.7	Very low	57 Å²	57	90.8 Å²	90.8	30%	0.298	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	19.3	-173.3	-52.3	172.8	0	0	0	113.9	I527 T530 E534 S537 A539	I527-L532 HydrophobicContact CG2-CB 3.49Å; I527-L532 VanDerWaalsContact CG2-CB 3.49Å; I527-L532 HydrophobicContact CG2-CD1 4.19Å; I527-L532 HydrophobicContact CG2-CG 4.47Å; I527-L532 WeakPolarHBondContact O-CB 3.31Å; I527-L532 PolarHBondContact O-N 2.98Å; T530-L532 PolarHBondContact O-N 3.26Å; T530-L532 VanDerWaalsContact O-N 3.14Å; T530-L532 VanDerWaalsContact OG1-CD1 3.24Å; T530-L532 WeakPolarHBondContact OG1-CD1 3.5Å; T530-L532 WeakPolarHBondContact OG1-CG 3.29Å; L532-E534 VanDerWaalsContact C-N 3.28Å; L532-S537 WeakPolarHBondContact CD2-OG 3.48Å; L532-A539 HydrophobicContact CD2-CB 3.88Å
533	G	39.1	Very low	39.4	Very low	76 Å²	76	89.7 Å²	89.7	78%	0.784	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.6	170.4	0	0	0	0	0	113.4	G531	G531-G533 PolarHBondContact O-N 3.22Å
534	E	42	Very low	40.3	Very low	123 Å²	123	87.4 Å²	87.4	58%	0.575	49%	0.485	S	S	*	.	S	Bend	trans	-85.1	143.3	178.4	-66.2	-161.3	170.3	0	0	113.7	L532 N536 S537	L532-E534 VanDerWaalsContact C-N 3.28Å; E534-N536 HydrophobicContact CB-CB 4.37Å; E534-N536 PolarHBondContact O-N 3.36Å; E534-S537 PolarHBondContact O-N 2.58Å
535	P	43.1	Very low	41.1	Very low	109 Å²	109	91.4 Å²	91.4	71%	0.708	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-0.2	169.3	30.8	-36.3	0	0	0	113.5
536	N	38.8	Very low	41.6	Very low	87 Å²	87	85.2 Å²	85.2	47%	0.465	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.5	177.8	-89.1	-39.1	0	0	0	115.7	E534 T538 R541	E534-N536 HydrophobicContact CB-CB 4.37Å; E534-N536 PolarHBondContact O-N 3.36Å; N536-T538 PolarHBondContact O-N 3.14Å; N536-R541 PolarHBondContact O-NH1 3.41Å; N536-R541 PolarHBondContact OD1-NH2 2.97Å
537	S	44.9	Very low	42.3	Very low	16 Å²	16	77.4 Å²	77.4	11%	0.112	45%	0.451	C	S	.	.			trans	-46.8	120.6	-175.3	175.6	0	0	0	0	114.7	L532 E534 A539 L540 R541	L532-S537 WeakPolarHBondContact CD2-OG 3.48Å; E534-S537 PolarHBondContact O-N 2.58Å; S537-A539 PolarHBondContact OG-N 3.17Å; S537-L540 PolarHBondContact OG-N 3.12Å; S537-R541 WeakPolarHBondContact O-CD 3.27Å; S537-R541 VanDerWaalsContact O-CG 3.27Å; S537-R541 WeakPolarHBondContact O-CG 3.28Å; S537-R541 PolarHBondContact O-N 3.02Å
538	T	43.5	Very low	42.6	Very low	114 Å²	114	77.9 Å²	77.9	70%	0.699	45%	0.453	S	S	*	.	H	α-helix	trans	-66.4	-36.5	168.3	41.6	0	0	0	0	112.1	N536 R541 S542	N536-T538 PolarHBondContact O-N 3.14Å; T538-R541 WeakPolarHBondContact O-CB 3.48Å; T538-R541 PolarHBondContact O-N 3.24Å; T538-S542 PolarHBondContact O-N 3.33Å
539	A	40.3	Very low	42.8	Very low	40 Å²	40	77.1 Å²	77.1	33%	0.331	45%	0.445	S	S	.	.	H	α-helix	trans	-61.1	-47.4	175.8	0	0	0	0	0	111.7	L532 S537 R541 S542 I543	L532-A539 HydrophobicContact CD2-CB 3.88Å; S537-A539 PolarHBondContact OG-N 3.17Å; A539-R541 VanDerWaalsContact C-N 3.29Å; A539-R541 PolarHBondContact O-N 2.72Å; A539-S542 WeakPolarHBondContact O-CB 3.47Å; A539-S542 PolarHBondContact O-N 3.22Å; A539-S542 VanDerWaalsContact O-N 3.11Å; A539-I543 WeakPolarHBondContact O-CD1 3.35Å; A539-I543 VanDerWaalsContact O-CG1 3.22Å; A539-I543 WeakPolarHBondContact O-CG1 3.49Å; A539-I543 PolarHBondContact O-N 3.44Å
540	L	45.2	Very low	42.9	Very low	77 Å²	77	70.2 Å²	70.2	40%	0.403	42%	0.421	S	S	.	.	H	α-helix	trans	-60.2	-39.6	176.5	-171.5	70.8	0	0	0	111.9	S537 I543 L544	S537-L540 PolarHBondContact OG-N 3.12Å; L540-I543 PolarHBondContact O-N 3.26Å; L540-L544 HydrophobicContact CG-CD1 4.35Å; L540-L544 WeakPolarHBondContact O-CG 3.44Å; L540-L544 PolarHBondContact O-N 2.84Å
541	R	48.1	Very low	42.9	Very low	48 Å²	48	70.8 Å²	70.8	18%	0.181	42%	0.415	C	S	.	.	H	α-helix	trans	-65.8	-35.8	175.4	-68.2	164.9	-179.3	164.4	2.9	112.4	L150 N536 S537 T538 A539 R545	L150-R541 HydrophobicContact CD2-CG 4.45Å; N536-R541 PolarHBondContact O-NH1 3.41Å; N536-R541 PolarHBondContact OD1-NH2 2.97Å; S537-R541 WeakPolarHBondContact O-CD 3.27Å; S537-R541 VanDerWaalsContact O-CG 3.27Å; S537-R541 WeakPolarHBondContact O-CG 3.28Å; S537-R541 PolarHBondContact O-N 3.02Å; T538-R541 WeakPolarHBondContact O-CB 3.48Å; T538-R541 PolarHBondContact O-N 3.24Å; A539-R541 VanDerWaalsContact C-N 3.29Å; A539-R541 PolarHBondContact O-N 2.72Å; R541-R545 WeakPolarHBondContact O-CB 3.47Å; R541-R545 PolarHBondContact O-N 3.15Å; R541-R545 VanDerWaalsContact O-N 3.12Å
542	S	43.4	Very low	42.9	Very low	66 Å²	66	70.9 Å²	70.9	46%	0.462	42%	0.417	S	S	.	.	H	α-helix	trans	-68.8	-46.3	175.1	-162.3	0	0	0	0	111.5	T538 A539 L544 R545 Q546	T538-S542 PolarHBondContact O-N 3.33Å; A539-S542 WeakPolarHBondContact O-CB 3.47Å; A539-S542 PolarHBondContact O-N 3.22Å; A539-S542 VanDerWaalsContact O-N 3.11Å; S542-L544 PolarHBondContact O-N 2.93Å; S542-R545 WeakPolarHBondContact O-CB 3.24Å; S542-R545 PolarHBondContact O-N 2.98Å; S542-R545 VanDerWaalsContact O-N 3.16Å; S542-Q546 WeakPolarHBondContact O-CB 3.26Å; S542-Q546 PolarHBondContact O-N 3.45Å
543	I	45.9	Very low	42.7	Very low	51 Å²	51	75.7 Å²	75.7	26%	0.262	44%	0.438	S	S	.	.	H	α-helix	trans	-59.6	-46.9	179	-65.9	162.5	0	0	0	111.1	A539 L540 Q546 I547 L645	A539-I543 WeakPolarHBondContact O-CD1 3.35Å; A539-I543 VanDerWaalsContact O-CG1 3.22Å; A539-I543 WeakPolarHBondContact O-CG1 3.49Å; A539-I543 PolarHBondContact O-N 3.44Å; L540-I543 PolarHBondContact O-N 3.26Å; I543-Q546 PolarHBondContact O-N 3.03Å; I543-I547 HydrophobicContact CG2-CD1 3.97Å; I543-I547 WeakPolarHBondContact O-CD1 3.17Å; I543-I547 VanDerWaalsContact O-CG1 3.31Å; I543-I547 WeakPolarHBondContact O-CG1 3.38Å; I543-I547 PolarHBondContact O-N 3.3Å; I543-I547 VanDerWaalsContact O-N 3.12Å; I543-L645 HydrophobicContact CB-CD1 4.28Å; I543-L645 HydrophobicContact CD1-CD1 3.81Å; I543-L645 HydrophobicContact CD1-CD2 4.49Å; I543-L645 HydrophobicContact CD1-CG 4.35Å; I543-L645 HydrophobicContact CG1-CD1 3.6Å; I543-L645 HydrophobicContact CG1-CG 4.09Å; I543-L645 HydrophobicContact CG2-CD1 3.73Å
544	L	46.5	Very low	42.3	Very low	24 Å²	24	76 Å²	76	13%	0.126	42%	0.421	C	S	.	.	H	α-helix	trans	-64.8	-38.6	176.6	-74.3	168.4	0	0	0	112.3	L540 S542 M548	L540-L544 HydrophobicContact CG-CD1 4.35Å; L540-L544 WeakPolarHBondContact O-CG 3.44Å; L540-L544 PolarHBondContact O-N 2.84Å; S542-L544 PolarHBondContact O-N 2.93Å; L544-M548 WeakPolarHBondContact O-CG 3.31Å; L544-M548 PolarHBondContact O-N 3.3Å
545	R	48.4	Very low	41.8	Very low	127 Å²	127	73.9 Å²	73.9	48%	0.479	42%	0.419	S	S	.	.	H	α-helix	trans	-60.8	-50	174.3	-175	-172.2	-57.1	-170.4	0.6	111.1	L146 R541 S542 I547 M548 T549	L146-R545 HydrophobicContact CD2-CG 4.26Å; R541-R545 WeakPolarHBondContact O-CB 3.47Å; R541-R545 PolarHBondContact O-N 3.15Å; R541-R545 VanDerWaalsContact O-N 3.12Å; S542-R545 WeakPolarHBondContact O-CB 3.24Å; S542-R545 PolarHBondContact O-N 2.98Å; S542-R545 VanDerWaalsContact O-N 3.16Å; R545-I547 VanDerWaalsContact C-N 3.31Å; R545-I547 PolarHBondContact O-N 3.48Å; R545-M548 CarbonylContact O-C 3.51Å; R545-M548 WeakPolarHBondContact O-CA 3.18Å; R545-M548 PolarHBondContact O-N 2.92Å; R545-T549 HydrophobicContact CG-CG2 4.23Å; R545-T549 PolarHBondContact O-N 3.11Å; R545-T549 PolarHBondContact O-OG1 2.88Å
546	Q	45.5	Very low	41.1	Very low	82 Å²	82	73.8 Å²	73.8	38%	0.383	42%	0.422	S	S	.	.	H	α-helix	trans	-66	-32.1	-175.6	-161.7	167.4	26.9	0	0	112.7	S542 I543 M548 G550	S542-Q546 WeakPolarHBondContact O-CB 3.26Å; S542-Q546 PolarHBondContact O-N 3.45Å; I543-Q546 PolarHBondContact O-N 3.03Å; Q546-M548 VanDerWaalsContact C-N 3.3Å; Q546-G550 PolarHBondContact O-N 3.35Å
547	I	46.5	Very low	40.7	Very low	57 Å²	57	76.1 Å²	76.1	29%	0.292	43%	0.433	S	S	.	.	H	α-helix	trans	-67.3	-30.5	170.7	-68.6	165.7	0	0	0	111.9	I543 R545 I647	I543-I547 HydrophobicContact CG2-CD1 3.97Å; I543-I547 WeakPolarHBondContact O-CD1 3.17Å; I543-I547 VanDerWaalsContact O-CG1 3.31Å; I543-I547 WeakPolarHBondContact O-CG1 3.38Å; I543-I547 PolarHBondContact O-N 3.3Å; I543-I547 VanDerWaalsContact O-N 3.12Å; R545-I547 VanDerWaalsContact C-N 3.31Å; R545-I547 PolarHBondContact O-N 3.48Å; I547-I647 HydrophobicContact CD1-CD1 4.39Å
548	M	40.8	Very low	40.1	Very low	56 Å²	56	82.8 Å²	82.8	28%	0.276	47%	0.465	S	S	.	.	H	α-helix	trans	-86.8	-27.6	179.2	-69.7	177.5	66.1	0	0	113.7	L146 W149 L544 R545 Q546	L146-M548 HydrophobicContact CD1-CE 3.64Å; L146-M548 HydrophobicContact CD1-SD 4.27Å; W149-M548 HydrophobicContact CZ3-SD 4.26Å; L544-M548 WeakPolarHBondContact O-CG 3.31Å; L544-M548 PolarHBondContact O-N 3.3Å; R545-M548 CarbonylContact O-C 3.51Å; R545-M548 WeakPolarHBondContact O-CA 3.18Å; R545-M548 PolarHBondContact O-N 2.92Å; Q546-M548 VanDerWaalsContact C-N 3.3Å
549	T	41.8	Very low	39.5	Very low	77 Å²	77	85.4 Å²	85.4	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-93.3	-34.4	179.8	58.2	0	0	0	0	113.3	R545 F551 G552	R545-T549 HydrophobicContact CG-CG2 4.23Å; R545-T549 PolarHBondContact O-N 3.11Å; R545-T549 PolarHBondContact O-OG1 2.88Å; T549-F551 PolarHBondContact O-N 3.27Å; T549-G552 PolarHBondContact O-N 3.06Å; T549-G552 VanDerWaalsContact O-N 3.08Å
550	G	38.2	Very low	39.2	Very low	31 Å²	31	89.6 Å²	89.6	32%	0.32	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	17.3	-175	0	0	0	0	0	116.5	Q546	Q546-G550 PolarHBondContact O-N 3.35Å
551	F	41.6	Very low	38.5	Very low	108 Å²	108	94.1 Å²	94.1	47%	0.474	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-12.3	169.4	-89.9	-86.4	0	0	0	113.2	T549 L554	T549-F551 PolarHBondContact O-N 3.27Å; F551-L554 HydrophobicContact CD1-CD1 4.21Å; F551-L554 HydrophobicContact CE1-CD1 4.44Å
552	G	36.4	Very low	37.7	Very low	63 Å²	63	96 Å²	96	65%	0.649	54%	0.536	S	S	*	.	S	Bend	trans	-73.9	-31.1	177.8	0	0	0	0	0	113.9	T549 L554	T549-G552 PolarHBondContact O-N 3.06Å; T549-G552 VanDerWaalsContact O-N 3.08Å; G552-L554 VanDerWaalsContact C-N 3.26Å; G552-L554 PolarHBondContact O-N 3.41Å
553	E	36.5	Very low	36.9	Very low	158 Å²	158	98.5 Å²	98.5	74%	0.738	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-11.4	-176.2	-68.3	163.4	-163.5	0	0	113.5
554	L	31.6	Very low	36	Very low	82 Å²	82	102 Å²	102	43%	0.429	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.5	-10.3	-175.4	-65.1	178.3	0	0	0	114.6	F551 G552 L655	F551-L554 HydrophobicContact CD1-CD1 4.21Å; F551-L554 HydrophobicContact CE1-CD1 4.44Å; G552-L554 VanDerWaalsContact C-N 3.26Å; G552-L554 PolarHBondContact O-N 3.41Å; L554-L655 HydrophobicContact CD2-CD1 3.8Å
555	S	30.7	Very low	35.1	Very low	78 Å²	78	110.1 Å²	110.1	55%	0.545	62%	0.62	S	S	.	*	S	Bend	trans	-78.7	-30.7	176.7	-74.7	0	0	0	0	113.3	L557	S555-L557 PolarHBondContact O-N 3.12Å; S555-L557 VanDerWaalsContact O-N 3.15Å
556	S	28.4	Very low	34.1	Very low	108 Å²	108	108.8 Å²	108.8	76%	0.755	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	0.6	-173.8	-171.6	0	0	0	0	114.7
557	L	30.6	Very low	33.3	Very low	135 Å²	135	111.6 Å²	111.6	71%	0.707	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	16.9	-170.5	-127.7	165.1	0	0	0	112.7	S555	S555-L557 PolarHBondContact O-N 3.12Å; S555-L557 VanDerWaalsContact O-N 3.15Å
558	M	32	Very low	32.4	Very low	157 Å²	157	113.1 Å²	113.1	77%	0.773	67%	0.673	S	S	*	*	S	Bend	trans	-125.1	10.2	-177.7	-81.5	-164.8	67.4	0	0	114.6
559	E	32.2	Very low	32.4	Very low	168 Å²	168	116.3 Å²	116.3	79%	0.785	70%	0.698	S	S	*	*	S	Bend	trans	-108.2	0.8	-172.9	-63	-170.4	138.1	0	0	114.6
560	T	32.7	Very low	31.6	Very low	128 Å²	128	118.5 Å²	118.5	79%	0.785	72%	0.717	S	S	*	*	S	Bend	trans	-94.5	-0.6	-175.6	42.6	0	0	0	0	116
561	E	30.3	Very low	31.2	Very low	172 Å²	172	126.2 Å²	126.2	80%	0.804	74%	0.744	S	S	*	*			trans	-129.3	56.1	-176	57.2	-162.9	109.5	0	0	113.5
562	A	31.6	Very low	30.6	Very low	89 Å²	89	125.2 Å²	125.2	74%	0.736	76%	0.756	S	S	*	*			trans	-128.4	50.8	178.8	0	0	0	0	0	113.4
563	S	26.8	Very low	30.1	Very low	117 Å²	117	129.6 Å²	129.6	82%	0.818	76%	0.764	S	S	*	*			trans	-160.7	147	165.5	-84.1	0	0	0	0	113.5
564	S	26.7	Very low	29.8	Very low	126 Å²	126	128.2 Å²	128.2	88%	0.881	77%	0.766	S	S	*	*			trans	79.1	59.9	164.5	-52.7	0	0	0	0	119.5
565	E	27.2	Very low	29.5	Very low	194 Å²	194	127.9 Å²	127.9	91%	0.907	78%	0.783	S	S	*	*			trans	-113.7	127.3	134	-147.1	-172.1	90.2	0	0	105.7
566	S	28.5	Very low	29.4	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	79%	0.794	S	S	*	*			cis	-168.1	-167.7	49.1	55.4	0	0	0	0	111.4
567	V	27.9	Very low	29.3	Very low	140 Å²	140	129.3 Å²	129.3	85%	0.848	79%	0.793	S	S	*	*			trans	103.8	120.8	169.7	-176.7	0	0	0	0	116.1
568	A	26.8	Very low	29.4	Very low	89 Å²	89	129.9 Å²	129.9	74%	0.736	80%	0.797	S	S	*	*			trans	-142.5	177.2	169.2	0	0	0	0	0	108.6
569	P	41.5	Very low	29.3	Very low	123 Å²	123	127.8 Å²	127.8	80%	0.799	80%	0.798	S	S	*	*				-113.2	169.2	-87.2	36.8	-26.5	0	0	0	113.2
570	S	25.1	Very low	29.2	Very low	124 Å²	124	125.1 Å²	125.1	87%	0.867	80%	0.798	S	S	*	*			trans	-152.3	159.5	170.6	-80.5	0	0	0	0	112
571	H	29.8	Very low	29	Very low	192 Å²	192	124.2 Å²	124.2	89%	0.889	80%	0.797	S	S	*	*			trans	-98.9	141.2	-157.2	-93.3	-107	0	0	0	116.3
572	A	29.6	Very low	29	Very low	88 Å²	88	120.1 Å²	120.1	73%	0.727	79%	0.787	S	S	*	*				68.5	108.6	129	0	0	0	0	0	122.4
573	D	25.8	Very low	28.7	Very low	154 Å²	154	126.7 Å²	126.7	82%	0.824	79%	0.793	S	S	*	*				102	152.2	112.3	-153.7	20.2	0	0	0	121.8
574	V	30.3	Very low	28.7	Very low	129 Å²	129	128.1 Å²	128.1	78%	0.782	79%	0.791	S	S	*	*			trans	70.3	119.3	167.4	-162.8	0	0	0	0	120
575	G	25.4	Very low	28.6	Very low	76 Å²	76	129.3 Å²	129.3	78%	0.784	78%	0.782	S	S	*	*			trans	156.7	104.4	153.2	0	0	0	0	0	117.4
576	A	27.2	Very low	28.5	Very low	93 Å²	93	126.6 Å²	126.6	77%	0.769	77%	0.773	S	S	*	*			trans	-86.4	167.6	165.3	0	0	0	0	0	110.4
577	T	28.1	Very low	28.3	Very low	122 Å²	122	127.8 Å²	127.8	75%	0.748	77%	0.772	S	S	*	*			cis	-165.1	140.2	49.4	48.6	0	0	0	0	116
578	N	31.1	Very low	28.2	Very low	148 Å²	148	128.4 Å²	128.4	79%	0.791	77%	0.765	S	S	*	*			trans	41.1	132.3	135.8	-58.7	-2.4	0	0	0	124.5
579	S	30.5	Very low	28.1	Very low	112 Å²	112	131.4 Å²	131.4	78%	0.783	77%	0.769	S	S	*	*				141.5	135.9	125.4	-60.8	0	0	0	0	111
580	S	29.6	Very low	27.5	Very low	112 Å²	112	133.1 Å²	133.1	78%	0.783	77%	0.766	S	S	*	*			cis	-140.5	145.1	9.6	-68.3	0	0	0	0	109.3
581	S	29	Very low	28.1	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	76%	0.763	S	S	*	*				58.8	136.3	73.1	-95.6	0	0	0	0	115.7
582	S	30	Very low	27.9	Very low	86 Å²	86	126.7 Å²	126.7	60%	0.601	75%	0.749	S	S	*	*			cis	-169.9	155.7	2.9	-119.6	0	0	0	0	114.9
583	R	26.4	Very low	28	Very low	226 Å²	226	131.4 Å²	131.4	85%	0.853	76%	0.756	S	S	*	*			trans	61.6	136.5	150.3	-62.5	167.3	-179.8	177.3	-2.6	119.7
584	L	25.5	Very low	28	Very low	147 Å²	147	130.8 Å²	130.8	77%	0.77	76%	0.757	S	S	*	*			cis	93.6	129.8	29.4	-73.3	177.1	0	0	0	117.3
585	H	25.7	Very low	28	Very low	152 Å²	152	127.4 Å²	127.4	70%	0.704	75%	0.749	S	S	*	*			trans	87.5	120.2	146.7	-77.2	-58.3	0	0	0	124.4
586	L	24.8	Very low	28.2	Very low	136 Å²	136	129.8 Å²	129.8	71%	0.712	75%	0.748	S	S	*	*				85.6	111	125.1	-78.7	165.4	0	0	0	124.3
587	N	24.7	Very low	28.2	Very low	124 Å²	124	132.4 Å²	132.4	66%	0.663	75%	0.749	S	S	*	*				87.1	141	121.6	-107.3	28.7	0	0	0	125.7
588	E	25.4	Very low	28.1	Very low	154 Å²	154	134.6 Å²	134.6	72%	0.72	75%	0.751	S	S	*	*			trans	88.3	133.1	141.2	-84.8	161.5	119.3	0	0	124.4
589	N	24.7	Very low	28	Very low	152 Å²	152	130.9 Å²	130.9	81%	0.813	74%	0.741	S	S	*	*			trans	85.6	121.4	153.5	-63.9	-10	0	0	0	123.6
590	E	28.5	Very low	28	Very low	159 Å²	159	131.5 Å²	131.5	74%	0.743	74%	0.74	S	S	*	*			trans	-70.6	160.7	155.3	-117.5	-79.1	97	0	0	110.6	G592	E590-G592 VanDerWaalsContact CD-N 3.34Å; E590-G592 PolarHBondContact OE1-N 2.88Å; E590-G592 PolarHBondContact OE2-N 3.16Å
591	P	37.3	Very low	29.1	Very low	123 Å²	123	132.3 Å²	132.3	80%	0.799	74%	0.742	S	S	*	*				-157.8	129.8	84.9	37.6	-15.3	0	0	0	119.7
592	G	26.9	Very low	28.9	Very low	57 Å²	57	130.1 Å²	130.1	59%	0.588	74%	0.737	S	S	*	*			trans	75.5	170.6	141.2	0	0	0	0	0	119.7	E590	E590-G592 VanDerWaalsContact CD-N 3.34Å; E590-G592 PolarHBondContact OE1-N 2.88Å; E590-G592 PolarHBondContact OE2-N 3.16Å
593	Q	31.2	Very low	28.7	Very low	188 Å²	188	133.5 Å²	133.5	88%	0.879	75%	0.748	S	S	*	*			cis	-164.8	172.1	-8.1	-151.1	-178.1	11.8	0	0	110.6
594	V	26.6	Very low	28.5	Very low	141 Å²	141	131 Å²	131	86%	0.855	75%	0.746	S	S	*	*			trans	79	131.8	170.1	-170.7	0	0	0	0	116.6
595	G	28.9	Very low	28.6	Very low	58 Å²	58	127.5 Å²	127.5	60%	0.598	75%	0.745	S	S	*	*			cis	164	166.3	-10.6	0	0	0	0	0	115.8
596	T	30.5	Very low	28.4	Very low	126 Å²	126	128.6 Å²	128.6	77%	0.773	75%	0.751	S	S	*	*			trans	66.8	142.8	164.9	67.7	0	0	0	0	119.4
597	D	27.8	Very low	28.5	Very low	148 Å²	148	128.1 Å²	128.1	79%	0.791	75%	0.753	S	S	*	*			cis	-172.1	173.3	-24.6	-89.3	-31.8	0	0	0	106
598	E	25.3	Very low	28.4	Very low	167 Å²	167	130.9 Å²	130.9	78%	0.78	75%	0.754	S	S	*	*			cis	-152.5	-171.2	2.5	-139.4	-152.5	126.8	0	0	106.6
599	A	28	Very low	28.6	Very low	71 Å²	71	128.8 Å²	128.8	59%	0.587	76%	0.757	S	S	*	*			cis	-158.4	159.2	4.1	0	0	0	0	0	112.8
600	V	32	Very low	28.7	Very low	125 Å²	125	126.7 Å²	126.7	76%	0.758	74%	0.742	S	S	*	*			trans	33.5	138.9	137.8	-179.7	0	0	0	0	123.4
601	P	52	Low	28.7	Very low	128 Å²	128	125.8 Å²	125.8	83%	0.831	74%	0.742	S	S	*	*			trans	-117.3	176.9	-179.7	44.1	-35.2	0	0	0	116.5
602	G	24.2	Very low	28.3	Very low	65 Å²	65	126.8 Å²	126.8	67%	0.67	74%	0.736	S	S	*	*			trans	153.6	157.9	149.7	0	0	0	0	0	119
603	L	26.6	Very low	28.5	Very low	157 Å²	157	130.8 Å²	130.8	82%	0.822	74%	0.74	S	S	*	*			trans	67.9	157.4	154.3	-46.8	179.9	0	0	0	118.1
604	E	22.9	Very low	28.2	Very low	172 Å²	172	129.3 Å²	129.3	80%	0.804	74%	0.736	S	S	*	*			cis	-162.3	157.7	-23.2	-114.8	177.8	146.3	0	0	111.9
605	G	25.7	Very low	28.3	Very low	74 Å²	74	125.2 Å²	125.2	76%	0.763	72%	0.723	S	S	*	*			trans	69.3	168.1	156.9	0	0	0	0	0	119.8
606	Q	23	Very low	28.3	Very low	175 Å²	175	132 Å²	132	82%	0.818	74%	0.739	S	S	*	*			cis	175	167	-16.5	-179.4	62.2	-24.5	0	0	105.6
607	V	25.9	Very low	28.1	Very low	126 Å²	126	130.2 Å²	130.2	76%	0.764	74%	0.737	S	S	*	*			trans	75.5	111.1	176	-168.2	0	0	0	0	112.8
608	R	23.8	Very low	28	Very low	183 Å²	183	133.4 Å²	133.4	69%	0.691	74%	0.738	S	S	*	*			cis	72.5	96.3	20	-168.2	-172.8	172	144.4	8.6	116.3	E610	R608-E610 HydrophobicContact CG-CG 4.38Å; R608-E610 IonicContact CZ-OE1 2.72Å; R608-E610 IonicContact CZ-OE2 2.75Å; R608-E610 VanDerWaalsContact NE-CD 3.29Å; R608-E610 IonicContact NE-OE1 3.86Å; R608-E610 PolarHBondContact NE-OE1 3.45Å; R608-E610 IonicContact NE-OE2 3.08Å; R608-E610 PolarHBondContact NE-OE2 3.15Å; R608-E610 IonicContact NH2-OE1 3.21Å; R608-E610 PolarHBondContact NH2-OE1 3.43Å; R608-E610 IonicContact NH2-OE2 3.15Å; R608-E610 PolarHBondContact NH2-OE2 2.81Å
609	S	28.3	Very low	28.1	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	74%	0.739	S	S	*	*			trans	-170.6	122.6	130.6	-84.8	0	0	0	0	106.3
610	E	27.2	Very low	28	Very low	108 Å²	108	134.4 Å²	134.4	51%	0.505	75%	0.748	S	S	.	*			cis	80.6	124.7	47.4	-63.3	-178.8	142.1	0	0	114.1	R608	R608-E610 HydrophobicContact CG-CG 4.38Å; R608-E610 IonicContact CZ-OE1 2.72Å; R608-E610 IonicContact CZ-OE2 2.75Å; R608-E610 VanDerWaalsContact NE-CD 3.29Å; R608-E610 IonicContact NE-OE1 3.86Å; R608-E610 PolarHBondContact NE-OE1 3.45Å; R608-E610 IonicContact NE-OE2 3.08Å; R608-E610 PolarHBondContact NE-OE2 3.15Å; R608-E610 IonicContact NH2-OE1 3.21Å; R608-E610 PolarHBondContact NH2-OE1 3.43Å; R608-E610 IonicContact NH2-OE2 3.15Å; R608-E610 PolarHBondContact NH2-OE2 2.81Å
611	D	28.5	Very low	27.6	Very low	140 Å²	140	132.7 Å²	132.7	75%	0.749	76%	0.755	S	S	*	*			trans	73.6	147.5	145.5	-58.8	-8.5	0	0	0	121.3
612	E	28.9	Very low	26.2	Very low	144 Å²	144	130.5 Å²	130.5	67%	0.673	76%	0.756	S	S	*	*			cis	-168.1	165.3	-27.7	-150.2	-174	172.9	0	0	111.1
613	Q	31.2	Very low	26.4	Very low	140 Å²	140	134 Å²	134	65%	0.654	76%	0.764	S	S	*	*			trans	77.8	148.8	138.3	-141	118	109.5	0	0	123.5
614	I	25.8	Very low	26.4	Very low	157 Å²	157	132.3 Å²	132.3	81%	0.805	76%	0.76	S	S	*	*			trans	63.5	132.2	162.2	-33.9	-172.7	0	0	0	118.5
615	G	27.4	Very low	26.6	Very low	56 Å²	56	129.3 Å²	129.3	58%	0.577	76%	0.758	S	S	*	*			cis	132.6	132.5	-10.4	0	0	0	0	0	115.2
616	Q	30	Very low	26.7	Very low	201 Å²	201	131.4 Å²	131.4	94%	0.939	76%	0.761	S	S	*	*			trans	-163.2	167.2	163.6	-125.5	126	119.2	0	0	108.4
617	A	25.2	Very low	26.9	Very low	87 Å²	87	129.4 Å²	129.4	72%	0.719	76%	0.76	S	S	*	*			trans	-153.8	177.9	-176.3	0	0	0	0	0	110.7
618	R	26.6	Very low	26.9	Very low	216 Å²	216	131 Å²	131	82%	0.815	76%	0.764	S	S	*	*			trans	87.7	139.9	178.2	-55.4	175	164	170.2	-6.2	114.9
619	F	27.2	Very low	27.1	Very low	184 Å²	184	126.2 Å²	126.2	81%	0.807	77%	0.772	S	S	*	*			cis	-154.8	163.2	-14.6	-88.7	-44	0	0	0	107.8
620	G	25.4	Very low	26.9	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	78%	0.779	S	S	*	*			cis	128.6	89.4	-4.8	0	0	0	0	0	114.6
621	G	24.3	Very low	27	Very low	88 Å²	88	130.6 Å²	130.6	91%	0.907	78%	0.782	S	S	*	*			trans	-173	142.4	171.6	0	0	0	0	0	114.2
622	G	22.6	Very low	27	Very low	82 Å²	82	129.4 Å²	129.4	85%	0.845	78%	0.775	S	S	*	*			trans	155.2	94.9	175.7	0	0	0	0	0	115.9
623	V	27.3	Very low	27.3	Very low	139 Å²	139	128.2 Å²	128.2	84%	0.842	78%	0.783	S	S	*	*			trans	-166.3	129.8	174.8	135	0	0	0	0	104.5
624	V	27.4	Very low	27.3	Very low	122 Å²	122	130 Å²	130	74%	0.739	78%	0.784	S	S	*	*			cis	-152.4	163.3	4.7	-98.1	0	0	0	0	112
625	S	27.5	Very low	27.4	Very low	108 Å²	108	127.9 Å²	127.9	76%	0.755	77%	0.774	S	S	*	*			trans	80.6	133.9	150.2	-65.6	0	0	0	0	122.3
626	S	27.2	Very low	27.8	Very low	119 Å²	119	131.8 Å²	131.8	83%	0.832	79%	0.787	S	S	*	*			trans	56.8	104.1	153.2	-61.1	0	0	0	0	120.7
627	V	27.5	Very low	28.1	Very low	132 Å²	132	128.3 Å²	128.3	80%	0.8	78%	0.775	S	S	*	*				176.2	157.2	119.3	65.1	0	0	0	0	110.8
628	D	25.7	Very low	28.4	Very low	160 Å²	160	130.4 Å²	130.4	86%	0.856	77%	0.774	S	S	*	*			trans	14.3	139.7	166.8	-64.9	-37.9	0	0	0	123
629	G	27	Very low	29	Very low	82 Å²	82	126.8 Å²	126.8	85%	0.845	77%	0.77	S	S	*	*			trans	-163.3	67.7	175	0	0	0	0	0	114.7
630	R	26	Very low	29.5	Very low	242 Å²	242	124.4 Å²	124.4	91%	0.913	77%	0.77	S	S	*	*			trans	-95.4	119.8	-172.6	177.7	176.4	175.8	167.3	-0.8	114.3
631	A	27.3	Very low	30.2	Very low	69 Å²	69	129.6 Å²	129.6	57%	0.57	77%	0.774	S	S	*	*			trans	63	135.1	149.3	0	0	0	0	0	121.8
632	N	28.9	Very low	30.7	Very low	114 Å²	114	130.7 Å²	130.7	61%	0.61	76%	0.759	S	S	*	*				-159.4	129.8	125.5	-85.8	-36.3	0	0	0	106	R634	N632-R634 PolarHBondContact OD1-NH1 3.08Å
633	S	34.9	Very low	31.5	Very low	119 Å²	119	130.8 Å²	130.8	83%	0.832	76%	0.76	S	S	*	*			cis	62.6	37	0.4	-142.8	0	0	0	0	116.8
634	R	31.8	Very low	32	Very low	178 Å²	178	128.5 Å²	128.5	67%	0.672	75%	0.747	S	S	*	*			trans	-132.4	143.3	147.2	-72.2	174.1	161.8	86.4	-7.6	103.8	N632	N632-R634 PolarHBondContact OD1-NH1 3.08Å
635	D	29	Very low	32.6	Very low	112 Å²	112	125.7 Å²	125.7	60%	0.599	73%	0.727	S	S	*	*			cis	-131.3	131	26	-70.1	-69.9	0	0	0	115
636	T	36	Very low	33.5	Very low	138 Å²	138	125.6 Å²	125.6	85%	0.847	72%	0.724	S	S	*	*	S	Bend	trans	-125.7	7.1	159	49.9	0	0	0	0	112.4
637	N	34.3	Very low	34	Very low	129 Å²	129	124.1 Å²	124.1	69%	0.69	71%	0.706	S	S	*	*	S	Bend	trans	-98.8	-10.8	-177.3	-84.5	-8.5	0	0	0	114.6	L639	N637-L639 PolarHBondContact O-N 3.06Å
638	N	32.9	Very low	34.5	Very low	130 Å²	130	122 Å²	122	70%	0.695	69%	0.69	S	S	*	*	S	Bend	trans	-85	28.2	179.8	-82.5	-8.6	0	0	0	114.5
639	L	39	Very low	35.2	Very low	140 Å²	140	124.6 Å²	124.6	73%	0.733	69%	0.687	S	S	*	*			trans	-124.9	34.1	175.9	-158.8	64	0	0	0	112.7	N637	N637-L639 PolarHBondContact O-N 3.06Å
640	V	37.6	Very low	35.8	Very low	134 Å²	134	124.9 Å²	124.9	81%	0.812	67%	0.669	S	S	*	*	S	Bend	trans	-102.5	-20.6	172.5	-178.8	0	0	0	0	111.9
641	E	39.6	Very low	36.3	Very low	184 Å²	184	115.8 Å²	115.8	86%	0.86	65%	0.645	S	S	*	*	S	Bend	trans	-88.4	-25	-170.2	-160.7	127	-134.8	0	0	114
642	N	35.3	Very low	36.6	Very low	111 Å²	111	119.1 Å²	119.1	59%	0.594	65%	0.649	S	S	*	*	S	Bend	trans	-88.4	117.6	175.7	-70.1	-32.9	0	0	0	110.3	T644	N642-T644 PolarHBondContact O-N 2.99Å
643	G	38.7	Very low	37.1	Very low	84 Å²	84	120.4 Å²	120.4	87%	0.866	65%	0.649	S	S	*	*			trans	-68.6	33.9	-166.3	0	0	0	0	0	118.3
644	T	39.1	Very low	37.4	Very low	92 Å²	92	120.1 Å²	120.1	56%	0.564	63%	0.633	S	S	*	*			trans	-81.5	117.3	-178.3	-52.7	0	0	0	0	110.7	N642 L648	N642-T644 PolarHBondContact O-N 2.99Å; T644-L648 HydrophobicContact CG2-CD1 3.66Å
645	L	38.9	Very low	37.9	Very low	63 Å²	63	116.9 Å²	116.9	33%	0.33	63%	0.629	S	S	.	*			trans	-66	152.5	-174	-79.8	-164	0	0	0	114	I543 I647 L648	I543-L645 HydrophobicContact CB-CD1 4.28Å; I543-L645 HydrophobicContact CD1-CD1 3.81Å; I543-L645 HydrophobicContact CD1-CD2 4.49Å; I543-L645 HydrophobicContact CD1-CG 4.35Å; I543-L645 HydrophobicContact CG1-CD1 3.6Å; I543-L645 HydrophobicContact CG1-CG 4.09Å; I543-L645 HydrophobicContact CG2-CD1 3.73Å; L645-I647 HydrophobicContact CB-CB 4.49Å; L645-I647 HydrophobicContact CB-CG1 4.32Å; L645-I647 HydrophobicContact CD1-CD1 3.77Å; L645-I647 HydrophobicContact CD1-CG1 4.32Å; L645-I647 PolarHBondContact O-N 3.49Å; L645-L648 PolarHBondContact O-N 3.2Å
646	P	47.6	Very low	38.3	Very low	106 Å²	106	117.6 Å²	117.6	69%	0.688	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-2.6	171.3	-25.4	34.9	0	0	0	116.5
647	I	37.6	Very low	38.6	Very low	88 Å²	88	115 Å²	115	45%	0.451	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.2	-39	-178.8	-62.5	177.6	0	0	0	111.2	I547 L645 R649 L650 A651	I547-I647 HydrophobicContact CD1-CD1 4.39Å; L645-I647 HydrophobicContact CB-CB 4.49Å; L645-I647 HydrophobicContact CB-CG1 4.32Å; L645-I647 HydrophobicContact CD1-CD1 3.77Å; L645-I647 HydrophobicContact CD1-CG1 4.32Å; L645-I647 PolarHBondContact O-N 3.49Å; I647-R649 VanDerWaalsContact C-N 3.27Å; I647-R649 PolarHBondContact O-N 2.97Å; I647-L650 WeakPolarHBondContact O-CA 3.17Å; I647-L650 VanDerWaalsContact O-CB 3.31Å; I647-L650 WeakPolarHBondContact O-CB 3.4Å; I647-L650 PolarHBondContact O-N 3.06Å; I647-A651 PolarHBondContact O-N 3.28Å
648	L	37.7	Very low	39.1	Very low	87 Å²	87	115.4 Å²	115.4	46%	0.455	62%	0.615	S	S	.	*	H	α-helix	trans	-64	-34.6	177.3	-75.9	166.4	0	0	0	112	T644 L645 L650 A651 H652	T644-L648 HydrophobicContact CG2-CD1 3.66Å; L645-L648 PolarHBondContact O-N 3.2Å; L648-L650 PolarHBondContact O-N 3.2Å; L648-A651 PolarHBondContact O-N 2.89Å; L648-H652 PolarHBondContact O-N 2.86Å; L648-H652 VanDerWaalsContact O-N 3.14Å
649	R	40.2	Very low	39.4	Very low	214 Å²	214	116.4 Å²	116.4	81%	0.808	62%	0.62	S	S	*	*	H	α-helix	trans	-64.7	-18.8	173.2	-164.4	172.9	-172.6	146.5	4.4	113.3	I647	I647-R649 VanDerWaalsContact C-N 3.27Å; I647-R649 PolarHBondContact O-N 2.97Å
650	L	38.6	Very low	39.9	Very low	89 Å²	89	116.9 Å²	116.9	47%	0.466	62%	0.619	S	S	.	*	H	α-helix	trans	-86.3	-36.8	174.4	-169.4	65.7	0	0	0	111.7	I647 L648 F653 F654	I647-L650 WeakPolarHBondContact O-CA 3.17Å; I647-L650 VanDerWaalsContact O-CB 3.31Å; I647-L650 WeakPolarHBondContact O-CB 3.4Å; I647-L650 PolarHBondContact O-N 3.06Å; L648-L650 PolarHBondContact O-N 3.2Å; L650-F653 PolarHBondContact O-N 3.12Å; L650-F654 HydrophobicContact CD1-CE2 3.97Å; L650-F654 HydrophobicContact CD1-CZ 4.43Å; L650-F654 HydrophobicContact CD2-CE2 4.25Å; L650-F654 HydrophobicContact CG-CD2 4.23Å; L650-F654 HydrophobicContact CG-CE2 3.73Å; L650-F654 WeakPolarHBondContact O-CD2 3.34Å; L650-F654 PolarHBondContact O-N 3.35Å
651	A	36.8	Very low	40.1	Very low	50 Å²	50	114.3 Å²	114.3	41%	0.413	60%	0.601	S	S	.	*	H	α-helix	trans	-63	-48.9	174.7	0	0	0	0	0	111.7	I647 L648 F653 F654	I647-A651 PolarHBondContact O-N 3.28Å; L648-A651 PolarHBondContact O-N 2.89Å; A651-F653 PolarHBondContact O-N 2.95Å; A651-F653 VanDerWaalsContact O-N 3.12Å; A651-F654 PolarHBondContact O-N 3.24Å
652	H	35	Very low	40.4	Very low	139 Å²	139	113.8 Å²	113.8	64%	0.644	60%	0.604	S	S	*	*	H	α-helix	trans	-64.5	-15.1	176.6	-163.1	-48.7	0	0	0	113.3	L648	L648-H652 PolarHBondContact O-N 2.86Å; L648-H652 VanDerWaalsContact O-N 3.14Å
653	F	38.5	Very low	41.1	Very low	141 Å²	141	116.9 Å²	116.9	62%	0.618	62%	0.615	S	S	*	*	H	α-helix	trans	-84.7	-18.3	174.5	-163.8	-94.4	0	0	0	113	L650 A651 N657	L650-F653 PolarHBondContact O-N 3.12Å; A651-F653 PolarHBondContact O-N 2.95Å; A651-F653 VanDerWaalsContact O-N 3.12Å; F653-N657 PolarHBondContact O-ND2 3.36Å
654	F	40.8	Very low	41.4	Very low	113 Å²	113	120 Å²	120	50%	0.496	61%	0.606	S	S	.	*	H	α-helix	trans	-95.9	-10.6	-175.6	-79.7	-55.9	0	0	0	115.1	L650 A651	L650-F654 HydrophobicContact CD1-CE2 3.97Å; L650-F654 HydrophobicContact CD1-CZ 4.43Å; L650-F654 HydrophobicContact CD2-CE2 4.25Å; L650-F654 HydrophobicContact CG-CD2 4.23Å; L650-F654 HydrophobicContact CG-CE2 3.73Å; L650-F654 WeakPolarHBondContact O-CD2 3.34Å; L650-F654 PolarHBondContact O-N 3.35Å; A651-F654 PolarHBondContact O-N 3.24Å
655	L	43.3	Very low	41.9	Very low	111 Å²	111	121 Å²	121	58%	0.581	61%	0.614	S	S	*	*	S	Bend	trans	-113.8	15.2	-170	-63.8	177.7	0	0	0	115	L554	L554-L655 HydrophobicContact CD2-CD1 3.8Å
656	L	37.5	Very low	43.2	Very low	127 Å²	127	123.2 Å²	123.2	67%	0.665	62%	0.618	S	S	*	*	S	Bend	trans	-141	28.2	-178.8	-69.1	174.6	0	0	0	112.9
657	N	42.8	Very low	44.8	Very low	82 Å²	82	119.1 Å²	119.1	44%	0.439	60%	0.595	S	S	.	*	S	Bend	trans	-143.3	-7	-176.8	-66.9	-70.8	0	0	0	115.5	F653	F653-N657 PolarHBondContact O-ND2 3.36Å
658	D	43	Very low	47	Very low	139 Å²	139	115.4 Å²	115.4	74%	0.743	58%	0.577	S	S	*	*	S	Bend	trans	-93.5	-6.3	-166.2	-90.8	-17.3	0	0	0	114.8
659	D	39.1	Very low	49.3	Very low	150 Å²	150	114.8 Å²	114.8	80%	0.802	58%	0.576	S	S	*	*	S	Bend	trans	-98.1	-1.4	-170.8	-54.2	-78.2	0	0	0	115.4
660	E	49.8	Very low	51.5	Low	151 Å²	151	111.8 Å²	111.8	71%	0.706	57%	0.569	S	S	*	*	S	Bend	trans	-137.2	32.9	-167.4	-90.4	-87.4	121.9	0	0	113.5	R666	E660-R666 VanDerWaalsContact O-CZ 3.31Å; E660-R666 PolarHBondContact O-NH2 3.17Å
661	D	42.9	Very low	53.9	Low	79 Å²	79	114.7 Å²	114.7	42%	0.422	58%	0.58	S	S	.	*			trans	-145.9	26	-167.9	-106.3	-39.8	0	0	0	117.9	R666	D661-R666 VanDerWaalsContact CG-NE 3.26Å; D661-R666 VanDerWaalsContact CG-NH2 3.32Å; D661-R666 WeakPolarHBondContact OD1-CG 3.28Å; D661-R666 IonicContact OD1-CZ 3.79Å; D661-R666 IonicContact OD1-NE 3.69Å; D661-R666 PolarHBondContact OD1-NE 2.62Å; D661-R666 IonicContact OD1-NH2 3.69Å; D661-R666 IonicContact OD2-CZ 3.82Å; D661-R666 IonicContact OD2-NE 2.74Å; D661-R666 PolarHBondContact OD2-NE 3Å; D661-R666 IonicContact OD2-NH2 2.9Å; D661-R666 PolarHBondContact OD2-NH2 2.89Å
662	D	45.5	Very low	56.3	Low	174 Å²	174	115.8 Å²	115.8	93%	0.93	58%	0.577	S	S	*	*	S	Bend	trans	-93.7	0.8	177.3	-123.2	-22	0	0	0	115.1
663	E	49.8	Very low	58.9	Low	176 Å²	176	109.4 Å²	109.4	82%	0.822	55%	0.548	S	S	*	.	S	Bend	trans	-141.5	-5.4	177.2	-148.8	166	-174.5	0	0	118.2
664	H	44.8	Very low	61.3	Low	148 Å²	148	106.2 Å²	106.2	69%	0.685	54%	0.537	S	S	*	.			trans	-132.9	123.6	-179.4	-69.4	93.9	0	0	0	114	R666	H664-R666 PolarHBondContact O-N 3.25Å
665	P	50.8	Low	63.6	Low	113 Å²	113	107.5 Å²	107.5	73%	0.734	55%	0.549	S	S	*	.			trans	-73	111.9	172.6	29.5	-32.5	0	0	0	110.4	G667	P665-G667 PolarHBondContact O-N 2.84Å
666	R	66.2	Low	65.9	Low	110 Å²	110	103.2 Å²	103.2	42%	0.415	53%	0.527	S	S	.	.			trans	-69.5	16.7	179.4	-48.3	-159.1	-145.8	-136.9	12.8	115.6	E660 D661 H664 N728 N729	E660-R666 VanDerWaalsContact O-CZ 3.31Å; E660-R666 PolarHBondContact O-NH2 3.17Å; D661-R666 VanDerWaalsContact CG-NE 3.26Å; D661-R666 VanDerWaalsContact CG-NH2 3.32Å; D661-R666 WeakPolarHBondContact OD1-CG 3.28Å; D661-R666 IonicContact OD1-CZ 3.79Å; D661-R666 IonicContact OD1-NE 3.69Å; D661-R666 PolarHBondContact OD1-NE 2.62Å; D661-R666 IonicContact OD1-NH2 3.69Å; D661-R666 IonicContact OD2-CZ 3.82Å; D661-R666 IonicContact OD2-NE 2.74Å; D661-R666 PolarHBondContact OD2-NE 3Å; D661-R666 IonicContact OD2-NH2 2.9Å; D661-R666 PolarHBondContact OD2-NH2 2.89Å; H664-R666 PolarHBondContact O-N 3.25Å; R666-N728 CarbonylContact O-C 3.57Å; R666-N729 PolarHBondContact O-N 3.27Å; R666-N729 VanDerWaalsContact O-N 3.09Å
667	G	79.4	Confident	68.4	Low	20 Å²	20	101 Å²	101	21%	0.206	52%	0.522	C	S	.	.	S	Bend	trans	-101.4	161	173.2	0	0	0	0	0	112.7	P665 L725	P665-G667 PolarHBondContact O-N 2.84Å; G667-L725 CarbonylContact C-O 3.6Å; G667-L725 VanDerWaalsContact CA-O 3.29Å; G667-L725 WeakPolarHBondContact CA-O 3.29Å
668	L	84.3	Confident	70.7	Confident	11 Å²	11	100.5 Å²	100.5	6%	0.058	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-71.3	150	171.8	-85.7	65.7	0	0	0	110.7	Q672 I673 L725 N729 I738 L739	L668-Q672 HydrophobicContact CB-CB 4.09Å; L668-Q672 HydrophobicContact CD2-CB 4.08Å; L668-Q672 HydrophobicContact CG-CB 4.17Å; L668-I673 HydrophobicContact CB-CD1 4.1Å; L668-I673 HydrophobicContact CB-CG1 3.58Å; L668-I673 HydrophobicContact CD2-CG1 4.29Å; L668-L725 PolarHBondContact N-O 3.12Å; L668-N729 HydrophobicContact CD1-CB 3.62Å; L668-I738 HydrophobicContact CD1-CB 4.5Å; L668-I738 HydrophobicContact CD2-CB 4.16Å; L668-I738 HydrophobicContact CD2-CG2 3.88Å; L668-L739 HydrophobicContact CD1-CG 4.49Å; L668-L739 HydrophobicContact CD2-CD2 4.23Å; L668-L739 HydrophobicContact CD2-CG 4.19Å; L668-L739 HydrophobicContact CG-CD1 4.13Å; L668-L739 HydrophobicContact CG-CG 4.21Å
669	T	87.3	Confident	72.8	Confident	73 Å²	73	99.5 Å²	99.5	45%	0.448	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-65.5	152.7	167.9	78.6	0	0	0	0	110.1	E671 Q672 I673	T669-E671 PolarHBondContact O-N 3.08Å; T669-E671 VanDerWaalsContact O-N 3.12Å; T669-Q672 WeakPolarHBondContact O-CB 3.4Å; T669-Q672 PolarHBondContact O-N 2.84Å; T669-Q672 WeakPolarHBondContact OG1-CG 3.27Å; T669-Q672 PolarHBondContact OG1-N 3.07Å; T669-I673 WeakPolarHBondContact O-CG1 3.17Å; T669-I673 PolarHBondContact O-N 3.33Å
670	K	86.1	Confident	75.2	Confident	151 Å²	151	96.6 Å²	96.6	66%	0.657	50%	0.495	S	S	*	.	H	α-helix	trans	-55	-34.7	178.1	-174.9	176.3	-179.4	-69.2	0	112.5	I673 D674	K670-I673 PolarHBondContact O-N 3.15Å; K670-D674 IonicContact NZ-OD2 3.36Å; K670-D674 PolarHBondContact NZ-OD2 3.12Å; K670-D674 WeakPolarHBondContact O-CB 3.4Å; K670-D674 PolarHBondContact O-N 3.29Å
671	E	87.8	Confident	76.9	Confident	151 Å²	151	91 Å²	91	71%	0.706	47%	0.468	S	S	*	.	H	α-helix	trans	-67.8	-43.5	177.6	-64.7	168.7	-170.7	0	0	111.7	T669 I673 D674 N675	T669-E671 PolarHBondContact O-N 3.08Å; T669-E671 VanDerWaalsContact O-N 3.12Å; E671-I673 VanDerWaalsContact C-N 3.32Å; E671-I673 PolarHBondContact O-N 3.29Å; E671-D674 PolarHBondContact O-N 3.16Å; E671-N675 WeakPolarHBondContact O-CB 3.38Å; E671-N675 PolarHBondContact O-N 3.13Å; E671-N675 PolarHBondContact O-ND2 3.08Å; E671-N675 VanDerWaalsContact O-ND2 3.1Å
672	Q	87.6	Confident	78.6	Confident	72 Å²	72	88.7 Å²	88.7	34%	0.336	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-39.2	173.3	-69.9	167.5	-21.8	0	0	111.7	L668 T669	L668-Q672 HydrophobicContact CB-CB 4.09Å; L668-Q672 HydrophobicContact CD2-CB 4.08Å; L668-Q672 HydrophobicContact CG-CB 4.17Å; T669-Q672 WeakPolarHBondContact O-CB 3.4Å; T669-Q672 PolarHBondContact O-N 2.84Å; T669-Q672 WeakPolarHBondContact OG1-CG 3.27Å; T669-Q672 PolarHBondContact OG1-N 3.07Å
673	I	89.8	Confident	79.2	Confident	6 Å²	6	86.3 Å²	86.3	3%	0.031	45%	0.446	C	S	.	.	H	α-helix	trans	-66.2	-48.9	175.1	-62.8	169.8	0	0	0	110.5	L668 T669 K670 E671 N675 L676 R708 D722 L725	L668-I673 HydrophobicContact CB-CD1 4.1Å; L668-I673 HydrophobicContact CB-CG1 3.58Å; L668-I673 HydrophobicContact CD2-CG1 4.29Å; T669-I673 WeakPolarHBondContact O-CG1 3.17Å; T669-I673 PolarHBondContact O-N 3.33Å; K670-I673 PolarHBondContact O-N 3.15Å; E671-I673 VanDerWaalsContact C-N 3.32Å; E671-I673 PolarHBondContact O-N 3.29Å; I673-N675 VanDerWaalsContact C-N 3.28Å; I673-N675 PolarHBondContact O-N 2.99Å; I673-L676 VanDerWaalsContact O-CB 3.26Å; I673-L676 WeakPolarHBondContact O-CB 3.45Å; I673-L676 WeakPolarHBondContact O-CG 3.22Å; I673-L676 PolarHBondContact O-N 3.25Å; I673-R708 PolarHBondContact O-NH1 2.93Å; I673-D722 HydrophobicContact CG2-CB 4.04Å; I673-D722 WeakPolarHBondContact CG2-OD1 3.14Å; I673-L725 HydrophobicContact CD1-CB 3.67Å; I673-L725 HydrophobicContact CG1-CB 3.82Å; I673-L725 HydrophobicContact CG1-CD1 4.43Å
674	D	88.8	Confident	79.4	Confident	73 Å²	73	83 Å²	83	39%	0.39	45%	0.449	S	S	.	.	H	α-helix	trans	-65.1	-29.8	-175.9	-83.6	-29.1	0	0	0	113.1	K670 E671 L676 R708	K670-D674 IonicContact NZ-OD2 3.36Å; K670-D674 PolarHBondContact NZ-OD2 3.12Å; K670-D674 WeakPolarHBondContact O-CB 3.4Å; K670-D674 PolarHBondContact O-N 3.29Å; E671-D674 PolarHBondContact O-N 3.16Å; D674-L676 PolarHBondContact O-N 3.49Å; D674-R708 PolarHBondContact O-NH1 2.97Å; D674-R708 IonicContact OD1-CZ 2.67Å; D674-R708 IonicContact OD1-NH2 3.44Å; D674-R708 PolarHBondContact OD1-NH2 2.85Å
675	N	89.9	Confident	79.9	Confident	141 Å²	141	77.1 Å²	77.1	75%	0.754	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.2	172.7	-75.2	-30.1	0	0	0	114.4	E671 I673	E671-N675 WeakPolarHBondContact O-CB 3.38Å; E671-N675 PolarHBondContact O-N 3.13Å; E671-N675 PolarHBondContact O-ND2 3.08Å; E671-N675 VanDerWaalsContact O-ND2 3.1Å; I673-N675 VanDerWaalsContact C-N 3.28Å; I673-N675 PolarHBondContact O-N 2.99Å
676	L	90	Very high	79.9	Confident	21 Å²	21	78.2 Å²	78.2	11%	0.11	42%	0.423	C	S	.	.	S	Bend	trans	-76	137	179.6	-60.5	169.5	0	0	0	111.7	I673 D674 T678 R708 L710 P711 L725 I738	I673-L676 VanDerWaalsContact O-CB 3.26Å; I673-L676 WeakPolarHBondContact O-CB 3.45Å; I673-L676 WeakPolarHBondContact O-CG 3.22Å; I673-L676 PolarHBondContact O-N 3.25Å; D674-L676 PolarHBondContact O-N 3.49Å; L676-T678 PolarHBondContact O-N 2.83Å; L676-T678 PolarHBondContact O-OG1 3.29Å; L676-R708 HydrophobicContact CB-CG 3.9Å; L676-R708 PolarHBondContact O-NH1 2.74Å; L676-L710 HydrophobicContact CD1-CD2 3.97Å; L676-P711 HydrophobicContact CD2-CG 4.32Å; L676-L725 HydrophobicContact CD1-CD1 3.71Å; L676-I738 HydrophobicContact CD1-CG2 3.79Å; L676-I738 HydrophobicContact CD2-CG2 3.78Å; L676-I738 HydrophobicContact CG-CG2 4.44Å
677	S	90.4	Very high	79.2	Confident	80 Å²	80	82.6 Å²	82.6	56%	0.559	45%	0.449	S	S	*	.			trans	-47.7	128.7	-174.9	-170.3	0	0	0	0	112.9	R708 R709	S677-R708 CarbonylContact O-C 3.55Å; S677-R708 WeakPolarHBondContact O-CA 3.33Å; S677-R708 WeakPolarHBondContact O-CG 3.38Å; S677-R709 PolarHBondContact O-N 3.36Å
678	T	91.9	Very high	77.8	Confident	72 Å²	72	85.1 Å²	85.1	44%	0.442	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.2	179.9	-63.5	0	0	0	0	110.3	L676 L707 R708 V718	L676-T678 PolarHBondContact O-N 2.83Å; L676-T678 PolarHBondContact O-OG1 3.29Å; T678-L707 CarbonylContact C-O 3.42Å; T678-L707 WeakPolarHBondContact CA-O 3.24Å; T678-R708 PolarHBondContact OG1-NH1 3.04Å; T678-V718 HydrophobicContact CG2-CG2 3.88Å
679	R	87.4	Confident	76.2	Confident	117 Å²	117	88.4 Å²	88.4	44%	0.442	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	144.5	-177.7	179.6	-179.5	177	-151.4	0.3	109.6	L707 E715	R679-L707 PolarHBondContact N-O 2.7Å; R679-L707 PolarHBondContact O-N 2.94Å; R679-L707 VanDerWaalsContact O-O 3.11Å; R679-E715 IonicContact NH1-OE1 2.71Å
680	T	88.8	Confident	74.2	Confident	90 Å²	90	94.4 Å²	94.4	55%	0.552	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.1	167.1	39.4	0	0	0	0	110.5	G682 N705 K706	T680-G682 PolarHBondContact O-N 3.04Å; T680-N705 CarbonylContact C-O 3.55Å; T680-N705 WeakPolarHBondContact CA-O 3.47Å; T680-K706 HydrophobicContact CG2-CG 4.34Å
681	Y	85.1	Confident	72.7	Confident	34 Å²	34	90.3 Å²	90.3	13%	0.133	52%	0.516	C	S	.	.			trans	-70.2	126.7	173	-168.1	-100	0	0	0	109.7	Y701 T702 G704 N705 L707	Y681-Y701 WeakPolarHBondContact CD1-O 3.44Å; Y681-Y701 HydrophobicContact CD2-CD2 4.4Å; Y681-Y701 HydrophobicContact CD2-CG 4.38Å; Y681-Y701 WeakPolarHBondContact CE1-O 3.35Å; Y681-Y701 HydrophobicContact CE2-CD2 4.43Å; Y681-T702 WeakPolarHBondContact CD1-O 3.45Å; Y681-G704 PolarHBondContact O-N 3.41Å; Y681-N705 PolarHBondContact N-O 3.29Å; Y681-L707 HydrophobicContact CD2-CD1 3.95Å; Y681-L707 HydrophobicContact CG-CD1 4.41Å
682	G	80.1	Confident	72.1	Confident	30 Å²	30	88.3 Å²	88.3	31%	0.309	50%	0.502	S	S	.	.			trans	-134.3	151.6	-165	0	0	0	0	0	113.5	T680 A684 S685	T680-G682 PolarHBondContact O-N 3.04Å; G682-A684 PolarHBondContact O-N 3.39Å; G682-A684 VanDerWaalsContact O-N 3.08Å; G682-S685 PolarHBondContact O-N 2.84Å; G682-S685 VanDerWaalsContact O-N 3.16Å
683	Q	56.4	Low	72.1	Confident	123 Å²	123	87.1 Å²	87.1	58%	0.575	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-60.5	-22.1	-171.7	-139.1	165.9	-8.6	0	0	114.3	S685 L686	Q683-S685 PolarHBondContact O-N 2.82Å; Q683-L686 HydrophobicContact CG-CD1 4.11Å
684	A	55.4	Low	72.2	Confident	108 Å²	108	86.9 Å²	86.9	89%	0.893	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-72.4	1	177.4	0	0	0	0	0	114.7	G682 L686	G682-A684 PolarHBondContact O-N 3.39Å; G682-A684 VanDerWaalsContact O-N 3.08Å; A684-L686 VanDerWaalsContact C-N 3.33Å
685	S	53.9	Low	72.3	Confident	23 Å²	23	86.6 Å²	86.6	16%	0.161	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-90.7	9.2	174.8	-137	0	0	0	0	113.6	G682 Q683	G682-S685 PolarHBondContact O-N 2.84Å; G682-S685 VanDerWaalsContact O-N 3.16Å; Q683-S685 PolarHBondContact O-N 2.82Å
686	L	51.5	Low	72.3	Confident	136 Å²	136	82.7 Å²	82.7	71%	0.712	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-10.1	-172.2	-85.8	168.4	0	0	0	115.4	Q683 A684 G688	Q683-L686 HydrophobicContact CG-CD1 4.11Å; A684-L686 VanDerWaalsContact C-N 3.33Å; L686-G688 PolarHBondContact O-N 2.91Å
687	E	50.4	Low	72.4	Confident	203 Å²	203	83.9 Å²	83.9	95%	0.949	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	83.6	168.5	-70.6	-172.1	124.2	0	0	110.3
688	G	49.9	Very low	72.4	Confident	73 Å²	73	87 Å²	87	75%	0.753	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.4	-19.7	160.7	0	0	0	0	0	117.5	L686	L686-G688 PolarHBondContact O-N 2.91Å
689	E	52.5	Low	72.2	Confident	79 Å²	79	88.7 Å²	88.7	37%	0.369	51%	0.512	S	S	.	.			trans	-115.1	66.1	-168.6	-63.5	-165.7	147.1	0	0	114.9	G691 R692	E689-G691 PolarHBondContact O-N 3.14Å; E689-R692 VanDerWaalsContact CD-NE 3.31Å; E689-R692 IonicContact OE1-CZ 2.73Å; E689-R692 IonicContact OE1-NE 3.93Å; E689-R692 PolarHBondContact OE1-NE 3.4Å; E689-R692 IonicContact OE1-NH2 2.87Å; E689-R692 PolarHBondContact OE1-NH2 3.46Å; E689-R692 IonicContact OE2-CZ 2.75Å; E689-R692 IonicContact OE2-NE 3.22Å; E689-R692 PolarHBondContact OE2-NE 3Å; E689-R692 IonicContact OE2-NH2 3.22Å; E689-R692 PolarHBondContact OE2-NH2 2.97Å
690	M	43.9	Very low	72.3	Confident	199 Å²	199	90.1 Å²	90.1	98%	0.98	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	121.6	160.1	-64.5	167.1	76.2	0	0	109
691	G	56.1	Low	72.3	Confident	65 Å²	65	86.6 Å²	86.6	67%	0.67	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.3	19	168.3	0	0	0	0	0	118.4	E689 A693	E689-G691 PolarHBondContact O-N 3.14Å; G691-A693 PolarHBondContact O-N 3.21Å
692	R	74.6	Confident	72.4	Confident	110 Å²	110	89.2 Å²	89.2	42%	0.415	52%	0.521	S	S	.	.			trans	-75.9	111.8	163.8	-68.8	-163.5	-175.8	-91.8	-3.4	110.6	E689 Y701	E689-R692 VanDerWaalsContact CD-NE 3.31Å; E689-R692 IonicContact OE1-CZ 2.73Å; E689-R692 IonicContact OE1-NE 3.93Å; E689-R692 PolarHBondContact OE1-NE 3.4Å; E689-R692 IonicContact OE1-NH2 2.87Å; E689-R692 PolarHBondContact OE1-NH2 3.46Å; E689-R692 IonicContact OE2-CZ 2.75Å; E689-R692 IonicContact OE2-NE 3.22Å; E689-R692 PolarHBondContact OE2-NE 3Å; E689-R692 IonicContact OE2-NH2 3.22Å; E689-R692 PolarHBondContact OE2-NH2 2.97Å; R692-Y701 HydrophobicContact CB-CD2 3.62Å; R692-Y701 HydrophobicContact CB-CE2 4.01Å; R692-Y701 WeakPolarHBondContact O-CD2 3.5Å; R692-Y701 PolarHBondContact O-N 2.99Å; R692-Y701 VanDerWaalsContact O-N 3.09Å
693	A	88.2	Confident	72.6	Confident	47 Å²	47	93.3 Å²	93.3	39%	0.388	53%	0.531	S	S	.	.	B	Isolated β-bridge	trans	-125.6	156.2	175.7	0	0	0	0	0	111.2	G691 N699 E700	G691-A693 PolarHBondContact O-N 3.21Å; A693-N699 WeakPolarHBondContact CA-O 3.49Å; A693-N699 WeakPolarHBondContact CB-O 3.31Å; A693-E700 HydrophobicContact CB-CG 4.43Å
694	C	91.7	Very high	73.9	Confident	0 Å²	0	90 Å²	90	0%	0	53%	0.53	C	S	.	.			trans	-82.7	114.4	176.8	-177.7	0	0	0	0	110.5	V696 C697 I698 N699 Y701 H717	C694-V696 PolarHBondContact O-N 2.95Å; C694-V696 VanDerWaalsContact O-N 3.08Å; C694-C697 VanDerWaalsContact CB-SG 3.57Å; C694-C697 PolarHBondContact O-N 3.27Å; C694-I698 VanDerWaalsContact O-CA 3.27Å; C694-I698 WeakPolarHBondContact O-CA 3.36Å; C694-I698 PolarHBondContact O-N 3.49Å; C694-N699 PolarHBondContact N-O 2.93Å; C694-Y701 WeakPolarHBondContact CA-OH 3.46Å; C694-Y701 HydrophobicContact CB-CE1 3.65Å; C694-H717 WeakPolarHBondContact CB-ND1 3.49Å
695	S	90.2	Very high	75.5	Confident	67 Å²	67	86.7 Å²	86.7	47%	0.469	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.7	-178.7	58.4	0	0	0	0	115	F716 I733	S695-F716 WeakPolarHBondContact OG-CE1 3.42Å; S695-I733 WeakPolarHBondContact OG-CG1 3.49Å
696	V	90.1	Very high	77.4	Confident	59 Å²	59	92 Å²	92	36%	0.358	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-33.6	177.9	176.5	0	0	0	0	112.6	C694 F716 C720 P732	C694-V696 PolarHBondContact O-N 2.95Å; C694-V696 VanDerWaalsContact O-N 3.08Å; V696-F716 HydrophobicContact CG2-CD1 3.72Å; V696-F716 HydrophobicContact CG2-CE1 3.86Å; V696-C720 HydrophobicContact CB-CB 3.97Å; V696-C720 HydrophobicContact CG1-CB 3.79Å; V696-P732 HydrophobicContact CG2-CB 4.2Å; V696-P732 HydrophobicContact CG2-CG 3.99Å
697	C	92.3	Very high	79.3	Confident	46 Å²	46	85.6 Å²	85.6	31%	0.311	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-9	176.5	64.8	0	0	0	0	113.9	C694 N699 H717	C694-C697 VanDerWaalsContact CB-SG 3.57Å; C694-C697 PolarHBondContact O-N 3.27Å; C697-N699 PolarHBondContact O-N 3.23Å; C697-N699 PolarHBondContact O-OD1 3.31Å; C697-H717 PolarHBondContact SG-ND1 2.93Å; C697-H717 VanDerWaalsContact SG-ND1 3.43Å
698	I	89.9	Confident	81.4	Confident	147 Å²	147	76.2 Å²	76.2	75%	0.754	44%	0.44	S	S	*	.			trans	64.1	16.8	-179.3	-34.2	-178.6	0	0	0	113	C694	C694-I698 VanDerWaalsContact O-CA 3.27Å; C694-I698 WeakPolarHBondContact O-CA 3.36Å; C694-I698 PolarHBondContact O-N 3.49Å
699	N	88.8	Confident	83.4	Confident	106 Å²	106	78.3 Å²	78.3	57%	0.567	43%	0.426	S	S	*	.			trans	-97.1	143.4	175.4	-71.4	18.5	0	0	0	112.1	A693 C694 C697	A693-N699 WeakPolarHBondContact CA-O 3.49Å; A693-N699 WeakPolarHBondContact CB-O 3.31Å; C694-N699 PolarHBondContact N-O 2.93Å; C697-N699 PolarHBondContact O-N 3.23Å; C697-N699 PolarHBondContact O-OD1 3.31Å
700	E	89.7	Confident	85.3	Confident	147 Å²	147	74.8 Å²	74.8	69%	0.687	41%	0.409	S	S	*	.	B	Isolated β-bridge	trans	-63.8	157.3	172.9	-61.9	-177.5	161.9	0	0	113.2	A693 T702	A693-E700 HydrophobicContact CB-CG 4.43Å; E700-T702 PolarHBondContact O-N 3.17Å
701	Y	88.3	Confident	87.5	Confident	16 Å²	16	69.8 Å²	69.8	6%	0.063	39%	0.391	C	S	.	.			trans	-82.7	106.7	174.3	-62.9	-42.1	0	0	0	112.7	Y681 R692 C694 L707 E715 F716 H717	Y681-Y701 WeakPolarHBondContact CD1-O 3.44Å; Y681-Y701 HydrophobicContact CD2-CD2 4.4Å; Y681-Y701 HydrophobicContact CD2-CG 4.38Å; Y681-Y701 WeakPolarHBondContact CE1-O 3.35Å; Y681-Y701 HydrophobicContact CE2-CD2 4.43Å; R692-Y701 HydrophobicContact CB-CD2 3.62Å; R692-Y701 HydrophobicContact CB-CE2 4.01Å; R692-Y701 WeakPolarHBondContact O-CD2 3.5Å; R692-Y701 PolarHBondContact O-N 2.99Å; R692-Y701 VanDerWaalsContact O-N 3.09Å; C694-Y701 WeakPolarHBondContact CA-OH 3.46Å; C694-Y701 HydrophobicContact CB-CE1 3.65Å; Y701-L707 HydrophobicContact CD1-CD1 4.01Å; Y701-L707 HydrophobicContact CD1-CD2 3.41Å; Y701-L707 VanDerWaalsContact CD1-CD2 3.41Å; Y701-L707 HydrophobicContact CD1-CG 4.36Å; Y701-L707 HydrophobicContact CD2-CD1 3.69Å; Y701-L707 HydrophobicContact CE1-CD1 4.06Å; Y701-L707 HydrophobicContact CE1-CD2 3.29Å; Y701-L707 HydrophobicContact CE1-CG 4.32Å; Y701-L707 HydrophobicContact CE2-CD1 3.78Å; Y701-L707 HydrophobicContact CG-CD1 3.84Å; Y701-L707 HydrophobicContact CG-CD2 4.09Å; Y701-E715 PolarHBondContact OH-O 3.39Å; Y701-F716 WeakPolarHBondContact OH-CA 3.32Å; Y701-F716 PolarHBondContact OH-N 2.83Å; Y701-H717 AromaticContact CD1-CE1 3.7Å; Y701-H717 AromaticContact CD1-NE2 3.56Å; Y701-H717 AromaticContact CE1-CE1 3.65Å; Y701-H717 AromaticContact CE1-ND1 3.83Å; Y701-H717 AromaticContact CE1-NE2 3.83Å
702	T	85.7	Confident	89.1	Confident	90 Å²	90	67.7 Å²	67.7	55%	0.552	37%	0.366	S	S	*	.			trans	-80.8	153.4	165.7	58.2	0	0	0	0	112.5	Y681 E700 N705	Y681-T702 WeakPolarHBondContact CD1-O 3.45Å; E700-T702 PolarHBondContact O-N 3.17Å; T702-N705 PolarHBondContact N-ND2 2.81Å; T702-N705 VanDerWaalsContact O-CB 3.31Å; T702-N705 WeakPolarHBondContact O-CB 3.37Å; T702-N705 PolarHBondContact O-N 3.27Å; T702-N705 PolarHBondContact O-ND2 2.97Å; T702-N705 PolarHBondContact OG1-ND2 2.9Å
703	Q	84.6	Confident	89.8	Confident	115 Å²	115	65.7 Å²	65.7	54%	0.537	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	137.1	177.7	-179.4	172.6	-5.2	0	0	112.1	N705	Q703-N705 VanDerWaalsContact C-N 3.32Å
704	G	84.6	Confident	89.9	Confident	53 Å²	53	65.9 Å²	65.9	55%	0.546	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	-9.1	-177	0	0	0	0	0	114.7	Y681 K706	Y681-G704 PolarHBondContact O-N 3.41Å; G704-K706 PolarHBondContact O-N 3.08Å
705	N	89.7	Confident	89.9	Confident	39 Å²	39	67.1 Å²	67.1	21%	0.209	37%	0.368	C	S	.	.			trans	-58.6	133.6	173.2	-83.6	-35.9	0	0	0	111.4	T680 Y681 T702 Q703 L707 H717	T680-N705 CarbonylContact C-O 3.55Å; T680-N705 WeakPolarHBondContact CA-O 3.47Å; Y681-N705 PolarHBondContact N-O 3.29Å; T702-N705 PolarHBondContact N-ND2 2.81Å; T702-N705 VanDerWaalsContact O-CB 3.31Å; T702-N705 WeakPolarHBondContact O-CB 3.37Å; T702-N705 PolarHBondContact O-N 3.27Å; T702-N705 PolarHBondContact O-ND2 2.97Å; T702-N705 PolarHBondContact OG1-ND2 2.9Å; Q703-N705 VanDerWaalsContact C-N 3.32Å; N705-L707 HydrophobicContact CB-CD2 4.02Å; N705-H717 PolarHBondContact ND2-NE2 3.07Å
706	K	92.6	Very high	90.1	Very high	135 Å²	135	63.9 Å²	63.9	59%	0.587	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	115.4	170.4	-62.5	-176.5	179.4	-177.3	0	108.8	T680 G704 V718	T680-K706 HydrophobicContact CG2-CG 4.34Å; G704-K706 PolarHBondContact O-N 3.08Å; K706-V718 HydrophobicContact CB-CB 4.46Å; K706-V718 HydrophobicContact CB-CG2 3.8Å; K706-V718 WeakPolarHBondContact O-CG2 3.42Å; K706-V718 PolarHBondContact O-N 2.89Å
707	L	92.8	Very high	90.3	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.4	177.5	-50.5	-171.6	0	0	0	109.6	T678 R679 Y681 Y701 N705 F716	T678-L707 CarbonylContact C-O 3.42Å; T678-L707 WeakPolarHBondContact CA-O 3.24Å; R679-L707 PolarHBondContact N-O 2.7Å; R679-L707 PolarHBondContact O-N 2.94Å; R679-L707 VanDerWaalsContact O-O 3.11Å; Y681-L707 HydrophobicContact CD2-CD1 3.95Å; Y681-L707 HydrophobicContact CG-CD1 4.41Å; Y701-L707 HydrophobicContact CD1-CD1 4.01Å; Y701-L707 HydrophobicContact CD1-CD2 3.41Å; Y701-L707 VanDerWaalsContact CD1-CD2 3.41Å; Y701-L707 HydrophobicContact CD1-CG 4.36Å; Y701-L707 HydrophobicContact CD2-CD1 3.69Å; Y701-L707 HydrophobicContact CE1-CD1 4.06Å; Y701-L707 HydrophobicContact CE1-CD2 3.29Å; Y701-L707 HydrophobicContact CE1-CG 4.32Å; Y701-L707 HydrophobicContact CE2-CD1 3.78Å; Y701-L707 HydrophobicContact CG-CD1 3.84Å; Y701-L707 HydrophobicContact CG-CD2 4.09Å; N705-L707 HydrophobicContact CB-CD2 4.02Å; L707-F716 CarbonylContact C-O 3.6Å; L707-F716 WeakPolarHBondContact CA-O 3.2Å
708	R	92.9	Very high	90.4	Very high	5 Å²	5	60.8 Å²	60.8	2%	0.019	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.8	169.5	-166.7	-178	-69.2	-82.7	22.5	108.3	I673 D674 L676 S677 T678 E715 F716 V718 I721 D722	I673-R708 PolarHBondContact O-NH1 2.93Å; D674-R708 PolarHBondContact O-NH1 2.97Å; D674-R708 IonicContact OD1-CZ 2.67Å; D674-R708 IonicContact OD1-NH2 3.44Å; D674-R708 PolarHBondContact OD1-NH2 2.85Å; L676-R708 HydrophobicContact CB-CG 3.9Å; L676-R708 PolarHBondContact O-NH1 2.74Å; S677-R708 CarbonylContact O-C 3.55Å; S677-R708 WeakPolarHBondContact O-CA 3.33Å; S677-R708 WeakPolarHBondContact O-CG 3.38Å; T678-R708 PolarHBondContact OG1-NH1 3.04Å; R708-E715 WeakPolarHBondContact O-CA 3.4Å; R708-F716 PolarHBondContact N-O 2.98Å; R708-F716 PolarHBondContact O-N 3.01Å; R708-V718 HydrophobicContact CB-CG2 4.03Å; R708-I721 HydrophobicContact CB-CG2 3.83Å; R708-I721 HydrophobicContact CG-CG2 4.48Å; R708-D722 WeakPolarHBondContact CD-OD1 3.09Å; R708-D722 IonicContact CZ-OD1 2.88Å; R708-D722 IonicContact CZ-OD2 3.47Å; R708-D722 IonicContact NE-OD1 3.8Å; R708-D722 PolarHBondContact NE-OD1 3.33Å; R708-D722 IonicContact NE-OD2 3.31Å; R708-D722 IonicContact NH2-OD1 3.27Å; R708-D722 PolarHBondContact NH2-OD1 2.93Å; R708-D722 IonicContact NH2-OD2 3.41Å; R708-D722 PolarHBondContact NH2-OD2 3.38Å
709	R	92.3	Very high	90.6	Very high	118 Å²	118	61.4 Å²	61.4	45%	0.445	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.7	179.6	-168.7	172.4	-171.9	-151.9	4.1	109.3	S677 S713 H714 E715	S677-R709 PolarHBondContact O-N 3.36Å; R709-S713 WeakPolarHBondContact CG-O 3.28Å; R709-S713 PolarHBondContact NE-O 2.9Å; R709-H714 WeakPolarHBondContact CA-O 3.43Å; R709-E715 HydrophobicContact CB-CG 3.94Å; R709-E715 HydrophobicContact CG-CG 3.71Å
710	L	92.4	Very high	90.9	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.026	31%	0.305	C	S	.	.			trans	-80.8	162	-180	-57.8	-177.3	0	0	0	111.1	L676 C712 S713 H714 F716 I721 L725 C731 I738	L676-L710 HydrophobicContact CD1-CD2 3.97Å; L710-C712 VanDerWaalsContact CB-SG 3.59Å; L710-C712 PolarHBondContact O-N 3.23Å; L710-S713 WeakPolarHBondContact O-CA 3.46Å; L710-S713 PolarHBondContact O-N 3.16Å; L710-H714 PolarHBondContact N-O 3.01Å; L710-F716 HydrophobicContact CD1-CD2 3.95Å; L710-F716 HydrophobicContact CD1-CE2 3.49Å; L710-F716 VanDerWaalsContact CD1-CE2 3.49Å; L710-F716 HydrophobicContact CD1-CZ 4.45Å; L710-F716 HydrophobicContact CG-CD2 4.22Å; L710-F716 HydrophobicContact CG-CE2 4.14Å; L710-I721 HydrophobicContact CD1-CD1 3.98Å; L710-I721 HydrophobicContact CD1-CG1 4.21Å; L710-I721 HydrophobicContact CD2-CG1 4.03Å; L710-I721 HydrophobicContact CG-CG1 4.48Å; L710-L725 HydrophobicContact CD2-CD1 4.01Å; L710-C731 HydrophobicContact CD1-CB 4Å; L710-I738 HydrophobicContact CB-CD1 4.22Å; L710-I738 HydrophobicContact CD1-CD1 3.82Å; L710-I738 HydrophobicContact CD2-CD1 4.31Å; L710-I738 HydrophobicContact CG-CD1 4.34Å
711	P	90	Very high	91.1	Very high	93 Å²	93	50.7 Å²	50.7	60%	0.604	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.5	178.3	-25.5	36.3	0	0	0	113	L676 S713 I738	L676-P711 HydrophobicContact CD2-CG 4.32Å; P711-S713 PolarHBondContact O-N 3.29Å; P711-I738 HydrophobicContact CG-CG2 4.37Å
712	C	90.1	Very high	91.3	Very high	22 Å²	22	51.5 Å²	51.5	15%	0.149	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	20.2	169.9	60.6	0	0	0	0	114.5	L710 H714 C734	L710-C712 VanDerWaalsContact CB-SG 3.59Å; L710-C712 PolarHBondContact O-N 3.23Å; C712-H714 PolarHBondContact O-N 3.19Å; C712-H714 PolarHBondContact O-ND1 2.81Å; C712-H714 PolarHBondContact SG-ND1 3.14Å; C712-H714 VanDerWaalsContact SG-ND1 3.42Å; C712-C734 VanDerWaalsContact CB-SG 3.59Å; C712-C734 VanDerWaalsContact SG-SG 3.62Å
713	S	88.7	Confident	91.7	Very high	67 Å²	67	55.3 Å²	55.3	47%	0.469	28%	0.282	S	S	.	.	S	Bend	trans	64.3	-14.4	179.6	81.5	0	0	0	0	118.7	R709 L710 P711	R709-S713 WeakPolarHBondContact CG-O 3.28Å; R709-S713 PolarHBondContact NE-O 2.9Å; L710-S713 WeakPolarHBondContact O-CA 3.46Å; L710-S713 PolarHBondContact O-N 3.16Å; P711-S713 PolarHBondContact O-N 3.29Å
714	H	90.9	Very high	92.1	Very high	52 Å²	52	54.1 Å²	54.1	24%	0.241	27%	0.272	C	S	.	.			trans	-61.8	138.1	178.2	-65.3	100.6	0	0	0	113.1	R709 L710 C712 F716 I733	R709-H714 WeakPolarHBondContact CA-O 3.43Å; L710-H714 PolarHBondContact N-O 3.01Å; C712-H714 PolarHBondContact O-N 3.19Å; C712-H714 PolarHBondContact O-ND1 2.81Å; C712-H714 PolarHBondContact SG-ND1 3.14Å; C712-H714 VanDerWaalsContact SG-ND1 3.42Å; H714-F716 HydrophobicContact CB-CE2 3.68Å; H714-F716 HydrophobicContact CB-CZ 4.23Å; H714-I733 HydrophobicContact CB-CD1 4.29Å; H714-I733 WeakPolarHBondContact NE2-CG2 3.35Å
715	E	92.4	Very high	92.4	Very high	25 Å²	25	51.6 Å²	51.6	12%	0.117	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.7	-178.1	-66	-176.3	154.3	0	0	111.3	R679 Y701 R708 R709	R679-E715 IonicContact NH1-OE1 2.71Å; Y701-E715 PolarHBondContact OH-O 3.39Å; R708-E715 WeakPolarHBondContact O-CA 3.4Å; R709-E715 HydrophobicContact CB-CG 3.94Å; R709-E715 HydrophobicContact CG-CG 3.71Å
716	F	94.3	Very high	92.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156.6	-178.7	-59.7	-93.9	0	0	0	110.3	S695 V696 Y701 L707 R708 L710 H714 V718 I721 P732 I733	S695-F716 WeakPolarHBondContact OG-CE1 3.42Å; V696-F716 HydrophobicContact CG2-CD1 3.72Å; V696-F716 HydrophobicContact CG2-CE1 3.86Å; Y701-F716 WeakPolarHBondContact OH-CA 3.32Å; Y701-F716 PolarHBondContact OH-N 2.83Å; L707-F716 CarbonylContact C-O 3.6Å; L707-F716 WeakPolarHBondContact CA-O 3.2Å; R708-F716 PolarHBondContact N-O 2.98Å; R708-F716 PolarHBondContact O-N 3.01Å; L710-F716 HydrophobicContact CD1-CD2 3.95Å; L710-F716 HydrophobicContact CD1-CE2 3.49Å; L710-F716 VanDerWaalsContact CD1-CE2 3.49Å; L710-F716 HydrophobicContact CD1-CZ 4.45Å; L710-F716 HydrophobicContact CG-CD2 4.22Å; L710-F716 HydrophobicContact CG-CE2 4.14Å; H714-F716 HydrophobicContact CB-CE2 3.68Å; H714-F716 HydrophobicContact CB-CZ 4.23Å; F716-V718 PolarHBondContact O-N 2.8Å; F716-I721 HydrophobicContact CB-CB 3.63Å; F716-I721 HydrophobicContact CB-CG1 4.3Å; F716-I721 HydrophobicContact CB-CG2 3.84Å; F716-I721 HydrophobicContact CD2-CB 4.31Å; F716-I721 HydrophobicContact CD2-CD1 4.04Å; F716-I721 HydrophobicContact CD2-CG1 4.04Å; F716-I721 HydrophobicContact CE2-CD1 4.23Å; F716-I721 HydrophobicContact CG-CB 4.01Å; F716-I721 HydrophobicContact CG-CD1 4.2Å; F716-I721 HydrophobicContact CG-CG1 4.21Å; F716-P732 HydrophobicContact CE1-CB 3.93Å; F716-P732 HydrophobicContact CE1-CG 3.83Å; F716-P732 HydrophobicContact CZ-CB 4.03Å; F716-P732 HydrophobicContact CZ-CG 3.86Å; F716-I733 HydrophobicContact CE1-CD1 3.95Å; F716-I733 HydrophobicContact CE1-CG1 4.17Å; F716-I733 HydrophobicContact CE2-CD1 4.48Å; F716-I733 HydrophobicContact CZ-CD1 3.61Å; F716-I733 HydrophobicContact CZ-CG1 3.83Å
717	H	94.4	Very high	92.1	Very high	24 Å²	24	52.2 Å²	52.2	11%	0.111	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	133	164.7	-64.4	107.9	0	0	0	110.3	C694 C697 Y701 N705 H719 C720 I721	C694-H717 WeakPolarHBondContact CB-ND1 3.49Å; C697-H717 PolarHBondContact SG-ND1 2.93Å; C697-H717 VanDerWaalsContact SG-ND1 3.43Å; Y701-H717 AromaticContact CD1-CE1 3.7Å; Y701-H717 AromaticContact CD1-NE2 3.56Å; Y701-H717 AromaticContact CE1-CE1 3.65Å; Y701-H717 AromaticContact CE1-ND1 3.83Å; Y701-H717 AromaticContact CE1-NE2 3.83Å; N705-H717 PolarHBondContact ND2-NE2 3.07Å; H717-H719 VanDerWaalsContact C-N 3.34Å; H717-H719 PolarHBondContact O-N 2.99Å; H717-C720 HydrophobicContact CB-CB 4.15Å; H717-C720 WeakPolarHBondContact O-CB 3.29Å; H717-C720 PolarHBondContact O-N 2.96Å; H717-I721 PolarHBondContact O-N 2.84Å; H717-I721 VanDerWaalsContact O-N 3.11Å
718	V	94.4	Very high	91.8	Very high	16 Å²	16	54.6 Å²	54.6	10%	0.097	27%	0.27	C	S	.	.	H	α-helix	trans	-46	-55.5	179.3	170.3	0	0	0	0	111.2	T678 K706 R708 F716 C720 I721 D722	T678-V718 HydrophobicContact CG2-CG2 3.88Å; K706-V718 HydrophobicContact CB-CB 4.46Å; K706-V718 HydrophobicContact CB-CG2 3.8Å; K706-V718 WeakPolarHBondContact O-CG2 3.42Å; K706-V718 PolarHBondContact O-N 2.89Å; R708-V718 HydrophobicContact CB-CG2 4.03Å; F716-V718 PolarHBondContact O-N 2.8Å; V718-C720 PolarHBondContact O-N 2.8Å; V718-C720 VanDerWaalsContact O-N 3.09Å; V718-I721 PolarHBondContact O-N 2.89Å; V718-D722 WeakPolarHBondContact CG1-OD2 3.41Å; V718-D722 VanDerWaalsContact O-CB 3.26Å; V718-D722 WeakPolarHBondContact O-CB 3.44Å; V718-D722 PolarHBondContact O-N 2.83Å
719	H	93.4	Very high	91.6	Very high	160 Å²	160	58.1 Å²	58.1	74%	0.741	29%	0.289	S	S	*	.	H	α-helix	trans	-63.2	-20.5	-178	-56.8	-48.6	0	0	0	115.3	H717	H717-H719 VanDerWaalsContact C-N 3.34Å; H717-H719 PolarHBondContact O-N 2.99Å
720	C	94.3	Very high	91.6	Very high	28 Å²	28	54.2 Å²	54.2	19%	0.189	28%	0.279	C	S	.	.	H	α-helix	trans	-84.4	-46.3	177.7	-66.1	0	0	0	0	111.4	V696 H717 V718 W724	V696-C720 HydrophobicContact CB-CB 3.97Å; V696-C720 HydrophobicContact CG1-CB 3.79Å; H717-C720 HydrophobicContact CB-CB 4.15Å; H717-C720 WeakPolarHBondContact O-CB 3.29Å; H717-C720 PolarHBondContact O-N 2.96Å; V718-C720 PolarHBondContact O-N 2.8Å; V718-C720 VanDerWaalsContact O-N 3.09Å; C720-W724 PolarHBondContact O-N 3.14Å
721	I	94.1	Very high	91.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-80.2	-31.7	-178.1	-169.6	62	0	0	0	112.8	R708 L710 F716 H717 V718 R723 W724 L725 P732	R708-I721 HydrophobicContact CB-CG2 3.83Å; R708-I721 HydrophobicContact CG-CG2 4.48Å; L710-I721 HydrophobicContact CD1-CD1 3.98Å; L710-I721 HydrophobicContact CD1-CG1 4.21Å; L710-I721 HydrophobicContact CD2-CG1 4.03Å; L710-I721 HydrophobicContact CG-CG1 4.48Å; F716-I721 HydrophobicContact CB-CB 3.63Å; F716-I721 HydrophobicContact CB-CG1 4.3Å; F716-I721 HydrophobicContact CB-CG2 3.84Å; F716-I721 HydrophobicContact CD2-CB 4.31Å; F716-I721 HydrophobicContact CD2-CD1 4.04Å; F716-I721 HydrophobicContact CD2-CG1 4.04Å; F716-I721 HydrophobicContact CE2-CD1 4.23Å; F716-I721 HydrophobicContact CG-CB 4.01Å; F716-I721 HydrophobicContact CG-CD1 4.2Å; F716-I721 HydrophobicContact CG-CG1 4.21Å; H717-I721 PolarHBondContact O-N 2.84Å; H717-I721 VanDerWaalsContact O-N 3.11Å; V718-I721 PolarHBondContact O-N 2.89Å; I721-R723 VanDerWaalsContact C-N 3.27Å; I721-R723 PolarHBondContact O-N 3.41Å; I721-W724 HydrophobicContact CD1-CB 4.24Å; I721-W724 HydrophobicContact CD1-CG 4.3Å; I721-W724 PolarHBondContact O-N 3.25Å; I721-L725 HydrophobicContact CD1-CD1 4.38Å; I721-L725 HydrophobicContact CD1-CD2 4.5Å; I721-L725 HydrophobicContact CD1-CG 4.08Å; I721-L725 HydrophobicContact CG1-CD1 3.87Å; I721-L725 HydrophobicContact CG1-CG 4.02Å; I721-L725 WeakPolarHBondContact O-CB 3.46Å; I721-L725 WeakPolarHBondContact O-CG 3.44Å; I721-L725 PolarHBondContact O-N 3.14Å; I721-P732 HydrophobicContact CD1-CG 3.66Å
722	D	93.3	Very high	91.6	Very high	33 Å²	33	51.4 Å²	51.4	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-38.9	176.6	-68.3	14.2	0	0	0	111.1	I673 R708 V718 L725 S726	I673-D722 HydrophobicContact CG2-CB 4.04Å; I673-D722 WeakPolarHBondContact CG2-OD1 3.14Å; R708-D722 WeakPolarHBondContact CD-OD1 3.09Å; R708-D722 IonicContact CZ-OD1 2.88Å; R708-D722 IonicContact CZ-OD2 3.47Å; R708-D722 IonicContact NE-OD1 3.8Å; R708-D722 PolarHBondContact NE-OD1 3.33Å; R708-D722 IonicContact NE-OD2 3.31Å; R708-D722 IonicContact NH2-OD1 3.27Å; R708-D722 PolarHBondContact NH2-OD1 2.93Å; R708-D722 IonicContact NH2-OD2 3.41Å; R708-D722 PolarHBondContact NH2-OD2 3.38Å; V718-D722 WeakPolarHBondContact CG1-OD2 3.41Å; V718-D722 VanDerWaalsContact O-CB 3.26Å; V718-D722 WeakPolarHBondContact O-CB 3.44Å; V718-D722 PolarHBondContact O-N 2.83Å; D722-L725 PolarHBondContact O-N 2.99Å; D722-S726 PolarHBondContact O-N 2.98Å; D722-S726 PolarHBondContact O-OG 3.29Å
723	R	92.8	Very high	91.5	Very high	170 Å²	170	54.6 Å²	54.6	64%	0.642	28%	0.275	S	S	*	.	H	α-helix	trans	-67	-44.8	174.3	-178.6	177.6	175.7	-179.2	-2.2	111.9	I721 L725 S726 E727	I721-R723 VanDerWaalsContact C-N 3.27Å; I721-R723 PolarHBondContact O-N 3.41Å; R723-L725 VanDerWaalsContact C-N 3.3Å; R723-L725 PolarHBondContact O-N 2.75Å; R723-S726 PolarHBondContact O-N 3.36Å; R723-S726 PolarHBondContact O-OG 2.84Å; R723-E727 IonicContact NE-OE1 3.39Å
724	W	92.9	Very high	91.6	Very high	90 Å²	90	53.6 Å²	53.6	34%	0.341	27%	0.268	S	S	.	.	H	α-helix	trans	-59.1	-44.8	175.2	175	-88.6	0	0	0	111.1	C720 I721 S726 E727 N728 T730 P732	C720-W724 PolarHBondContact O-N 3.14Å; I721-W724 HydrophobicContact CD1-CB 4.24Å; I721-W724 HydrophobicContact CD1-CG 4.3Å; I721-W724 PolarHBondContact O-N 3.25Å; W724-S726 PolarHBondContact O-N 3.39Å; W724-E727 CarbonylContact O-C 3.51Å; W724-E727 PolarHBondContact O-N 3.18Å; W724-E727 VanDerWaalsContact O-N 3.08Å; W724-N728 HydrophobicContact CZ2-CB 4.27Å; W724-N728 WeakPolarHBondContact O-CB 3.47Å; W724-N728 PolarHBondContact O-N 3.41Å; W724-N728 PolarHBondContact O-ND2 3.49Å; W724-T730 PolarHBondContact NE1-O 3.23Å; W724-P732 HydrophobicContact CD2-CG 3.93Å; W724-P732 HydrophobicContact CG-CG 3.86Å
725	L	91.4	Very high	91.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-73.8	-21.6	-177.4	-67.5	178.2	0	0	0	114.2	G667 L668 I673 L676 L710 I721 D722 R723 E727 N728 I738	G667-L725 CarbonylContact C-O 3.6Å; G667-L725 VanDerWaalsContact CA-O 3.29Å; G667-L725 WeakPolarHBondContact CA-O 3.29Å; L668-L725 PolarHBondContact N-O 3.12Å; I673-L725 HydrophobicContact CD1-CB 3.67Å; I673-L725 HydrophobicContact CG1-CB 3.82Å; I673-L725 HydrophobicContact CG1-CD1 4.43Å; L676-L725 HydrophobicContact CD1-CD1 3.71Å; L710-L725 HydrophobicContact CD2-CD1 4.01Å; I721-L725 HydrophobicContact CD1-CD1 4.38Å; I721-L725 HydrophobicContact CD1-CD2 4.5Å; I721-L725 HydrophobicContact CD1-CG 4.08Å; I721-L725 HydrophobicContact CG1-CD1 3.87Å; I721-L725 HydrophobicContact CG1-CG 4.02Å; I721-L725 WeakPolarHBondContact O-CB 3.46Å; I721-L725 WeakPolarHBondContact O-CG 3.44Å; I721-L725 PolarHBondContact O-N 3.14Å; D722-L725 PolarHBondContact O-N 2.99Å; R723-L725 VanDerWaalsContact C-N 3.3Å; R723-L725 PolarHBondContact O-N 2.75Å; L725-E727 PolarHBondContact O-N 3.07Å; L725-N728 CarbonylContact C-O 3.54Å; L725-N728 VanDerWaalsContact CA-O 3.24Å; L725-N728 WeakPolarHBondContact CA-O 3.45Å; L725-N728 VanDerWaalsContact O-O 3.08Å; L725-I738 HydrophobicContact CD2-CG1 3.69Å
726	S	89	Confident	91.1	Very high	67 Å²	67	64.7 Å²	64.7	47%	0.469	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-13.2	168.1	59.3	0	0	0	0	113.9	D722 R723 W724	D722-S726 PolarHBondContact O-N 2.98Å; D722-S726 PolarHBondContact O-OG 3.29Å; R723-S726 PolarHBondContact O-N 3.36Å; R723-S726 PolarHBondContact O-OG 2.84Å; W724-S726 PolarHBondContact O-N 3.39Å
727	E	86.8	Confident	90.8	Very high	120 Å²	120	68.8 Å²	68.8	56%	0.561	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-17.7	179.5	-64.1	174.1	-153.4	0	0	112.3	R723 W724 L725	R723-E727 IonicContact NE-OE1 3.39Å; W724-E727 CarbonylContact O-C 3.51Å; W724-E727 PolarHBondContact O-N 3.18Å; W724-E727 VanDerWaalsContact O-N 3.08Å; L725-E727 PolarHBondContact O-N 3.07Å
728	N	86.9	Confident	90.4	Very high	51 Å²	51	68 Å²	68	27%	0.273	33%	0.334	S	S	.	.			trans	-146	149.2	-172.8	-56	-103.2	0	0	0	111.6	R666 W724 L725	R666-N728 CarbonylContact O-C 3.57Å; W724-N728 HydrophobicContact CZ2-CB 4.27Å; W724-N728 WeakPolarHBondContact O-CB 3.47Å; W724-N728 PolarHBondContact O-N 3.41Å; W724-N728 PolarHBondContact O-ND2 3.49Å; L725-N728 CarbonylContact C-O 3.54Å; L725-N728 VanDerWaalsContact CA-O 3.24Å; L725-N728 WeakPolarHBondContact CA-O 3.45Å; L725-N728 VanDerWaalsContact O-O 3.08Å
729	N	89.3	Confident	89.6	Confident	80 Å²	80	71.1 Å²	71.1	43%	0.428	35%	0.35	S	S	.	.	S	Bend	trans	-99.1	11	176.8	66.9	4.4	0	0	0	115.5	R666 L668 P737 I738	R666-N729 PolarHBondContact O-N 3.27Å; R666-N729 VanDerWaalsContact O-N 3.09Å; L668-N729 HydrophobicContact CD1-CB 3.62Å; N729-P737 WeakPolarHBondContact O-CA 3.05Å; N729-I738 PolarHBondContact O-N 3.26Å
730	T	90.8	Very high	88	Confident	36 Å²	36	67.6 Å²	67.6	22%	0.221	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-121.4	159.5	-173.3	57.7	0	0	0	0	114.4	W724 R735 Q736	W724-T730 PolarHBondContact NE1-O 3.23Å; T730-R735 WeakPolarHBondContact CB-O 3.37Å; T730-R735 VanDerWaalsContact CG2-O 3.27Å; T730-R735 WeakPolarHBondContact CG2-O 3.33Å; T730-Q736 CarbonylContact C-O 3.55Å; T730-Q736 WeakPolarHBondContact CA-O 3.48Å
731	C	92.1	Very high	85.7	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.007	38%	0.375	C	S	.	.			trans	-72.5	130.9	174.7	176.8	0	0	0	0	112.7	L710 I733 C734 R735 Q736 I738	L710-C731 HydrophobicContact CD1-CB 4Å; C731-I733 PolarHBondContact O-N 3.23Å; C731-I733 VanDerWaalsContact O-N 3.08Å; C731-I733 PolarHBondContact SG-N 3Å; C731-I733 VanDerWaalsContact SG-N 3.44Å; C731-C734 VanDerWaalsContact CB-SG 3.58Å; C731-R735 WeakPolarHBondContact O-CA 3.31Å; C731-R735 PolarHBondContact O-N 3.36Å; C731-Q736 PolarHBondContact N-O 3.45Å; C731-I738 HydrophobicContact CB-CD1 3.95Å
732	P	90.8	Very high	82.8	Confident	38 Å²	38	78.3 Å²	78.3	25%	0.247	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.3	176.5	-25.7	31.8	0	0	0	116.2	V696 F716 I721 W724	V696-P732 HydrophobicContact CG2-CB 4.2Å; V696-P732 HydrophobicContact CG2-CG 3.99Å; F716-P732 HydrophobicContact CE1-CB 3.93Å; F716-P732 HydrophobicContact CE1-CG 3.83Å; F716-P732 HydrophobicContact CZ-CB 4.03Å; F716-P732 HydrophobicContact CZ-CG 3.86Å; I721-P732 HydrophobicContact CD1-CG 3.66Å; W724-P732 HydrophobicContact CD2-CG 3.93Å; W724-P732 HydrophobicContact CG-CG 3.86Å
733	I	89.1	Confident	79.9	Confident	88 Å²	88	85.8 Å²	85.8	45%	0.451	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-56.8	-175.5	-63.9	167.8	0	0	0	111.3	S695 H714 F716 C731	S695-I733 WeakPolarHBondContact OG-CG1 3.49Å; H714-I733 HydrophobicContact CB-CD1 4.29Å; H714-I733 WeakPolarHBondContact NE2-CG2 3.35Å; F716-I733 HydrophobicContact CE1-CD1 3.95Å; F716-I733 HydrophobicContact CE1-CG1 4.17Å; F716-I733 HydrophobicContact CE2-CD1 4.48Å; F716-I733 HydrophobicContact CZ-CD1 3.61Å; F716-I733 HydrophobicContact CZ-CG1 3.83Å; C731-I733 PolarHBondContact O-N 3.23Å; C731-I733 VanDerWaalsContact O-N 3.08Å; C731-I733 PolarHBondContact SG-N 3Å; C731-I733 VanDerWaalsContact SG-N 3.44Å
734	C	89.3	Confident	76.9	Confident	46 Å²	46	87.7 Å²	87.7	31%	0.311	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-1.2	-174.7	62.2	0	0	0	0	114.8	C712 C731 Q736	C712-C734 VanDerWaalsContact CB-SG 3.59Å; C712-C734 VanDerWaalsContact SG-SG 3.62Å; C731-C734 VanDerWaalsContact CB-SG 3.58Å; C734-Q736 HydrophobicContact CB-CG 4.33Å; C734-Q736 PolarHBondContact O-N 2.93Å; C734-Q736 PolarHBondContact SG-OE1 2.74Å
735	R	88.4	Confident	76.1	Confident	206 Å²	206	87.6 Å²	87.6	78%	0.777	47%	0.474	S	S	*	.			trans	56.7	3.1	-177.1	-57.9	-175.4	178.2	-163.9	-1.2	116.7	T730 C731	T730-R735 WeakPolarHBondContact CB-O 3.37Å; T730-R735 VanDerWaalsContact CG2-O 3.27Å; T730-R735 WeakPolarHBondContact CG2-O 3.33Å; C731-R735 WeakPolarHBondContact O-CA 3.31Å; C731-R735 PolarHBondContact O-N 3.36Å
736	Q	85.8	Confident	75.3	Confident	105 Å²	105	92.2 Å²	92.2	49%	0.491	50%	0.499	S	S	.	.			trans	-60.2	141.8	174.1	-65.1	177.3	-73.3	0	0	110.4	T730 C731 C734	T730-Q736 CarbonylContact C-O 3.55Å; T730-Q736 WeakPolarHBondContact CA-O 3.48Å; C731-Q736 PolarHBondContact N-O 3.45Å; C734-Q736 HydrophobicContact CB-CG 4.33Å; C734-Q736 PolarHBondContact O-N 2.93Å; C734-Q736 PolarHBondContact SG-OE1 2.74Å
737	P	87.2	Confident	74.5	Confident	85 Å²	85	93.6 Å²	93.6	55%	0.552	50%	0.5	S	S	*	.	B	Isolated β-bridge	trans	-65.4	145.8	174.6	29.5	-35.4	0	0	0	110.5	N729	N729-P737 WeakPolarHBondContact O-CA 3.05Å
738	I	85.4	Confident	73.8	Confident	9 Å²	9	92.1 Å²	92.1	5%	0.046	50%	0.497	C	S	.	.	S	Bend	trans	-84.6	-24.9	-177.4	-55.9	-48.2	0	0	0	112.1	L668 L676 L710 P711 L725 N729 C731	L668-I738 HydrophobicContact CD1-CB 4.5Å; L668-I738 HydrophobicContact CD2-CB 4.16Å; L668-I738 HydrophobicContact CD2-CG2 3.88Å; L676-I738 HydrophobicContact CD1-CG2 3.79Å; L676-I738 HydrophobicContact CD2-CG2 3.78Å; L676-I738 HydrophobicContact CG-CG2 4.44Å; L710-I738 HydrophobicContact CB-CD1 4.22Å; L710-I738 HydrophobicContact CD1-CD1 3.82Å; L710-I738 HydrophobicContact CD2-CD1 4.31Å; L710-I738 HydrophobicContact CG-CD1 4.34Å; P711-I738 HydrophobicContact CG-CG2 4.37Å; L725-I738 HydrophobicContact CD2-CG1 3.69Å; N729-I738 PolarHBondContact O-N 3.26Å; C731-I738 HydrophobicContact CB-CD1 3.95Å
739	L	79.4	Confident	73	Confident	80 Å²	80	94.6 Å²	94.6	42%	0.419	51%	0.511	S	S	.	.	S	Bend	trans	-104.9	129	169	-55.7	179.4	0	0	0	108.2	L668 A741	L668-L739 HydrophobicContact CD1-CG 4.49Å; L668-L739 HydrophobicContact CD2-CD2 4.23Å; L668-L739 HydrophobicContact CD2-CG 4.19Å; L668-L739 HydrophobicContact CG-CD1 4.13Å; L668-L739 HydrophobicContact CG-CG 4.21Å; L739-A741 PolarHBondContact O-N 3.08Å
740	A	59.4	Low	71.9	Confident	86 Å²	86	95.6 Å²	95.6	71%	0.711	52%	0.516	S	S	*	.			trans	-72.7	121.4	164.5	0	0	0	0	0	108.1	H742	A740-H742 PolarHBondContact O-N 3.17Å
741	A	45.1	Very low	70.6	Confident	92 Å²	92	99.9 Å²	99.9	76%	0.76	54%	0.537	S	S	*	.			trans	-69.4	113.5	169.5	0	0	0	0	0	108.3	L739 H743	L739-A741 PolarHBondContact O-N 3.08Å; A741-H743 PolarHBondContact O-N 2.86Å; A741-H743 VanDerWaalsContact O-N 3.16Å
742	H	33.5	Very low	68.9	Low	161 Å²	161	107.5 Å²	107.5	75%	0.745	58%	0.578	S	S	*	*			trans	-70.6	105.7	168.6	-85.8	-107.4	0	0	0	108.6	A740 D744	A740-H742 PolarHBondContact O-N 3.17Å; H742-D744 IonicContact ND1-OD2 3.9Å
743	H	33.4	Very low	67.1	Low	190 Å²	190	113.3 Å²	113.3	88%	0.88	61%	0.606	S	S	*	*			trans	-88.3	103.6	153.9	-94.3	-75.4	0	0	0	107.4	A741	A741-H743 PolarHBondContact O-N 2.86Å; A741-H743 VanDerWaalsContact O-N 3.16Å
744	D	29.2	Very low	65.1	Low	211 Å²	211	115.5 Å²	115.5	100%	1.128	62%	0.62	S	S	*	*			trans	-104.7	0	159.7	-76	-66.6	0	0	0	108.4	H742	H742-D744 IonicContact ND1-OD2 3.9Å

Retrieved 744 of 744 residues in 202 ms (Link to these results)

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