A0A087XES8_POEFO Loading...

Zinc finger and BTB domain containing 47

AlphaFold DB , UniProt , Accession A0A087XES8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 738 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	21.3	Very low	27.7	Very low	224 Å²	224	156.4 Å²	156.4	100%	1.103	82%	0.816	S	S	*	*				0	122.4	0	-176.9	175.9	78.1	0	0	107.4
2	L	23.3	Very low	28.9	Very low	166 Å²	166	155.8 Å²	155.8	87%	0.869	82%	0.824	S	S	*	*			trans	-108.5	125.6	178	-85.5	163.7	0	0	0	109.3
3	I	22.1	Very low	29.9	Very low	141 Å²	141	150.1 Å²	150.1	72%	0.723	81%	0.812	S	S	*	*			trans	-96.4	121.8	165.1	-62.8	175.5	0	0	0	105.9
4	V	23.8	Very low	30.5	Very low	127 Å²	127	151.9 Å²	151.9	77%	0.77	81%	0.813	S	S	*	*			trans	-96.8	98.3	177.5	-179.4	0	0	0	0	108.1
5	E	23.5	Very low	30.6	Very low	175 Å²	175	151.9 Å²	151.9	82%	0.818	80%	0.803	S	S	*	*			trans	-73	130.9	166.7	-82.1	-162.7	132.8	0	0	110.3	T7	E5-T7 PolarHBondContact O-N 2.83Å
6	K	32	Very low	31.1	Very low	187 Å²	187	148.5 Å²	148.5	81%	0.813	80%	0.796	S	S	*	*			trans	-99	80.2	-171.4	-160.9	-175.1	-169	-173.7	0	109.6	T8	K6-T8 PolarHBondContact O-N 3.42Å
7	T	27	Very low	31.3	Very low	134 Å²	134	147 Å²	147	82%	0.822	79%	0.787	S	S	*	*			trans	-69.7	109.7	167.8	53.5	0	0	0	0	108.8	E5	E5-T7 PolarHBondContact O-N 2.83Å
8	T	38.7	Very low	31.5	Very low	106 Å²	106	144.4 Å²	144.4	65%	0.65	78%	0.777	S	S	*	*			trans	-68.1	179.2	167.8	53.7	0	0	0	0	110.9	K6	K6-T8 PolarHBondContact O-N 3.42Å
9	D	33.4	Very low	31.7	Very low	139 Å²	139	145.3 Å²	145.3	74%	0.743	78%	0.775	S	S	*	*			trans	93.5	53.5	164.2	-47.2	-2.1	0	0	0	116.8
10	F	27.2	Very low	31.8	Very low	202 Å²	202	143.1 Å²	143.1	89%	0.886	76%	0.764	S	S	*	*	S	Bend	trans	-136.6	148.4	144	-92.5	-79.6	0	0	0	111
11	P	32.3	Very low	31.9	Very low	119 Å²	119	140.6 Å²	140.6	77%	0.773	75%	0.753	S	S	*	*			trans	-69.9	142.9	-173.8	-19.1	33.4	0	0	0	113.5	A13	P11-A13 PolarHBondContact O-N 3.17Å
12	T	42.6	Very low	32.6	Very low	150 Å²	150	132.4 Å²	132.4	92%	0.92	72%	0.721	S	S	*	*			trans	-81.8	94	-178.1	51.2	0	0	0	0	112.7
13	A	41.8	Very low	33.4	Very low	81 Å²	81	130.4 Å²	130.4	67%	0.669	71%	0.711	S	S	*	*			trans	-149.6	140.1	155.7	0	0	0	0	0	109.7	P11	P11-A13 PolarHBondContact O-N 3.17Å
14	E	37.6	Very low	34	Very low	175 Å²	175	130.9 Å²	130.9	82%	0.818	71%	0.71	S	S	*	*			trans	68	169.6	174.9	-53.7	-174	173.3	0	0	117.6
15	F	31.8	Very low	34.7	Very low	152 Å²	152	129.3 Å²	129.3	67%	0.667	69%	0.693	S	S	*	*			trans	75.2	69.2	178.5	-55.6	-69.4	0	0	0	120	L17 V18	F15-L17 PolarHBondContact O-N 2.99Å; F15-V18 HydrophobicContact CB-CG2 4.32Å
16	S	38.8	Very low	35.5	Very low	98 Å²	98	124.8 Å²	124.8	69%	0.685	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-13.3	159.6	-167.8	0	0	0	0	114.4	V18	S16-V18 PolarHBondContact O-N 3.25Å
17	L	35.1	Very low	36	Very low	123 Å²	123	119.2 Å²	119.2	64%	0.644	66%	0.661	S	S	*	*	H	α-helix	trans	-76.1	-18.7	-172.6	-89.8	101.5	0	0	0	115.2	F15 V21	F15-L17 PolarHBondContact O-N 2.99Å; L17-V21 WeakPolarHBondContact O-CB 3.34Å; L17-V21 VanDerWaalsContact O-CG2 3.29Å; L17-V21 WeakPolarHBondContact O-CG2 3.26Å; L17-V21 PolarHBondContact O-N 3.13Å; L17-V21 VanDerWaalsContact O-N 3.15Å
18	V	34.5	Very low	36.5	Very low	100 Å²	100	116.8 Å²	116.8	61%	0.606	64%	0.643	S	S	*	*	H	α-helix	trans	-74.1	-37.6	-171.4	-178.9	0	0	0	0	111.6	F15 S16 A22	F15-V18 HydrophobicContact CB-CG2 4.32Å; S16-V18 PolarHBondContact O-N 3.25Å; V18-A22 WeakPolarHBondContact O-CB 3.04Å; V18-A22 PolarHBondContact O-N 3.13Å
19	E	34.6	Very low	36.4	Very low	161 Å²	161	115.4 Å²	115.4	75%	0.752	63%	0.63	S	S	*	*	H	α-helix	trans	-70.6	-42.1	178.9	-60.5	-168.3	141.2	0	0	111.6	V21 A22 L23	E19-V21 PolarHBondContact O-N 3.29Å; E19-A22 PolarHBondContact O-N 3.26Å; E19-L23 WeakPolarHBondContact O-CB 3.4Å; E19-L23 PolarHBondContact O-N 3.43Å
20	D	34.4	Very low	36.6	Very low	102 Å²	102	112.9 Å²	112.9	55%	0.545	62%	0.616	S	S	.	*	H	α-helix	trans	-61.4	-43.6	174.8	-81.4	-31	0	0	0	112.2	L23 H24	D20-L23 PolarHBondContact O-N 2.83Å; D20-H24 WeakPolarHBondContact O-CB 3.44Å; D20-H24 PolarHBondContact O-N 3.08Å
21	V	34.7	Very low	37.2	Very low	90 Å²	90	110.6 Å²	110.6	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-66.5	-39.6	177.3	170.3	0	0	0	0	111.1	L17 E19 H24 F25	L17-V21 WeakPolarHBondContact O-CB 3.34Å; L17-V21 VanDerWaalsContact O-CG2 3.29Å; L17-V21 WeakPolarHBondContact O-CG2 3.26Å; L17-V21 PolarHBondContact O-N 3.13Å; L17-V21 VanDerWaalsContact O-N 3.15Å; E19-V21 PolarHBondContact O-N 3.29Å; V21-H24 PolarHBondContact O-N 3.16Å; V21-F25 VanDerWaalsContact O-CB 3.31Å; V21-F25 WeakPolarHBondContact O-CB 3.36Å; V21-F25 PolarHBondContact O-N 2.88Å
22	A	36.1	Very low	37.3	Very low	52 Å²	52	108.7 Å²	108.7	43%	0.43	59%	0.585	S	S	.	*	H	α-helix	trans	-61.8	-45.8	174	0	0	0	0	0	111.4	V18 E19 F25 T26	V18-A22 WeakPolarHBondContact O-CB 3.04Å; V18-A22 PolarHBondContact O-N 3.13Å; E19-A22 PolarHBondContact O-N 3.26Å; A22-F25 PolarHBondContact O-N 2.64Å; A22-T26 PolarHBondContact O-N 3.38Å; A22-T26 PolarHBondContact O-OG1 3.01Å
23	L	38.9	Very low	37	Very low	124 Å²	124	105.1 Å²	105.1	65%	0.649	56%	0.56	S	S	*	*	H	α-helix	trans	-63.4	-42.9	178.2	-165.8	73.2	0	0	0	112	E19 D20 T26 C27	E19-L23 WeakPolarHBondContact O-CB 3.4Å; E19-L23 PolarHBondContact O-N 3.43Å; D20-L23 PolarHBondContact O-N 2.83Å; L23-T26 PolarHBondContact O-N 3.45Å; L23-C27 WeakPolarHBondContact O-CB 3.47Å; L23-C27 PolarHBondContact O-N 3.36Å
24	H	35.8	Very low	37	Very low	151 Å²	151	107.6 Å²	107.6	70%	0.699	56%	0.558	S	S	*	*	H	α-helix	trans	-63.5	-40.5	175.2	-123.9	99	0	0	0	111.9	D20 V21 C27 L28	D20-H24 WeakPolarHBondContact O-CB 3.44Å; D20-H24 PolarHBondContact O-N 3.08Å; V21-H24 PolarHBondContact O-N 3.16Å; H24-C27 PolarHBondContact O-N 2.82Å; H24-L28 VanDerWaalsContact O-CB 3.28Å; H24-L28 WeakPolarHBondContact O-CB 3.31Å; H24-L28 PolarHBondContact O-N 2.84Å
25	F	37.2	Very low	37.1	Very low	95 Å²	95	105.7 Å²	105.7	42%	0.417	55%	0.549	S	S	.	.	H	α-helix	trans	-70.3	-38.9	179.2	-156	-86.4	0	0	0	111.7	V21 A22 L28 M29 F56	V21-F25 VanDerWaalsContact O-CB 3.31Å; V21-F25 WeakPolarHBondContact O-CB 3.36Å; V21-F25 PolarHBondContact O-N 2.88Å; A22-F25 PolarHBondContact O-N 2.64Å; F25-L28 PolarHBondContact O-N 3.46Å; F25-M29 HydrophobicContact CD1-CG 3.84Å; F25-M29 HydrophobicContact CE1-CG 3.76Å; F25-M29 HydrophobicContact CE1-SD 4.13Å; F25-M29 WeakPolarHBondContact O-CB 3.36Å; F25-M29 VanDerWaalsContact O-CG 3.28Å; F25-M29 WeakPolarHBondContact O-CG 3.39Å; F25-M29 PolarHBondContact O-N 3.12Å; F25-F56 HydrophobicContact CE2-CE1 4.38Å; F25-F56 HydrophobicContact CE2-CZ 4.47Å; F25-F56 HydrophobicContact CZ-CZ 4.34Å
26	T	41.6	Very low	37.2	Very low	79 Å²	79	106 Å²	106	49%	0.485	55%	0.546	S	S	.	.	H	α-helix	trans	-61.2	-50	171.8	-53.9	0	0	0	0	110.9	A22 L23 L28 M29 D30	A22-T26 PolarHBondContact O-N 3.38Å; A22-T26 PolarHBondContact O-OG1 3.01Å; L23-T26 PolarHBondContact O-N 3.45Å; T26-L28 VanDerWaalsContact C-N 3.29Å; T26-L28 PolarHBondContact O-N 3.03Å; T26-M29 PolarHBondContact O-N 3.14Å; T26-M29 VanDerWaalsContact O-N 3.12Å; T26-D30 PolarHBondContact O-N 3.3Å
27	C	41.5	Very low	37.1	Very low	71 Å²	71	108.2 Å²	108.2	48%	0.48	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-32.3	178	-172.2	0	0	0	0	113.2	L23 H24 R31	L23-C27 WeakPolarHBondContact O-CB 3.47Å; L23-C27 PolarHBondContact O-N 3.36Å; H24-C27 PolarHBondContact O-N 2.82Å; C27-R31 WeakPolarHBondContact O-CB 3.38Å; C27-R31 WeakPolarHBondContact O-CG 3.41Å; C27-R31 PolarHBondContact O-N 3.25Å; C27-R31 VanDerWaalsContact O-N 3.12Å
28	L	38	Very low	37.2	Very low	83 Å²	83	111.5 Å²	111.5	44%	0.435	56%	0.558	S	S	.	*	H	α-helix	trans	-68.5	-44.7	172.4	-171.9	74.3	0	0	0	111.5	H24 F25 T26 R31 L32	H24-L28 VanDerWaalsContact O-CB 3.28Å; H24-L28 WeakPolarHBondContact O-CB 3.31Å; H24-L28 PolarHBondContact O-N 2.84Å; F25-L28 PolarHBondContact O-N 3.46Å; T26-L28 VanDerWaalsContact C-N 3.29Å; T26-L28 PolarHBondContact O-N 3.03Å; L28-R31 PolarHBondContact O-N 3.26Å; L28-L32 HydrophobicContact CG-CD1 4.15Å; L28-L32 WeakPolarHBondContact O-CB 3.46Å; L28-L32 VanDerWaalsContact O-CG 3.28Å; L28-L32 WeakPolarHBondContact O-CG 3.27Å; L28-L32 PolarHBondContact O-N 2.98Å
29	M	36.3	Very low	37.2	Very low	76 Å²	76	113.9 Å²	113.9	37%	0.374	56%	0.563	S	S	.	*	H	α-helix	trans	-67.5	-37.7	178.3	-72.2	-60.4	-59.5	0	0	112.2	F25 T26 L32 N33	F25-M29 HydrophobicContact CD1-CG 3.84Å; F25-M29 HydrophobicContact CE1-CG 3.76Å; F25-M29 HydrophobicContact CE1-SD 4.13Å; F25-M29 WeakPolarHBondContact O-CB 3.36Å; F25-M29 VanDerWaalsContact O-CG 3.28Å; F25-M29 WeakPolarHBondContact O-CG 3.39Å; F25-M29 PolarHBondContact O-N 3.12Å; T26-M29 PolarHBondContact O-N 3.14Å; T26-M29 VanDerWaalsContact O-N 3.12Å; M29-L32 PolarHBondContact O-N 3.35Å; M29-L32 HydrophobicContact SD-CD1 4.35Å; M29-N33 WeakPolarHBondContact O-CB 3.42Å; M29-N33 VanDerWaalsContact O-CG 3.22Å; M29-N33 PolarHBondContact O-N 3.16Å; M29-N33 PolarHBondContact O-ND2 2.9Å
30	D	37.5	Very low	37.1	Very low	87 Å²	87	111.5 Å²	111.5	47%	0.465	56%	0.561	S	S	.	*	H	α-helix	trans	-62.9	-46.9	173.2	-72	-28.4	0	0	0	110.8	T26 L32 N33 E34	T26-D30 PolarHBondContact O-N 3.3Å; D30-L32 VanDerWaalsContact C-N 3.3Å; D30-L32 PolarHBondContact O-N 3.03Å; D30-N33 PolarHBondContact O-N 3.42Å; D30-N33 VanDerWaalsContact O-N 3.12Å; D30-E34 WeakPolarHBondContact O-CG 3.29Å; D30-E34 PolarHBondContact O-N 3.28Å
31	R	39.5	Very low	37	Very low	154 Å²	154	113.7 Å²	113.7	58%	0.581	57%	0.573	S	S	*	*	H	α-helix	trans	-60.2	-35.7	173.7	-77.2	177.3	59.3	-172.9	-4.3	113.6	C27 L28 Q35	C27-R31 WeakPolarHBondContact O-CB 3.38Å; C27-R31 WeakPolarHBondContact O-CG 3.41Å; C27-R31 PolarHBondContact O-N 3.25Å; C27-R31 VanDerWaalsContact O-N 3.12Å; L28-R31 PolarHBondContact O-N 3.26Å; R31-Q35 WeakPolarHBondContact O-CG 3.44Å; R31-Q35 PolarHBondContact O-N 3.36Å; R31-Q35 VanDerWaalsContact O-N 3.11Å
32	L	35.6	Very low	36.9	Very low	79 Å²	79	115.9 Å²	115.9	41%	0.414	58%	0.581	S	S	.	*	H	α-helix	trans	-74.1	-30	176.1	-73	168.1	0	0	0	112.4	L28 M29 D30 R36	L28-L32 HydrophobicContact CG-CD1 4.15Å; L28-L32 WeakPolarHBondContact O-CB 3.46Å; L28-L32 VanDerWaalsContact O-CG 3.28Å; L28-L32 WeakPolarHBondContact O-CG 3.27Å; L28-L32 PolarHBondContact O-N 2.98Å; M29-L32 PolarHBondContact O-N 3.35Å; M29-L32 HydrophobicContact SD-CD1 4.35Å; D30-L32 VanDerWaalsContact C-N 3.3Å; D30-L32 PolarHBondContact O-N 3.03Å; L32-R36 WeakPolarHBondContact O-CG 3.42Å; L32-R36 PolarHBondContact O-N 2.9Å
33	N	36.2	Very low	36.6	Very low	74 Å²	74	118.4 Å²	118.4	40%	0.396	59%	0.594	S	S	.	*	H	α-helix	trans	-73.1	-42.3	171.6	-71.8	-29.4	0	0	0	111.4	M29 D30 Q35 R36 L37	M29-N33 WeakPolarHBondContact O-CB 3.42Å; M29-N33 VanDerWaalsContact O-CG 3.22Å; M29-N33 PolarHBondContact O-N 3.16Å; M29-N33 PolarHBondContact O-ND2 2.9Å; D30-N33 PolarHBondContact O-N 3.42Å; D30-N33 VanDerWaalsContact O-N 3.12Å; N33-Q35 VanDerWaalsContact C-N 3.29Å; N33-Q35 PolarHBondContact O-N 3.05Å; N33-R36 PolarHBondContact O-N 3.23Å; N33-L37 PolarHBondContact O-N 3.07Å
34	E	41.8	Very low	36.1	Very low	134 Å²	134	120 Å²	120	63%	0.626	60%	0.604	S	S	*	*	H	α-helix	trans	-55.9	-42.6	172	-74.4	-179	157.1	0	0	111.6	D30 R36	D30-E34 WeakPolarHBondContact O-CG 3.29Å; D30-E34 PolarHBondContact O-N 3.28Å; E34-R36 VanDerWaalsContact C-N 3.31Å; E34-R36 PolarHBondContact O-N 3.12Å
35	Q	39.6	Very low	35.7	Very low	135 Å²	135	118.4 Å²	118.4	63%	0.631	60%	0.604	S	S	*	*	H	α-helix	trans	-74.1	-14.8	176.1	-73	-169.9	-46.9	0	0	114.5	R31 N33	R31-Q35 WeakPolarHBondContact O-CG 3.44Å; R31-Q35 PolarHBondContact O-N 3.36Å; R31-Q35 VanDerWaalsContact O-N 3.11Å; N33-Q35 VanDerWaalsContact C-N 3.29Å; N33-Q35 PolarHBondContact O-N 3.05Å
36	R	33.3	Very low	35.1	Very low	159 Å²	159	121.4 Å²	121.4	60%	0.6	62%	0.624	S	S	*	*	H	α-helix	trans	-86.2	-16.5	177.6	-86.9	175.2	163.2	-170.9	-8.6	114.5	L32 N33 E34 F38 Q39	L32-R36 WeakPolarHBondContact O-CG 3.42Å; L32-R36 PolarHBondContact O-N 2.9Å; N33-R36 PolarHBondContact O-N 3.23Å; E34-R36 VanDerWaalsContact C-N 3.31Å; E34-R36 PolarHBondContact O-N 3.12Å; R36-F38 PolarHBondContact O-N 3.5Å; R36-Q39 PolarHBondContact O-N 3.21Å
37	L	36.7	Very low	34.2	Very low	144 Å²	144	125.2 Å²	125.2	75%	0.754	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	6.3	-175.2	-75.6	166.6	0	0	0	115.7	N33	N33-L37 PolarHBondContact O-N 3.07Å
38	F	36.7	Very low	33.4	Very low	192 Å²	192	127.7 Å²	127.7	84%	0.842	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	9.7	-177.5	-85.5	-83.1	0	0	0	115.4	R36	R36-F38 PolarHBondContact O-N 3.5Å
39	Q	35.6	Very low	32.7	Very low	150 Å²	150	131.8 Å²	131.8	70%	0.701	67%	0.674	S	S	*	*			trans	-134.9	117.7	170.4	-71.2	-168.6	-22.5	0	0	111.3	R36 D41	R36-Q39 PolarHBondContact O-N 3.21Å; Q39-D41 PolarHBondContact O-N 3.14Å
40	P	31.2	Very low	32.2	Very low	110 Å²	110	134.4 Å²	134.4	71%	0.714	69%	0.694	S	S	*	*	S	Bend	trans	-71.6	-26.5	-175	-21.8	34.4	0	0	0	115.8	L42	P40-L42 PolarHBondContact O-N 3.33Å
41	D	32.5	Very low	31.5	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	72%	0.716	S	S	*	*	S	Bend	trans	-95.7	25.4	-157	-55.5	-47.9	0	0	0	115.3	Q39	Q39-D41 PolarHBondContact O-N 3.14Å
42	L	32.6	Very low	31.1	Very low	136 Å²	136	143.6 Å²	143.6	71%	0.712	73%	0.731	S	S	*	*			trans	-126	59.3	179.5	-75.5	173.9	0	0	0	112.7	P40	P40-L42 PolarHBondContact O-N 3.33Å
43	C	29.5	Very low	30.8	Very low	104 Å²	104	151.2 Å²	151.2	70%	0.703	75%	0.754	S	S	*	*			trans	-75.7	172.1	165.5	-71.2	0	0	0	0	112.7
44	D	29.9	Very low	30.4	Very low	159 Å²	159	152.6 Å²	152.6	85%	0.85	77%	0.769	S	S	*	*			trans	67.1	86.2	169.8	-55.5	-9.8	0	0	0	116.9
45	V	27.1	Very low	29.9	Very low	117 Å²	117	152.4 Å²	152.4	71%	0.709	78%	0.777	S	S	*	*			trans	-132.9	103.8	159.4	-177.4	0	0	0	0	109.6
46	D	23.7	Very low	29.3	Very low	157 Å²	157	154.6 Å²	154.6	84%	0.84	79%	0.785	S	S	*	*			trans	-66.4	137.6	170.9	-88.3	-46	0	0	0	111.9	V48	D46-V48 PolarHBondContact O-N 2.98Å
47	I	23.4	Very low	29.7	Very low	160 Å²	160	149.8 Å²	149.8	82%	0.821	77%	0.774	S	S	*	*			trans	-88.7	101.5	-177.3	-57.1	177.7	0	0	0	110.2
48	V	25.3	Very low	29.6	Very low	122 Å²	122	146.7 Å²	146.7	74%	0.739	77%	0.769	S	S	*	*			trans	-88.1	113.5	174.2	-178	0	0	0	0	110.8	D46 V50	D46-V48 PolarHBondContact O-N 2.98Å; V48-V50 PolarHBondContact O-N 2.91Å
49	L	22.6	Very low	29.6	Very low	170 Å²	170	142.2 Å²	142.2	89%	0.89	75%	0.751	S	S	*	*			trans	-70	121.9	173.5	-81.1	159.8	0	0	0	111.5
50	V	26.1	Very low	29.8	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	74%	0.738	S	S	*	*			trans	-110.5	118.9	174.4	-178.2	0	0	0	0	109.6	V48	V48-V50 PolarHBondContact O-N 2.91Å
51	R	23.3	Very low	30.1	Very low	244 Å²	244	137.1 Å²	137.1	92%	0.921	73%	0.73	S	S	*	*			trans	-69.2	147.1	173.8	-86.3	-179.1	165.3	170.4	-5.1	111.1
52	Q	31.4	Very low	30.3	Very low	190 Å²	190	133.1 Å²	133.1	89%	0.888	71%	0.711	S	S	*	*			trans	-55.2	133.5	-172.5	-66	174.2	-19.6	0	0	114.4
53	R	27.6	Very low	30.6	Very low	239 Å²	239	129 Å²	129	90%	0.902	69%	0.689	S	S	*	*				-167.1	152.1	118.7	-99.7	160.9	-173.3	-166	0.8	109.6
54	S	28.8	Very low	31.3	Very low	102 Å²	102	125 Å²	125	71%	0.713	66%	0.663	S	S	*	*	S	Bend	trans	54.9	104.1	179.7	55	0	0	0	0	117.9
55	T	31.9	Very low	31.7	Very low	130 Å²	130	120.9 Å²	120.9	80%	0.798	65%	0.652	S	S	*	*			trans	34	111.8	143.1	54	0	0	0	0	119.5	P57	T55-P57 WeakPolarHBondContact O-CD 3.38Å
56	F	27	Very low	32.2	Very low	181 Å²	181	124.8 Å²	124.8	79%	0.794	66%	0.655	S	S	*	*			trans	-63.3	120.4	171.9	-137.8	-91.9	0	0	0	111.7	F25 A58	F25-F56 HydrophobicContact CE2-CE1 4.38Å; F25-F56 HydrophobicContact CE2-CZ 4.47Å; F25-F56 HydrophobicContact CZ-CZ 4.34Å; F56-A58 PolarHBondContact O-N 2.77Å
57	P	41.6	Very low	33	Very low	59 Å²	59	117.8 Å²	117.8	38%	0.383	62%	0.618	S	S	.	*			trans	-97.8	92.7	-174.9	26.4	-15.7	0	0	0	112.8	T55 H59 K60	T55-P57 WeakPolarHBondContact O-CD 3.38Å; P57-H59 WeakPolarHBondContact CB-CE1 3.39Å; P57-H59 PolarHBondContact O-N 2.76Å; P57-H59 VanDerWaalsContact O-N 3.08Å; P57-K60 HydrophobicContact CG-CD 4.48Å; P57-K60 PolarHBondContact O-N 3.27Å
58	A	33.7	Very low	33.9	Very low	78 Å²	78	115.3 Å²	115.3	65%	0.645	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-24.9	176	0	0	0	0	0	113.9	F56 K60 G61 V62	F56-A58 PolarHBondContact O-N 2.77Å; A58-K60 PolarHBondContact O-N 3.21Å; A58-K60 VanDerWaalsContact O-N 3.13Å; A58-G61 PolarHBondContact O-N 3.44Å; A58-V62 PolarHBondContact O-N 3.44Å
59	H	37.7	Very low	34.9	Very low	98 Å²	98	113.3 Å²	113.3	45%	0.454	59%	0.594	S	S	.	*	H	α-helix	trans	-56.4	-28.8	178.7	62.8	-118	0	0	0	113.8	P57 L63	P57-H59 WeakPolarHBondContact CB-CE1 3.39Å; P57-H59 PolarHBondContact O-N 2.76Å; P57-H59 VanDerWaalsContact O-N 3.08Å; H59-L63 WeakPolarHBondContact O-CB 3.23Å; H59-L63 VanDerWaalsContact O-CG 3.3Å; H59-L63 WeakPolarHBondContact O-CG 3.42Å; H59-L63 PolarHBondContact O-N 3.43Å
60	K	39.3	Very low	36	Very low	101 Å²	101	106.1 Å²	106.1	44%	0.439	56%	0.556	S	S	.	*	H	α-helix	trans	-71.3	-36.2	-177	-62.3	-160.8	174.4	-163	0	113	P57 A58 A64	P57-K60 HydrophobicContact CG-CD 4.48Å; P57-K60 PolarHBondContact O-N 3.27Å; A58-K60 PolarHBondContact O-N 3.21Å; A58-K60 VanDerWaalsContact O-N 3.13Å; K60-A64 PolarHBondContact O-N 2.82Å
61	G	36.7	Very low	37.1	Very low	52 Å²	52	105.4 Å²	105.4	54%	0.536	54%	0.544	S	S	.	.	H	α-helix	trans	-70.9	-41.2	174.6	0	0	0	0	0	112.3	A58 A64 A65	A58-G61 PolarHBondContact O-N 3.44Å; G61-A64 PolarHBondContact O-N 3.39Å; G61-A65 PolarHBondContact O-N 3.08Å; G61-A65 VanDerWaalsContact O-N 3.11Å
62	V	38.3	Very low	38.3	Very low	65 Å²	65	97 Å²	97	39%	0.394	52%	0.522	S	S	.	.	H	α-helix	trans	-64	-45	178.8	179.2	0	0	0	0	111.5	A58 A64 A65 Y66	A58-V62 PolarHBondContact O-N 3.44Å; V62-A64 VanDerWaalsContact C-N 3.3Å; V62-A64 PolarHBondContact O-N 3.43Å; V62-A65 PolarHBondContact O-N 2.96Å; V62-Y66 HydrophobicContact CG1-CD2 4.19Å; V62-Y66 HydrophobicContact CG1-CE2 4.44Å; V62-Y66 WeakPolarHBondContact O-CD2 3.34Å; V62-Y66 PolarHBondContact O-N 2.79Å
63	L	38.6	Very low	39	Very low	51 Å²	51	91 Å²	91	27%	0.267	50%	0.495	S	S	.	.	H	α-helix	trans	-65	-31.4	178	-70.7	169.6	0	0	0	113.2	H59	H59-L63 WeakPolarHBondContact O-CB 3.23Å; H59-L63 VanDerWaalsContact O-CG 3.3Å; H59-L63 WeakPolarHBondContact O-CG 3.42Å; H59-L63 PolarHBondContact O-N 3.43Å
64	A	43.6	Very low	40	Very low	18 Å²	18	83.5 Å²	83.5	15%	0.149	47%	0.47	C	S	.	.	H	α-helix	trans	-71	-35.3	174.3	0	0	0	0	0	112.8	K60 G61 V62 F74	K60-A64 PolarHBondContact O-N 2.82Å; G61-A64 PolarHBondContact O-N 3.39Å; V62-A64 VanDerWaalsContact C-N 3.3Å; V62-A64 PolarHBondContact O-N 3.43Å; A64-F74 HydrophobicContact CB-CD2 3.74Å; A64-F74 HydrophobicContact CB-CE2 3.81Å
65	A	38.5	Very low	41.1	Very low	74 Å²	74	81.8 Å²	81.8	61%	0.612	46%	0.462	S	S	*	.	H	α-helix	trans	-71.9	-28.4	-178.2	0	0	0	0	0	113.8	G61 V62	G61-A65 PolarHBondContact O-N 3.08Å; G61-A65 VanDerWaalsContact O-N 3.11Å; V62-A65 PolarHBondContact O-N 2.96Å
66	Y	36.3	Very low	41.8	Very low	198 Å²	198	83.4 Å²	83.4	78%	0.776	46%	0.46	S	S	*	.	H	α-helix	trans	-105.3	-2	-173.2	-79.2	-84	0	0	0	115.4	V62	V62-Y66 HydrophobicContact CG1-CD2 4.19Å; V62-Y66 HydrophobicContact CG1-CE2 4.44Å; V62-Y66 WeakPolarHBondContact O-CD2 3.34Å; V62-Y66 PolarHBondContact O-N 2.79Å
67	S	41.4	Very low	42.7	Very low	10 Å²	10	77 Å²	77	7%	0.07	44%	0.438	C	S	.	.			trans	-136.8	117	-176.7	-170.8	0	0	0	0	112.8	F69 F70 H71 Q97	S67-F69 PolarHBondContact O-N 2.81Å; S67-F69 VanDerWaalsContact O-N 3.13Å; S67-F70 PolarHBondContact O-N 2.8Å; S67-H71 PolarHBondContact O-N 3.03Å; S67-Q97 PolarHBondContact OG-OE1 2.61Å
68	P	42.8	Very low	42.8	Very low	108 Å²	108	83.8 Å²	83.8	70%	0.701	46%	0.462	S	S	*	.	H	α-helix	trans	-57.1	-28.5	179	-27.1	35.3	0	0	0	114.3	H71 S72	P68-H71 PolarHBondContact O-N 3.39Å; P68-S72 WeakPolarHBondContact O-CB 3.39Å; P68-S72 PolarHBondContact O-N 2.82Å
69	F	45	Very low	43	Very low	81 Å²	81	86.8 Å²	86.8	36%	0.355	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-54.4	176.5	174.4	-102.4	0	0	0	111.6	S67 H71 S72 L73	S67-F69 PolarHBondContact O-N 2.81Å; S67-F69 VanDerWaalsContact O-N 3.13Å; F69-H71 VanDerWaalsContact C-N 3.34Å; F69-H71 PolarHBondContact O-N 3.02Å; F69-S72 PolarHBondContact O-N 3.18Å; F69-L73 HydrophobicContact CD1-CD1 4.36Å; F69-L73 HydrophobicContact CE1-CD1 3.77Å; F69-L73 HydrophobicContact CE2-CD1 4.35Å; F69-L73 HydrophobicContact CZ-CD1 3.77Å; F69-L73 PolarHBondContact O-N 3.25Å; F69-L73 VanDerWaalsContact O-N 3.15Å
70	F	47.3	Very low	42.8	Very low	19 Å²	19	89.5 Å²	89.5	8%	0.083	48%	0.479	C	S	.	.	H	α-helix	trans	-67.4	-36.7	177.6	-69.1	-64	0	0	0	111.6	S67 S72 L73 F74 L85	S67-F70 PolarHBondContact O-N 2.8Å; F70-S72 VanDerWaalsContact C-N 3.29Å; F70-S72 PolarHBondContact O-N 3.3Å; F70-L73 PolarHBondContact O-N 2.6Å; F70-F74 VanDerWaalsContact O-CD2 3.26Å; F70-F74 WeakPolarHBondContact O-CD2 3.22Å; F70-F74 PolarHBondContact O-N 3.05Å; F70-L85 HydrophobicContact CE1-CD1 4.28Å
71	H	48.1	Very low	42.4	Very low	116 Å²	116	94.2 Å²	94.2	54%	0.537	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-34.9	176.9	-155.3	-53.4	0	0	0	112.9	S67 P68 F69 A75	S67-H71 PolarHBondContact O-N 3.03Å; P68-H71 PolarHBondContact O-N 3.39Å; F69-H71 VanDerWaalsContact C-N 3.34Å; F69-H71 PolarHBondContact O-N 3.02Å; H71-A75 WeakPolarHBondContact O-CB 3.13Å; H71-A75 PolarHBondContact O-N 3.31Å; H71-A75 VanDerWaalsContact O-N 3.15Å
72	S	48.7	Very low	42	Very low	66 Å²	66	101.3 Å²	101.3	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-71	-43.9	173.4	-171.7	0	0	0	0	112.2	P68 F69 F70 F74 A75 Q76	P68-S72 WeakPolarHBondContact O-CB 3.39Å; P68-S72 PolarHBondContact O-N 2.82Å; F69-S72 PolarHBondContact O-N 3.18Å; F70-S72 VanDerWaalsContact C-N 3.29Å; F70-S72 PolarHBondContact O-N 3.3Å; S72-F74 PolarHBondContact O-N 2.82Å; S72-A75 PolarHBondContact O-N 2.83Å; S72-A75 VanDerWaalsContact O-N 3.12Å; S72-Q76 PolarHBondContact O-N 2.8Å
73	L	46.2	Very low	41.7	Very low	64 Å²	64	101.8 Å²	101.8	34%	0.335	51%	0.508	S	S	.	.	H	α-helix	trans	-59.2	-42.8	177.4	-111.3	159.7	0	0	0	112.6	F69 F70 S77	F69-L73 HydrophobicContact CD1-CD1 4.36Å; F69-L73 HydrophobicContact CE1-CD1 3.77Å; F69-L73 HydrophobicContact CE2-CD1 4.35Å; F69-L73 HydrophobicContact CZ-CD1 3.77Å; F69-L73 PolarHBondContact O-N 3.25Å; F69-L73 VanDerWaalsContact O-N 3.15Å; F70-L73 PolarHBondContact O-N 2.6Å; L73-S77 PolarHBondContact O-N 2.86Å; L73-S77 PolarHBondContact O-OG 3.48Å
74	F	49.7	Very low	41.3	Very low	82 Å²	82	105.2 Å²	105.2	36%	0.36	53%	0.526	S	S	.	.	H	α-helix	trans	-70.3	-34.2	173.3	-79.7	-67.7	0	0	0	112.9	A64 F70 S72 S77 L80	A64-F74 HydrophobicContact CB-CD2 3.74Å; A64-F74 HydrophobicContact CB-CE2 3.81Å; F70-F74 VanDerWaalsContact O-CD2 3.26Å; F70-F74 WeakPolarHBondContact O-CD2 3.22Å; F70-F74 PolarHBondContact O-N 3.05Å; S72-F74 PolarHBondContact O-N 2.82Å; F74-S77 PolarHBondContact O-N 2.94Å; F74-L80 HydrophobicContact CD1-CD2 3.84Å; F74-L80 HydrophobicContact CE1-CD2 3.67Å
75	A	51.7	Low	40.7	Very low	66 Å²	66	108.8 Å²	108.8	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-69.6	-34.1	179.3	0	0	0	0	0	113.6	H71 S72	H71-A75 WeakPolarHBondContact O-CB 3.13Å; H71-A75 PolarHBondContact O-N 3.31Å; H71-A75 VanDerWaalsContact O-N 3.15Å; S72-A75 PolarHBondContact O-N 2.83Å; S72-A75 VanDerWaalsContact O-N 3.12Å
76	Q	45.7	Very low	40.5	Very low	165 Å²	165	108.2 Å²	108.2	77%	0.771	53%	0.534	S	S	*	.	H	α-helix	trans	-72.9	-32.8	174.8	-73.5	-171.7	-17.9	0	0	112.9	S72 K78	S72-Q76 PolarHBondContact O-N 2.8Å; Q76-K78 PolarHBondContact O-N 3.31Å
77	S	46.5	Very low	40.5	Very low	47 Å²	47	103.8 Å²	103.8	33%	0.329	52%	0.523	S	S	.	.			trans	-96.8	79.4	-174.9	53.4	0	0	0	0	112.2	L73 F74 Q79	L73-S77 PolarHBondContact O-N 2.86Å; L73-S77 PolarHBondContact O-OG 3.48Å; F74-S77 PolarHBondContact O-N 2.94Å; S77-Q79 PolarHBondContact O-N 2.83Å
78	K	44.2	Very low	40.2	Very low	201 Å²	201	110.9 Å²	110.9	87%	0.874	56%	0.56	S	S	*	*			trans	-61.9	16.7	-178	-68.6	-164.6	174.8	-168.8	0	117	Q76	Q76-K78 PolarHBondContact O-N 3.31Å
79	Q	36.4	Very low	39.9	Very low	140 Å²	140	108.2 Å²	108.2	65%	0.654	55%	0.547	S	S	*	.	S	Bend	trans	-141.1	131.1	164.5	-72.1	-169.3	-8.2	0	0	109.9	S77 R81	S77-Q79 PolarHBondContact O-N 2.83Å; Q79-R81 PolarHBondContact O-N 3.03Å
80	L	34.5	Very low	39.7	Very low	156 Å²	156	106.4 Å²	106.4	82%	0.817	54%	0.541	S	S	*	.			trans	-72.5	67.3	175.1	-73.1	170	0	0	0	112.1	F74	F74-L80 HydrophobicContact CD1-CD2 3.84Å; F74-L80 HydrophobicContact CE1-CD2 3.67Å
81	R	29.7	Very low	39.6	Very low	200 Å²	200	108.8 Å²	108.8	76%	0.755	56%	0.557	S	S	*	*			trans	-80.1	161.2	163.4	-74.2	-167.9	175.1	-149.7	-2.7	110.6	Q79 V83	Q79-R81 PolarHBondContact O-N 3.03Å; R81-V83 PolarHBondContact O-N 3.17Å
82	R	28.3	Very low	39.4	Very low	201 Å²	201	108 Å²	108	76%	0.758	57%	0.565	S	S	*	*			trans	-65.2	96.7	175.3	-168.9	-169.8	-134.2	154.1	4.3	109.3	D84	R82-D84 WeakPolarHBondContact CD-OD1 3.23Å; R82-D84 WeakPolarHBondContact CG-OD1 3.28Å; R82-D84 IonicContact NE-OD1 2.66Å; R82-D84 PolarHBondContact O-N 3.26Å
83	V	33.5	Very low	39.1	Very low	74 Å²	74	111.4 Å²	111.4	45%	0.448	57%	0.573	S	S	.	*			trans	-77.1	103.3	165.9	-178	0	0	0	0	107.3	R81 L85	R81-V83 PolarHBondContact O-N 3.17Å; V83-L85 HydrophobicContact CG1-CD2 4.38Å
84	D	29.2	Very low	39	Very low	124 Å²	124	108.6 Å²	108.6	66%	0.663	56%	0.56	S	S	*	*			trans	-81.4	111.8	167	-64.7	-40.8	0	0	0	107.4	R82 S86	R82-D84 WeakPolarHBondContact CD-OD1 3.23Å; R82-D84 WeakPolarHBondContact CG-OD1 3.28Å; R82-D84 IonicContact NE-OD1 2.66Å; R82-D84 PolarHBondContact O-N 3.26Å; D84-S86 PolarHBondContact O-N 3.26Å
85	L	31.4	Very low	38.9	Very low	93 Å²	93	106.5 Å²	106.5	49%	0.487	55%	0.552	S	S	.	*			trans	-74.1	113.1	-177.8	-71.8	163.8	0	0	0	109.4	F70 V83 L90	F70-L85 HydrophobicContact CE1-CD1 4.28Å; V83-L85 HydrophobicContact CG1-CD2 4.38Å; L85-L90 HydrophobicContact CB-CD1 4.34Å
86	S	35	Very low	38.6	Very low	61 Å²	61	107.7 Å²	107.7	43%	0.427	55%	0.547	S	S	.	.			trans	-68.6	143.7	166.3	58.5	0	0	0	0	109.9	D84 D88 A89	D84-S86 PolarHBondContact O-N 3.26Å; S86-D88 PolarHBondContact O-N 3.34Å; S86-A89 PolarHBondContact O-N 2.86Å; S86-A89 VanDerWaalsContact O-N 3.09Å
87	L	34.8	Very low	38.7	Very low	106 Å²	106	103.6 Å²	103.6	56%	0.555	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-63.4	-28.2	179	-71	166.4	0	0	0	111.8	A89 L90	L87-A89 PolarHBondContact O-N 2.87Å; L87-L90 PolarHBondContact O-N 3.41Å
88	D	35.3	Very low	38.7	Very low	159 Å²	159	103.7 Å²	103.7	85%	0.85	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-64.7	-16.1	175.7	-44.9	-62.8	0	0	0	113.8	S86	S86-D88 PolarHBondContact O-N 3.34Å
89	A	36.4	Very low	38.8	Very low	51 Å²	51	95.2 Å²	95.2	42%	0.421	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-97.4	-4.1	-179.5	0	0	0	0	0	114	S86 L87	S86-A89 PolarHBondContact O-N 2.86Å; S86-A89 VanDerWaalsContact O-N 3.09Å; L87-A89 PolarHBondContact O-N 2.87Å
90	L	40.9	Very low	39.2	Very low	43 Å²	43	92.6 Å²	92.6	23%	0.225	48%	0.478	C	S	.	.			trans	-85.8	118.4	175.8	-92	72.7	0	0	0	110.9	L85 L87 L95 I98	L85-L90 HydrophobicContact CB-CD1 4.34Å; L87-L90 PolarHBondContact O-N 3.41Å; L90-L95 HydrophobicContact CD2-CD1 3.96Å; L90-I98 HydrophobicContact CD2-CD1 4.01Å
91	T	45.3	Very low	39.7	Very low	70 Å²	70	88.8 Å²	88.8	43%	0.429	46%	0.455	S	S	.	.			trans	-68.3	151.2	163	62.8	0	0	0	0	110.1	Q93 G94 L95	T91-Q93 PolarHBondContact O-N 2.97Å; T91-G94 WeakPolarHBondContact O-CA 3.5Å; T91-G94 PolarHBondContact O-N 3.06Å; T91-G94 PolarHBondContact OG1-N 3.37Å; T91-L95 PolarHBondContact O-N 3.07Å; T91-L95 VanDerWaalsContact O-N 3.07Å
92	S	43.6	Very low	40.3	Very low	99 Å²	99	82.2 Å²	82.2	69%	0.692	43%	0.434	S	S	*	.	H	α-helix	trans	-54.4	-35.6	176.3	51.6	0	0	0	0	112.7	L95 Q96	S92-L95 PolarHBondContact O-N 3.23Å; S92-Q96 WeakPolarHBondContact O-CB 3.14Å; S92-Q96 PolarHBondContact O-N 3.14Å
93	Q	43.2	Very low	41	Very low	137 Å²	137	81 Å²	81	64%	0.64	43%	0.431	S	S	*	.	H	α-helix	trans	-64.4	-38.9	174.4	-170.3	176.4	8.5	0	0	112.8	T91 Q96 Q97	T91-Q93 PolarHBondContact O-N 2.97Å; Q93-Q96 PolarHBondContact O-N 3.23Å; Q93-Q97 WeakPolarHBondContact O-CG 3.15Å; Q93-Q97 PolarHBondContact O-N 3.42Å; Q93-Q97 VanDerWaalsContact O-N 3.08Å
94	G	44.5	Very low	41.1	Very low	6 Å²	6	82.8 Å²	82.8	6%	0.062	44%	0.443	C	S	.	.	H	α-helix	trans	-67	-41	174.3	0	0	0	0	0	112.4	T91 Q97 I98	T91-G94 WeakPolarHBondContact O-CA 3.5Å; T91-G94 PolarHBondContact O-N 3.06Å; T91-G94 PolarHBondContact OG1-N 3.37Å; G94-Q97 PolarHBondContact O-N 2.76Å; G94-I98 WeakPolarHBondContact O-CG1 3.39Å; G94-I98 PolarHBondContact O-N 3.06Å; G94-I98 VanDerWaalsContact O-N 3.13Å
95	L	47.7	Very low	41.4	Very low	37 Å²	37	78.5 Å²	78.5	19%	0.194	42%	0.422	C	S	.	.	H	α-helix	trans	-62.9	-43	174.4	-167.1	73	0	0	0	111.6	L90 T91 S92 Q97 I98 L99 L124 M126	L90-L95 HydrophobicContact CD2-CD1 3.96Å; T91-L95 PolarHBondContact O-N 3.07Å; T91-L95 VanDerWaalsContact O-N 3.07Å; S92-L95 PolarHBondContact O-N 3.23Å; L95-Q97 VanDerWaalsContact C-N 3.33Å; L95-Q97 PolarHBondContact O-N 3.44Å; L95-I98 PolarHBondContact O-N 3.42Å; L95-L99 HydrophobicContact CG-CD1 4.22Å; L95-L99 WeakPolarHBondContact O-CG 3.36Å; L95-L99 PolarHBondContact O-N 3.36Å; L95-L124 HydrophobicContact CD2-CD1 4.13Å; L95-M126 HydrophobicContact CD2-SD 3.79Å
96	Q	43.6	Very low	41.6	Very low	91 Å²	91	84.4 Å²	84.4	43%	0.425	44%	0.444	S	S	.	.	H	α-helix	trans	-62.7	-37.5	176.6	-168.8	65.1	44.9	0	0	112.4	S92 Q93 L99 N100	S92-Q96 WeakPolarHBondContact O-CB 3.14Å; S92-Q96 PolarHBondContact O-N 3.14Å; Q93-Q96 PolarHBondContact O-N 3.23Å; Q96-L99 PolarHBondContact O-N 3.34Å; Q96-N100 PolarHBondContact NE2-OD1 3.38Å; Q96-N100 WeakPolarHBondContact O-CB 3.24Å; Q96-N100 VanDerWaalsContact O-CG 3.3Å; Q96-N100 PolarHBondContact O-N 3.38Å; Q96-N100 PolarHBondContact O-OD1 3.31Å
97	Q	47.8	Very low	41.7	Very low	80 Å²	80	86.7 Å²	86.7	37%	0.374	45%	0.451	S	S	.	.	H	α-helix	trans	-64.5	-41.1	174.4	-75.4	-179.7	-8.2	0	0	112	S67 Q93 G94 L95 F101	S67-Q97 PolarHBondContact OG-OE1 2.61Å; Q93-Q97 WeakPolarHBondContact O-CG 3.15Å; Q93-Q97 PolarHBondContact O-N 3.42Å; Q93-Q97 VanDerWaalsContact O-N 3.08Å; G94-Q97 PolarHBondContact O-N 2.76Å; L95-Q97 VanDerWaalsContact C-N 3.33Å; L95-Q97 PolarHBondContact O-N 3.44Å; Q97-F101 WeakPolarHBondContact O-CB 3.35Å; Q97-F101 PolarHBondContact O-N 2.84Å
98	I	47	Very low	41.5	Very low	48 Å²	48	90.1 Å²	90.1	25%	0.246	47%	0.469	C	S	.	.	H	α-helix	trans	-65.1	-44.6	175.9	-66.8	164.1	0	0	0	110.8	L90 G94 L95 F101 I102	L90-I98 HydrophobicContact CD2-CD1 4.01Å; G94-I98 WeakPolarHBondContact O-CG1 3.39Å; G94-I98 PolarHBondContact O-N 3.06Å; G94-I98 VanDerWaalsContact O-N 3.13Å; L95-I98 PolarHBondContact O-N 3.42Å; I98-F101 WeakPolarHBondContact O-CB 3.44Å; I98-F101 PolarHBondContact O-N 3.29Å; I98-I102 HydrophobicContact CG2-CD1 3.89Å; I98-I102 VanDerWaalsContact O-CG1 3.32Å; I98-I102 WeakPolarHBondContact O-CG1 3.38Å; I98-I102 PolarHBondContact O-N 3.22Å
99	L	45.7	Very low	41.7	Very low	24 Å²	24	85.7 Å²	85.7	13%	0.126	45%	0.447	C	S	.	.	H	α-helix	trans	-65.7	-41.9	177.7	-70.7	170.4	0	0	0	112.3	L95 Q96 F101 I102 Y103 V117 I129	L95-L99 HydrophobicContact CG-CD1 4.22Å; L95-L99 WeakPolarHBondContact O-CG 3.36Å; L95-L99 PolarHBondContact O-N 3.36Å; Q96-L99 PolarHBondContact O-N 3.34Å; L99-F101 VanDerWaalsContact C-N 3.31Å; L99-F101 PolarHBondContact O-N 2.88Å; L99-I102 PolarHBondContact O-N 3.11Å; L99-Y103 PolarHBondContact O-N 2.81Å; L99-V117 HydrophobicContact CD2-CG1 4.14Å; L99-I129 HydrophobicContact CD1-CD1 3.92Å
100	N	45.6	Very low	42	Very low	84 Å²	84	85.7 Å²	85.7	45%	0.449	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-38.2	173.4	-76.7	9.9	0	0	0	111.5	Q96 Y103 T104	Q96-N100 PolarHBondContact NE2-OD1 3.38Å; Q96-N100 WeakPolarHBondContact O-CB 3.24Å; Q96-N100 VanDerWaalsContact O-CG 3.3Å; Q96-N100 PolarHBondContact O-N 3.38Å; Q96-N100 PolarHBondContact O-OD1 3.31Å; N100-Y103 PolarHBondContact O-N 2.85Å; N100-T104 WeakPolarHBondContact O-CB 3.46Å; N100-T104 WeakPolarHBondContact O-CG2 3.34Å; N100-T104 PolarHBondContact O-N 3.17Å; N100-T104 PolarHBondContact O-OG1 3.2Å
101	F	44.2	Very low	42.1	Very low	77 Å²	77	86.4 Å²	86.4	34%	0.338	45%	0.453	S	S	.	.	H	α-helix	trans	-64.7	-40.1	175.1	179.5	-99.6	0	0	0	112	Q97 I98 L99 T104 S105	Q97-F101 WeakPolarHBondContact O-CB 3.35Å; Q97-F101 PolarHBondContact O-N 2.84Å; I98-F101 WeakPolarHBondContact O-CB 3.44Å; I98-F101 PolarHBondContact O-N 3.29Å; L99-F101 VanDerWaalsContact C-N 3.31Å; L99-F101 PolarHBondContact O-N 2.88Å; F101-T104 PolarHBondContact O-OG1 3.39Å; F101-S105 WeakPolarHBondContact O-CB 3.41Å; F101-S105 PolarHBondContact O-N 2.96Å; F101-S105 PolarHBondContact O-OG 3.22Å
102	I	43.3	Very low	42.1	Very low	61 Å²	61	86.5 Å²	86.5	31%	0.313	46%	0.456	S	S	.	.	H	α-helix	trans	-67.5	-35	175	-67.6	164.8	0	0	0	112	I98 L99	I98-I102 HydrophobicContact CG2-CD1 3.89Å; I98-I102 VanDerWaalsContact O-CG1 3.32Å; I98-I102 WeakPolarHBondContact O-CG1 3.38Å; I98-I102 PolarHBondContact O-N 3.22Å; L99-I102 PolarHBondContact O-N 3.11Å
103	Y	42	Very low	42.4	Very low	176 Å²	176	84.7 Å²	84.7	69%	0.69	44%	0.441	S	S	*	.	H	α-helix	trans	-78.5	-36.1	178.1	-102.1	-82.8	0	0	0	114.2	L99 N100	L99-Y103 PolarHBondContact O-N 2.81Å; N100-Y103 PolarHBondContact O-N 2.85Å
104	T	37.1	Very low	42.7	Very low	112 Å²	112	78.5 Å²	78.5	69%	0.687	41%	0.413	S	S	*	.	H	α-helix	trans	-82.1	-31.6	-179.3	52	0	0	0	0	112.5	N100 F101 K106	N100-T104 WeakPolarHBondContact O-CB 3.46Å; N100-T104 WeakPolarHBondContact O-CG2 3.34Å; N100-T104 PolarHBondContact O-N 3.17Å; N100-T104 PolarHBondContact O-OG1 3.2Å; F101-T104 PolarHBondContact O-OG1 3.39Å; T104-K106 PolarHBondContact O-N 2.93Å
105	S	35	Very low	42.8	Very low	33 Å²	33	84 Å²	84	23%	0.231	43%	0.431	C	S	.	.	S	Bend	trans	-76.4	119	167.6	-52.4	0	0	0	0	109.3	F101 L107	F101-S105 WeakPolarHBondContact O-CB 3.41Å; F101-S105 PolarHBondContact O-N 2.96Å; F101-S105 PolarHBondContact O-OG 3.22Å; S105-L107 PolarHBondContact O-N 2.87Å
106	K	35.1	Very low	42.9	Very low	217 Å²	217	86.9 Å²	86.9	94%	0.943	45%	0.447	S	S	*	.			trans	-71.8	54.4	170.5	-72	-174.4	176.1	-179.1	0	112.3	T104	T104-K106 PolarHBondContact O-N 2.93Å
107	L	38.1	Very low	43.2	Very low	109 Å²	109	84.8 Å²	84.8	57%	0.571	44%	0.441	S	S	*	.			trans	-74.6	138	171	-68.8	166.5	0	0	0	108.7	S105 V109	S105-L107 PolarHBondContact O-N 2.87Å; L107-V109 WeakPolarHBondContact O-CG2 3.47Å; L107-V109 PolarHBondContact O-N 3.43Å
108	L	30.6	Very low	43.5	Very low	179 Å²	179	82 Å²	82	94%	0.937	43%	0.428	S	S	*	.			trans	-67.8	97.4	176.2	-73.9	165.7	0	0	0	109.6	S110	L108-S110 PolarHBondContact O-N 2.91Å; L108-S110 VanDerWaalsContact O-N 3.1Å
109	V	39.5	Very low	43.5	Very low	66 Å²	66	83.8 Å²	83.8	40%	0.4	44%	0.438	S	S	.	.			trans	-73.9	104.4	-176.5	-160.9	0	0	0	0	109.7	L107 V114	L107-V109 WeakPolarHBondContact O-CG2 3.47Å; L107-V109 PolarHBondContact O-N 3.43Å; V109-V114 HydrophobicContact CB-CG2 4.35Å; V109-V114 HydrophobicContact CG1-CG2 3.53Å
110	S	41.5	Very low	43.5	Very low	51 Å²	51	84.2 Å²	84.2	36%	0.357	45%	0.445	S	S	.	.			trans	-65.8	148.5	177.2	67.9	0	0	0	0	112	L108 S112 T113 V114	L108-S110 PolarHBondContact O-N 2.91Å; L108-S110 VanDerWaalsContact O-N 3.1Å; S110-S112 PolarHBondContact O-N 3.44Å; S110-S112 VanDerWaalsContact O-N 3.17Å; S110-S112 PolarHBondContact OG-OG 3.07Å; S110-T113 PolarHBondContact N-OG1 2.9Å; S110-T113 VanDerWaalsContact N-OG1 3.11Å; S110-T113 PolarHBondContact O-N 3.03Å; S110-T113 PolarHBondContact O-OG1 3.19Å; S110-T113 PolarHBondContact OG-N 2.79Å; S110-T113 PolarHBondContact OG-OG1 2.97Å; S110-V114 PolarHBondContact O-N 3.09Å; S110-V114 VanDerWaalsContact O-N 3.11Å
111	S	43.2	Very low	43.6	Very low	57 Å²	57	80.5 Å²	80.5	40%	0.399	43%	0.426	S	S	.	.	H	α-helix	trans	-57.4	-30.9	179.6	-172.3	0	0	0	0	113	R115	S111-R115 PolarHBondContact O-N 3.49Å
112	S	46.4	Very low	43.9	Very low	73 Å²	73	80.1 Å²	80.1	51%	0.51	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-53.3	169.5	40.9	0	0	0	0	112	S110 V114 R115 D116	S110-S112 PolarHBondContact O-N 3.44Å; S110-S112 VanDerWaalsContact O-N 3.17Å; S110-S112 PolarHBondContact OG-OG 3.07Å; S112-V114 VanDerWaalsContact C-N 3.29Å; S112-V114 PolarHBondContact O-N 3.01Å; S112-R115 CarbonylContact O-C 3.47Å; S112-R115 WeakPolarHBondContact O-CA 3.49Å; S112-R115 VanDerWaalsContact O-CB 3.27Å; S112-R115 WeakPolarHBondContact O-CB 3.46Å; S112-R115 PolarHBondContact O-N 2.75Å; S112-D116 PolarHBondContact O-N 2.93Å
113	T	48.8	Very low	44	Very low	61 Å²	61	82.6 Å²	82.6	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-61.6	-33.1	-179.5	44.2	0	0	0	0	113.6	S110 R115 V117	S110-T113 PolarHBondContact N-OG1 2.9Å; S110-T113 VanDerWaalsContact N-OG1 3.11Å; S110-T113 PolarHBondContact O-N 3.03Å; S110-T113 PolarHBondContact O-OG1 3.19Å; S110-T113 PolarHBondContact OG-N 2.79Å; S110-T113 PolarHBondContact OG-OG1 2.97Å; T113-R115 VanDerWaalsContact C-N 3.32Å; T113-V117 WeakPolarHBondContact O-CG2 3.25Å; T113-V117 PolarHBondContact O-N 2.84Å; T113-V117 VanDerWaalsContact O-N 3.17Å
114	V	49.1	Very low	44.1	Very low	7 Å²	7	78 Å²	78	4%	0.042	44%	0.435	C	S	.	.	H	α-helix	trans	-67.5	-34.4	171.3	-170	0	0	0	0	111.2	V109 S110 S112 L118 C133 L136 L137	V109-V114 HydrophobicContact CB-CG2 4.35Å; V109-V114 HydrophobicContact CG1-CG2 3.53Å; S110-V114 PolarHBondContact O-N 3.09Å; S110-V114 VanDerWaalsContact O-N 3.11Å; S112-V114 VanDerWaalsContact C-N 3.29Å; S112-V114 PolarHBondContact O-N 3.01Å; V114-L118 WeakPolarHBondContact O-CB 3.31Å; V114-L118 PolarHBondContact O-N 3.25Å; V114-C133 HydrophobicContact CG1-CB 4.22Å; V114-L136 HydrophobicContact CG1-CB 4.4Å; V114-L136 HydrophobicContact CG1-CD2 4.08Å; V114-L136 HydrophobicContact CG2-CD2 4.13Å; V114-L137 HydrophobicContact CB-CD1 4.33Å; V114-L137 HydrophobicContact CB-CD2 4Å; V114-L137 HydrophobicContact CB-CG 4.21Å; V114-L137 HydrophobicContact CG1-CD1 3.83Å; V114-L137 HydrophobicContact CG1-CD2 4.04Å; V114-L137 HydrophobicContact CG1-CG 3.69Å
115	R	48.5	Very low	44.3	Very low	120 Å²	120	81.1 Å²	81.1	45%	0.453	44%	0.442	S	S	.	.	H	α-helix	trans	-70.7	-39	177.3	-162.8	132.6	-60.4	-176.8	4.3	112.6	S111 S112 T113 L118 N119	S111-R115 PolarHBondContact O-N 3.49Å; S112-R115 CarbonylContact O-C 3.47Å; S112-R115 WeakPolarHBondContact O-CA 3.49Å; S112-R115 VanDerWaalsContact O-CB 3.27Å; S112-R115 WeakPolarHBondContact O-CB 3.46Å; S112-R115 PolarHBondContact O-N 2.75Å; T113-R115 VanDerWaalsContact C-N 3.32Å; R115-L118 WeakPolarHBondContact O-CB 3.27Å; R115-L118 PolarHBondContact O-N 3.4Å; R115-N119 WeakPolarHBondContact O-CB 3.4Å; R115-N119 PolarHBondContact O-N 2.84Å; R115-N119 PolarHBondContact O-ND2 3.23Å
116	D	48.6	Very low	44.6	Very low	99 Å²	99	82.7 Å²	82.7	53%	0.529	45%	0.446	S	S	.	.	H	α-helix	trans	-66.4	-40.8	177.1	-60.5	-36.3	0	0	0	111.1	S112 N119 A120	S112-D116 PolarHBondContact O-N 2.93Å; D116-N119 PolarHBondContact O-N 2.7Å; D116-A120 PolarHBondContact O-N 3.36Å
117	V	49.9	Very low	45.2	Very low	47 Å²	47	75.8 Å²	75.8	29%	0.285	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-40.9	171.9	173.4	0	0	0	0	111.7	L99 T113 N119 A120 A121	L99-V117 HydrophobicContact CD2-CG1 4.14Å; T113-V117 WeakPolarHBondContact O-CG2 3.25Å; T113-V117 PolarHBondContact O-N 2.84Å; T113-V117 VanDerWaalsContact O-N 3.17Å; V117-N119 PolarHBondContact O-N 3.01Å; V117-A120 PolarHBondContact O-N 3.29Å; V117-A121 WeakPolarHBondContact O-CB 3.37Å; V117-A121 PolarHBondContact O-N 3.2Å
118	L	53.2	Low	45.5	Very low	22 Å²	22	76.3 Å²	76.3	12%	0.115	43%	0.428	C	S	.	.	H	α-helix	trans	-60	-44.4	173.9	173.1	59.1	0	0	0	111.8	V114 R115 A121 T122 A130 C133 R134 L137	V114-L118 WeakPolarHBondContact O-CB 3.31Å; V114-L118 PolarHBondContact O-N 3.25Å; R115-L118 WeakPolarHBondContact O-CB 3.27Å; R115-L118 PolarHBondContact O-N 3.4Å; L118-A121 PolarHBondContact O-N 2.04Å; L118-T122 HydrophobicContact CD1-CG2 4.19Å; L118-T122 PolarHBondContact O-N 3.47Å; L118-T122 PolarHBondContact O-OG1 3.16Å; L118-A130 HydrophobicContact CD1-CB 3.89Å; L118-A130 VanDerWaalsContact CD1-O 3.28Å; L118-A130 WeakPolarHBondContact CD1-O 3.17Å; L118-C133 HydrophobicContact CB-CB 3.95Å; L118-C133 HydrophobicContact CD1-CB 4.14Å; L118-R134 HydrophobicContact CD1-CG 3.92Å; L118-R134 HydrophobicContact CD2-CG 3.95Å; L118-L137 HydrophobicContact CD2-CD1 3.8Å
119	N	48.5	Very low	46.3	Very low	85 Å²	85	69.7 Å²	69.7	46%	0.455	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-40.8	178.5	-68.4	-23.6	0	0	0	111.7	R115 D116 V117 T122 V123	R115-N119 WeakPolarHBondContact O-CB 3.4Å; R115-N119 PolarHBondContact O-N 2.84Å; R115-N119 PolarHBondContact O-ND2 3.23Å; D116-N119 PolarHBondContact O-N 2.7Å; V117-N119 PolarHBondContact O-N 3.01Å; N119-T122 PolarHBondContact O-OG1 2.81Å; N119-T122 VanDerWaalsContact O-OG1 3.06Å; N119-V123 WeakPolarHBondContact O-CG2 3.36Å; N119-V123 PolarHBondContact O-N 2.98Å; N119-V123 VanDerWaalsContact O-N 3.16Å
120	A	46.2	Very low	46.8	Very low	33 Å²	33	66.6 Å²	66.6	27%	0.273	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-43.2	173.7	0	0	0	0	0	111.8	D116 V117 T122 V123 L124	D116-A120 PolarHBondContact O-N 3.36Å; V117-A120 PolarHBondContact O-N 3.29Å; A120-T122 PolarHBondContact O-N 2.05Å; A120-V123 PolarHBondContact O-N 3.43Å; A120-L124 WeakPolarHBondContact O-CB 3.25Å; A120-L124 WeakPolarHBondContact O-CG 3.31Å; A120-L124 PolarHBondContact O-N 3.23Å
121	A	47.2	Very low	47.3	Very low	6 Å²	6	65.7 Å²	65.7	5%	0.05	37%	0.371	C	S	.	.	H	α-helix	trans	-64.5	-36.1	179.2	0	0	0	0	0	112.9	V117 L118 Q125 M126 I129 A130	V117-A121 WeakPolarHBondContact O-CB 3.37Å; V117-A121 PolarHBondContact O-N 3.2Å; L118-A121 PolarHBondContact O-N 2.04Å; A121-Q125 PolarHBondContact O-N 3.14Å; A121-M126 HydrophobicContact CB-CB 4.41Å; A121-M126 PolarHBondContact O-N 2.78Å; A121-I129 HydrophobicContact CB-CB 4.28Å; A121-I129 HydrophobicContact CB-CG2 3.95Å; A121-A130 HydrophobicContact CB-CB 4.01Å
122	T	50.7	Low	47.8	Very low	68 Å²	68	66.2 Å²	66.2	42%	0.417	37%	0.374	S	S	.	.	H	α-helix	trans	-72.8	-38.1	174.9	50	0	0	0	0	112.9	L118 N119 A120 L124 Q125 A130	L118-T122 HydrophobicContact CD1-CG2 4.19Å; L118-T122 PolarHBondContact O-N 3.47Å; L118-T122 PolarHBondContact O-OG1 3.16Å; N119-T122 PolarHBondContact O-OG1 2.81Å; N119-T122 VanDerWaalsContact O-OG1 3.06Å; A120-T122 PolarHBondContact O-N 2.05Å; T122-L124 VanDerWaalsContact C-N 3.33Å; T122-L124 PolarHBondContact O-N 2.83Å; T122-Q125 PolarHBondContact O-N 2.96Å; T122-A130 HydrophobicContact CG2-CB 3.89Å
123	V	44.8	Very low	48.1	Very low	113 Å²	113	63.5 Å²	63.5	69%	0.685	36%	0.355	S	S	*	.	H	α-helix	trans	-62.5	-40.4	173.4	169.4	0	0	0	0	111.4	N119 A120 Q125	N119-V123 WeakPolarHBondContact O-CG2 3.36Å; N119-V123 PolarHBondContact O-N 2.98Å; N119-V123 VanDerWaalsContact O-N 3.16Å; A120-V123 PolarHBondContact O-N 3.43Å; V123-Q125 PolarHBondContact O-N 2.95Å
124	L	43.3	Very low	48.6	Very low	81 Å²	81	66.1 Å²	66.1	42%	0.424	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	8.4	177.1	-62.4	174.5	0	0	0	113.9	L95 A120 T122 M126	L95-L124 HydrophobicContact CD2-CD1 4.13Å; A120-L124 WeakPolarHBondContact O-CB 3.25Å; A120-L124 WeakPolarHBondContact O-CG 3.31Å; A120-L124 PolarHBondContact O-N 3.23Å; T122-L124 VanDerWaalsContact C-N 3.33Å; T122-L124 PolarHBondContact O-N 2.83Å; L124-M126 HydrophobicContact CB-CG 4.06Å; L124-M126 PolarHBondContact O-N 2.88Å; L124-M126 VanDerWaalsContact O-N 3.11Å
125	Q	42	Very low	48.9	Very low	177 Å²	177	70.7 Å²	70.7	83%	0.827	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	24.5	179.5	-57.1	-179	43.3	0	0	115.1	A121 T122 V123 S127	A121-Q125 PolarHBondContact O-N 3.14Å; T122-Q125 PolarHBondContact O-N 2.96Å; V123-Q125 PolarHBondContact O-N 2.95Å; Q125-S127 VanDerWaalsContact C-N 3.35Å; Q125-S127 PolarHBondContact O-N 3.37Å
126	M	42.2	Very low	49.1	Very low	65 Å²	65	69 Å²	69	32%	0.32	38%	0.382	S	S	.	.			trans	-80.5	80.8	178.9	-58.7	-167.4	80.6	0	0	110.2	L95 A121 L124 D128 I129 A130	L95-M126 HydrophobicContact CD2-SD 3.79Å; A121-M126 HydrophobicContact CB-CB 4.41Å; A121-M126 PolarHBondContact O-N 2.78Å; L124-M126 HydrophobicContact CB-CG 4.06Å; L124-M126 PolarHBondContact O-N 2.88Å; L124-M126 VanDerWaalsContact O-N 3.11Å; M126-D128 VanDerWaalsContact C-N 3.25Å; M126-D128 PolarHBondContact O-N 3.47Å; M126-D128 VanDerWaalsContact O-N 3.17Å; M126-I129 HydrophobicContact CB-CB 4.37Å; M126-I129 HydrophobicContact CB-CD1 4.42Å; M126-I129 HydrophobicContact CE-CD1 3.53Å; M126-I129 PolarHBondContact O-N 3.33Å; M126-I129 HydrophobicContact SD-CD1 3.98Å; M126-A130 VanDerWaalsContact O-CB 3.29Å; M126-A130 WeakPolarHBondContact O-CB 3.28Å; M126-A130 PolarHBondContact O-N 2.96Å
127	S	47.4	Very low	49.5	Very low	72 Å²	72	65.9 Å²	65.9	50%	0.503	37%	0.365	S	S	.	.	H	α-helix	trans	-45.5	-46.8	-175.1	47.3	0	0	0	0	113.8	Q125 A130 A131	Q125-S127 VanDerWaalsContact C-N 3.35Å; Q125-S127 PolarHBondContact O-N 3.37Å; S127-A130 PolarHBondContact O-N 3Å; S127-A131 WeakPolarHBondContact O-CB 2.98Å; S127-A131 PolarHBondContact O-N 3.06Å
128	D	44.1	Very low	49.7	Very low	120 Å²	120	67.6 Å²	67.6	64%	0.642	38%	0.379	S	S	*	.	H	α-helix	trans	-82	-40.9	-164.1	-46.2	-21	0	0	0	110.6	M126 A131 S132	M126-D128 VanDerWaalsContact C-N 3.25Å; M126-D128 PolarHBondContact O-N 3.47Å; M126-D128 VanDerWaalsContact O-N 3.17Å; D128-A131 WeakPolarHBondContact O-CB 3.43Å; D128-A131 PolarHBondContact O-N 3.41Å; D128-S132 PolarHBondContact O-N 3.42Å; D128-S132 PolarHBondContact O-OG 2.74Å; D128-S132 VanDerWaalsContact O-OG 3.05Å
129	I	48	Very low	49.5	Very low	40 Å²	40	69.5 Å²	69.5	21%	0.205	40%	0.395	C	S	.	.	H	α-helix	trans	-63.7	-44.1	170.5	-59.9	178.9	0	0	0	109.6	L99 A121 M126 A131 S132 C133	L99-I129 HydrophobicContact CD1-CD1 3.92Å; A121-I129 HydrophobicContact CB-CB 4.28Å; A121-I129 HydrophobicContact CB-CG2 3.95Å; M126-I129 HydrophobicContact CB-CB 4.37Å; M126-I129 HydrophobicContact CB-CD1 4.42Å; M126-I129 HydrophobicContact CE-CD1 3.53Å; M126-I129 PolarHBondContact O-N 3.33Å; M126-I129 HydrophobicContact SD-CD1 3.98Å; I129-A131 VanDerWaalsContact C-N 3.27Å; I129-A131 PolarHBondContact O-N 2.93Å; I129-S132 PolarHBondContact O-N 3.38Å; I129-C133 WeakPolarHBondContact O-CB 3.48Å; I129-C133 PolarHBondContact O-N 3.42Å; I129-C133 PolarHBondContact O-SG 3.24Å
130	A	49.8	Very low	49.4	Very low	1 Å²	1	72.3 Å²	72.3	1%	0.008	41%	0.405	C	S	.	.	H	α-helix	trans	-64.6	-31	176.2	0	0	0	0	0	112.3	L118 A121 T122 M126 S127 R134	L118-A130 HydrophobicContact CD1-CB 3.89Å; L118-A130 VanDerWaalsContact CD1-O 3.28Å; L118-A130 WeakPolarHBondContact CD1-O 3.17Å; A121-A130 HydrophobicContact CB-CB 4.01Å; T122-A130 HydrophobicContact CG2-CB 3.89Å; M126-A130 VanDerWaalsContact O-CB 3.29Å; M126-A130 WeakPolarHBondContact O-CB 3.28Å; M126-A130 PolarHBondContact O-N 2.96Å; S127-A130 PolarHBondContact O-N 3Å; A130-R134 VanDerWaalsContact C-CZ 3.44Å; A130-R134 VanDerWaalsContact O-CG 3.27Å; A130-R134 WeakPolarHBondContact O-CG 3.45Å; A130-R134 PolarHBondContact O-N 3.14Å; A130-R134 VanDerWaalsContact O-N 3.12Å; A130-R134 PolarHBondContact O-NE 3.4Å; A130-R134 PolarHBondContact O-NH1 2.67Å
131	A	52.4	Low	49.4	Very low	33 Å²	33	75.3 Å²	75.3	27%	0.273	42%	0.424	S	S	.	.	H	α-helix	trans	-69.4	-53.2	172	0	0	0	0	0	111	S127 D128 I129 C133 R134 D135	S127-A131 WeakPolarHBondContact O-CB 2.98Å; S127-A131 PolarHBondContact O-N 3.06Å; D128-A131 WeakPolarHBondContact O-CB 3.43Å; D128-A131 PolarHBondContact O-N 3.41Å; I129-A131 VanDerWaalsContact C-N 3.27Å; I129-A131 PolarHBondContact O-N 2.93Å; A131-C133 VanDerWaalsContact C-N 3.27Å; A131-C133 PolarHBondContact O-N 3.35Å; A131-R134 VanDerWaalsContact CA-NH2 3.34Å; A131-R134 WeakPolarHBondContact O-CA 3.49Å; A131-R134 WeakPolarHBondContact O-CB 3.49Å; A131-R134 PolarHBondContact O-N 2.97Å; A131-D135 PolarHBondContact O-N 2.81Å
132	S	52.8	Low	49.3	Very low	67 Å²	67	78.3 Å²	78.3	47%	0.469	44%	0.439	S	S	.	.	H	α-helix	trans	-55.5	-40.7	176.9	-56.5	0	0	0	0	112.5	D128 I129 D135 L136	D128-S132 PolarHBondContact O-N 3.42Å; D128-S132 PolarHBondContact O-OG 2.74Å; D128-S132 VanDerWaalsContact O-OG 3.05Å; I129-S132 PolarHBondContact O-N 3.38Å; S132-D135 PolarHBondContact O-N 3.37Å; S132-L136 WeakPolarHBondContact O-CB 3.11Å; S132-L136 PolarHBondContact O-N 3.49Å
133	C	52.1	Low	48.7	Very low	17 Å²	17	84.5 Å²	84.5	12%	0.115	45%	0.454	C	S	.	.	H	α-helix	trans	-69.5	-33.5	175.2	-65.8	0	0	0	0	113	V114 L118 I129 A131 L137	V114-C133 HydrophobicContact CG1-CB 4.22Å; L118-C133 HydrophobicContact CB-CB 3.95Å; L118-C133 HydrophobicContact CD1-CB 4.14Å; I129-C133 WeakPolarHBondContact O-CB 3.48Å; I129-C133 PolarHBondContact O-N 3.42Å; I129-C133 PolarHBondContact O-SG 3.24Å; A131-C133 VanDerWaalsContact C-N 3.27Å; A131-C133 PolarHBondContact O-N 3.35Å; C133-L137 VanDerWaalsContact O-CB 3.32Å; C133-L137 WeakPolarHBondContact O-CB 3.24Å; C133-L137 VanDerWaalsContact O-CD1 3.31Å; C133-L137 WeakPolarHBondContact O-CD1 3.48Å; C133-L137 WeakPolarHBondContact O-CG 3.17Å; C133-L137 PolarHBondContact O-N 3.32Å; C133-L137 VanDerWaalsContact O-N 3.16Å
134	R	59.8	Low	48.2	Very low	116 Å²	116	80.9 Å²	80.9	44%	0.438	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-39.2	171.6	-78	179.9	-62.6	-99.5	1.2	111.6	L118 A130 A131 L137 S138	L118-R134 HydrophobicContact CD1-CG 3.92Å; L118-R134 HydrophobicContact CD2-CG 3.95Å; A130-R134 VanDerWaalsContact C-CZ 3.44Å; A130-R134 VanDerWaalsContact O-CG 3.27Å; A130-R134 WeakPolarHBondContact O-CG 3.45Å; A130-R134 PolarHBondContact O-N 3.14Å; A130-R134 VanDerWaalsContact O-N 3.12Å; A130-R134 PolarHBondContact O-NE 3.4Å; A130-R134 PolarHBondContact O-NH1 2.67Å; A131-R134 VanDerWaalsContact CA-NH2 3.34Å; A131-R134 WeakPolarHBondContact O-CA 3.49Å; A131-R134 WeakPolarHBondContact O-CB 3.49Å; A131-R134 PolarHBondContact O-N 2.97Å; R134-L137 CarbonylContact O-C 3.47Å; R134-L137 PolarHBondContact O-N 2.83Å; R134-L137 VanDerWaalsContact O-N 3.16Å; R134-S138 WeakPolarHBondContact O-CB 3.47Å; R134-S138 PolarHBondContact O-N 3.08Å; R134-S138 PolarHBondContact O-OG 3.23Å
135	D	54.4	Low	48.1	Very low	103 Å²	103	80.9 Å²	80.9	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-73.1	-35.1	178.7	-65.2	-24.6	0	0	0	112.5	A131 S132 L137 S138 S139	A131-D135 PolarHBondContact O-N 2.81Å; S132-D135 PolarHBondContact O-N 3.37Å; D135-L137 PolarHBondContact O-N 3.16Å; D135-S138 WeakPolarHBondContact CA-OG 3.47Å; D135-S138 PolarHBondContact O-N 3.39Å; D135-S138 PolarHBondContact O-OG 2.96Å; D135-S139 VanDerWaalsContact O-CB 3.31Å; D135-S139 WeakPolarHBondContact O-CB 3.46Å; D135-S139 PolarHBondContact O-N 3.4Å; D135-S139 PolarHBondContact O-OG 2.98Å
136	L	53	Low	47.7	Very low	83 Å²	83	77.7 Å²	77.7	44%	0.435	44%	0.436	S	S	.	.	H	α-helix	trans	-64.2	-23.2	169	-142.7	85.4	0	0	0	112.8	V114 S132 S139	V114-L136 HydrophobicContact CG1-CB 4.4Å; V114-L136 HydrophobicContact CG1-CD2 4.08Å; V114-L136 HydrophobicContact CG2-CD2 4.13Å; S132-L136 WeakPolarHBondContact O-CB 3.11Å; S132-L136 PolarHBondContact O-N 3.49Å; L136-S139 PolarHBondContact O-OG 3.41Å
137	L	57.8	Low	47.3	Very low	34 Å²	34	83.9 Å²	83.9	18%	0.178	46%	0.455	C	S	.	.	H	α-helix	trans	-98.9	-12.9	179.6	-74.4	168.4	0	0	0	113.8	V114 L118 C133 R134 D135 L142	V114-L137 HydrophobicContact CB-CD1 4.33Å; V114-L137 HydrophobicContact CB-CD2 4Å; V114-L137 HydrophobicContact CB-CG 4.21Å; V114-L137 HydrophobicContact CG1-CD1 3.83Å; V114-L137 HydrophobicContact CG1-CD2 4.04Å; V114-L137 HydrophobicContact CG1-CG 3.69Å; L118-L137 HydrophobicContact CD2-CD1 3.8Å; C133-L137 VanDerWaalsContact O-CB 3.32Å; C133-L137 WeakPolarHBondContact O-CB 3.24Å; C133-L137 VanDerWaalsContact O-CD1 3.31Å; C133-L137 WeakPolarHBondContact O-CD1 3.48Å; C133-L137 WeakPolarHBondContact O-CG 3.17Å; C133-L137 PolarHBondContact O-N 3.32Å; C133-L137 VanDerWaalsContact O-N 3.16Å; R134-L137 CarbonylContact O-C 3.47Å; R134-L137 PolarHBondContact O-N 2.83Å; R134-L137 VanDerWaalsContact O-N 3.16Å; D135-L137 PolarHBondContact O-N 3.16Å; L137-L142 HydrophobicContact CD2-CD1 4.31Å
138	S	53.2	Low	46.5	Very low	84 Å²	84	87.5 Å²	87.5	59%	0.587	46%	0.464	S	S	*	.	H	α-helix	trans	-98.1	-30.2	174.9	71.5	0	0	0	0	112.2	R134 D135	R134-S138 WeakPolarHBondContact O-CB 3.47Å; R134-S138 PolarHBondContact O-N 3.08Å; R134-S138 PolarHBondContact O-OG 3.23Å; D135-S138 WeakPolarHBondContact CA-OG 3.47Å; D135-S138 PolarHBondContact O-N 3.39Å; D135-S138 PolarHBondContact O-OG 2.96Å
139	S	49.5	Very low	46.1	Very low	62 Å²	62	90.2 Å²	90.2	43%	0.434	48%	0.475	S	S	.	.	S	Bend	trans	-61.8	135.4	175.3	48.9	0	0	0	0	112.1	D135 L136 S141	D135-S139 VanDerWaalsContact O-CB 3.31Å; D135-S139 WeakPolarHBondContact O-CB 3.46Å; D135-S139 PolarHBondContact O-N 3.4Å; D135-S139 PolarHBondContact O-OG 2.98Å; L136-S139 PolarHBondContact O-OG 3.41Å; S139-S141 PolarHBondContact O-N 3.1Å
140	H	46.9	Very low	45.5	Very low	144 Å²	144	91.8 Å²	91.8	67%	0.667	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-5.7	-155.9	-143.3	-95.3	0	0	0	115.5	R143	H140-R143 PolarHBondContact O-N 3.26Å
141	S	46.2	Very low	44.9	Very low	96 Å²	96	98.2 Å²	98.2	67%	0.671	53%	0.529	S	S	*	.	H	α-helix	trans	-66.1	-39.6	-173.1	-161.4	0	0	0	0	113.1	S139 R143 A144	S139-S141 PolarHBondContact O-N 3.1Å; S141-R143 PolarHBondContact O-N 3.26Å; S141-A144 PolarHBondContact O-N 3.37Å
142	L	45.5	Very low	44.2	Very low	69 Å²	69	105.4 Å²	105.4	36%	0.361	56%	0.557	S	S	.	*	H	α-helix	trans	-74.4	-0	177.1	-74.6	174.8	0	0	0	114.3	L137	L137-L142 HydrophobicContact CD2-CD1 4.31Å
143	R	38.4	Very low	43.1	Very low	197 Å²	197	111.4 Å²	111.4	74%	0.743	58%	0.577	S	S	*	*	H	α-helix	trans	-107.5	-17.9	178.2	-123.1	179.6	-175.8	178	2	113.9	H140 S141	H140-R143 PolarHBondContact O-N 3.26Å; S141-R143 PolarHBondContact O-N 3.26Å
144	A	34.2	Very low	42.2	Very low	37 Å²	37	113.9 Å²	113.9	31%	0.306	61%	0.606	S	S	.	*	H	α-helix	trans	-78	-43.1	179.8	0	0	0	0	0	112.3	S141 C146 R147 E148	S141-A144 PolarHBondContact O-N 3.37Å; A144-C146 VanDerWaalsContact C-N 3.26Å; A144-C146 PolarHBondContact O-N 2.97Å; A144-C146 VanDerWaalsContact O-N 3.14Å; A144-R147 PolarHBondContact O-N 3.35Å; A144-E148 PolarHBondContact O-N 3.49Å
145	T	40.1	Very low	40.7	Very low	81 Å²	81	118.2 Å²	118.2	50%	0.497	63%	0.628	S	S	.	*	H	α-helix	trans	-58.4	-30.2	-173.9	47.8	0	0	0	0	114.5
146	C	33.5	Very low	39.4	Very low	110 Å²	110	120.5 Å²	120.5	74%	0.743	64%	0.64	S	S	*	*	H	α-helix	trans	-81.4	-9.5	174.9	-63.9	0	0	0	0	114.5	A144	A144-C146 VanDerWaalsContact C-N 3.26Å; A144-C146 PolarHBondContact O-N 2.97Å; A144-C146 VanDerWaalsContact O-N 3.14Å
147	R	35	Very low	38.2	Very low	195 Å²	195	122.7 Å²	122.7	74%	0.736	66%	0.66	S	S	*	*	H	α-helix	trans	-106.6	-30.5	-176.8	-164.5	171.2	-174.3	169.7	1.9	113.2	A144 A150	A144-R147 PolarHBondContact O-N 3.35Å; R147-A150 PolarHBondContact O-N 3.34Å
148	E	29.4	Very low	37	Very low	148 Å²	148	125.3 Å²	125.3	69%	0.692	69%	0.686	S	S	*	*	H	α-helix	trans	-72.9	-30	177	-66.8	179.2	137.1	0	0	112.2	A144 A150	A144-E148 PolarHBondContact O-N 3.49Å; E148-A150 PolarHBondContact O-N 2.76Å
149	M	35.4	Very low	35.7	Very low	177 Å²	177	130.9 Å²	130.9	87%	0.872	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-1.7	173.4	-63.5	-166.9	78.8	0	0	114.8
150	A	35.8	Very low	34.6	Very low	74 Å²	74	136.5 Å²	136.5	61%	0.612	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-0.2	-176.6	0	0	0	0	0	114.2	R147 E148	R147-A150 PolarHBondContact O-N 3.34Å; E148-A150 PolarHBondContact O-N 2.76Å
151	N	38.3	Very low	33.8	Very low	135 Å²	135	134.2 Å²	134.2	72%	0.722	72%	0.723	S	S	*	*	S	Bend	trans	-125.1	21.8	-168.1	-100.6	25.6	0	0	0	114.1
152	Q	37.9	Very low	33.3	Very low	185 Å²	185	134.8 Å²	134.8	86%	0.864	72%	0.724	S	S	*	*	S	Bend	trans	-136.5	54.5	173.4	-71.3	-164.7	6.7	0	0	113.9
153	E	29.2	Very low	32.2	Very low	192 Å²	192	138 Å²	138	90%	0.897	75%	0.751	S	S	*	*			trans	-141.6	134.3	138.9	-76.2	-151.5	144.7	0	0	108.3
154	G	33.3	Very low	31.7	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	76%	0.755	S	S	*	*			trans	-125.9	99.7	-175.7	0	0	0	0	0	111.6
155	F	27.5	Very low	31.1	Very low	207 Å²	207	143.6 Å²	143.6	91%	0.908	78%	0.783	S	S	*	*			trans	-143.5	154.6	169.2	-86.6	-75.4	0	0	0	110.5
156	D	27.1	Very low	30.3	Very low	150 Å²	150	149.3 Å²	149.3	80%	0.802	80%	0.798	S	S	*	*			trans	-75.4	145.8	-162	-89.5	-64.8	0	0	0	116	A158	D156-A158 PolarHBondContact O-N 2.99Å
157	P	29.1	Very low	30	Very low	129 Å²	129	153.9 Å²	153.9	84%	0.838	80%	0.799	S	S	*	*			trans	-87.3	80.4	-178.2	35.6	-35.1	0	0	0	112.3
158	A	31.4	Very low	29.5	Very low	89 Å²	89	150.2 Å²	150.2	74%	0.736	79%	0.79	S	S	*	*			trans	-134.6	28.4	-171.9	0	0	0	0	0	117	D156	D156-A158 PolarHBondContact O-N 2.99Å
159	E	26.7	Very low	29.2	Very low	201 Å²	201	150.1 Å²	150.1	94%	0.939	79%	0.793	S	S	*	*	S	Bend	trans	-144.8	157.8	160.9	-126.3	169.5	-147.8	0	0	112.1
160	M	24.9	Very low	28.6	Very low	180 Å²	180	150.6 Å²	150.6	89%	0.887	79%	0.79	S	S	*	*			trans	-109.6	162.7	-153.3	-98.6	-132.6	128	0	0	116.6
161	P	31.2	Very low	28.1	Very low	97 Å²	97	154.2 Å²	154.2	63%	0.63	79%	0.794	S	S	*	*			trans	-93.7	-159.3	-175.7	45.3	-40.4	0	0	0	110.1
162	P	35.4	Very low	27.4	Very low	108 Å²	108	155.4 Å²	155.4	70%	0.701	80%	0.796	S	S	*	*			cis	-131.2	169.9	-8.8	41.2	-26	0	0	0	115.1
163	C	23.4	Very low	27	Very low	136 Å²	136	151.2 Å²	151.2	92%	0.919	79%	0.787	S	S	*	*			trans	-128.7	93.5	156.9	-80.8	0	0	0	0	111.9
164	Q	27.1	Very low	27	Very low	178 Å²	178	150 Å²	150	83%	0.832	78%	0.781	S	S	*	*			trans	-81.5	125.8	144.8	-66.8	179.1	1	0	0	107.7
165	L	22.4	Very low	26.8	Very low	173 Å²	173	154.6 Å²	154.6	91%	0.906	79%	0.788	S	S	*	*				-155.6	147.5	124.9	-135.7	70.8	0	0	0	110.8
166	Y	21.4	Very low	26.9	Very low	202 Å²	202	147.8 Å²	147.8	79%	0.792	78%	0.777	S	S	*	*			trans	-111.9	-178.5	-179.2	-151.8	-98.9	0	0	0	108.8
167	R	27.2	Very low	27	Very low	206 Å²	206	149.6 Å²	149.6	78%	0.777	77%	0.772	S	S	*	*			trans	81.6	144.9	166.9	-63	-161.8	138.3	149.2	0.7	117.9
168	E	25.8	Very low	27.1	Very low	118 Å²	118	149.9 Å²	149.9	55%	0.551	77%	0.771	S	S	*	*			cis	-169.8	160.9	-25.6	-121	166.7	-139.9	0	0	107
169	I	23.7	Very low	27	Very low	145 Å²	145	154.4 Å²	154.4	74%	0.744	77%	0.771	S	S	*	*				167	118.1	118.4	-85.4	165.2	0	0	0	108.4
170	K	22.7	Very low	27.2	Very low	187 Å²	187	151.5 Å²	151.5	81%	0.813	77%	0.767	S	S	*	*			trans	36.4	140.8	143.7	-58.1	179.3	-178.7	178.4	0	119.1
171	Q	24.4	Very low	27.6	Very low	150 Å²	150	154.2 Å²	154.2	70%	0.701	77%	0.767	S	S	*	*			cis	-157.1	141.3	49.8	-169.3	162.6	-2.2	0	0	115.1
172	E	24	Very low	27.3	Very low	160 Å²	160	159 Å²	159	75%	0.748	78%	0.781	S	S	*	*			trans	53.6	96.8	158.1	-76.7	140.8	-138.2	0	0	121.1
173	S	28.3	Very low	27.2	Very low	98 Å²	98	156.8 Å²	156.8	69%	0.685	78%	0.778	S	S	*	*			trans	-61.7	166.3	130.6	60.9	0	0	0	0	110.4
174	E	31	Very low	28.1	Very low	167 Å²	167	156.9 Å²	156.9	78%	0.78	78%	0.78	S	S	*	*			cis	-166	168.7	12.1	-143.3	161.9	-116.2	0	0	109.2
175	L	27.8	Very low	28.1	Very low	166 Å²	166	152.5 Å²	152.5	87%	0.869	77%	0.77	S	S	*	*				174	125.2	125.1	-96.7	167.3	0	0	0	112.5
176	G	29.5	Very low	28.7	Very low	64 Å²	64	149.5 Å²	149.5	66%	0.66	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-88.3	157.4	164.3	0	0	0	0	0	111.9
177	R	29.2	Very low	29.3	Very low	187 Å²	187	149.1 Å²	149.1	71%	0.706	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-97.2	123.4	172.2	-67.5	-178.9	178.3	176	-2.2	110.2	Y179	R177-Y179 HydrophobicContact CB-CE2 3.95Å
178	V	32.4	Very low	29.3	Very low	136 Å²	136	144.2 Å²	144.2	82%	0.824	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-98.6	134.6	169.5	178.1	0	0	0	0	108.3
179	Y	28.7	Very low	29.5	Very low	183 Å²	183	145 Å²	145	72%	0.718	77%	0.773	S	S	*	*			trans	-110.5	117.7	177.7	-63.9	-96.2	0	0	0	109.3	R177	R177-Y179 HydrophobicContact CB-CE2 3.95Å
180	T	31.1	Very low	29.8	Very low	141 Å²	141	148.1 Å²	148.1	87%	0.865	78%	0.775	S	S	*	*			trans	-107.8	155.5	169.3	47.1	0	0	0	0	110.3
181	R	31.9	Very low	30.1	Very low	236 Å²	236	144.5 Å²	144.5	89%	0.891	77%	0.769	S	S	*	*			trans	-122.6	119.9	-170.4	176.7	-173.3	178.1	-174.3	0.7	110.6
182	E	24.9	Very low	30.3	Very low	197 Å²	197	144.7 Å²	144.7	92%	0.921	77%	0.77	S	S	*	*			trans	-134.7	157.5	161.3	-77.5	-158.4	127.3	0	0	110.2
183	G	35	Very low	30.5	Very low	62 Å²	62	144.9 Å²	144.9	64%	0.639	77%	0.771	S	S	*	*	S	Bend	trans	85.5	145.6	172.7	0	0	0	0	0	115.4
184	S	40.8	Very low	30.7	Very low	138 Å²	138	147 Å²	147	97%	0.965	78%	0.779	S	S	*	*	S	Bend	trans	-105	61.5	-172.4	-60.7	0	0	0	0	113
185	S	28.8	Very low	30.4	Very low	87 Å²	87	142.8 Å²	142.8	61%	0.608	78%	0.78	S	S	*	*			trans	-150.6	151.1	160.3	86.3	0	0	0	0	111.5
186	P	34.8	Very low	30.4	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	78%	0.782	S	S	*	*	S	Bend	trans	-90.9	-5.7	-163.5	-6.9	26.6	0	0	0	116.1
187	F	32.5	Very low	30	Very low	193 Å²	193	150.6 Å²	150.6	85%	0.846	79%	0.794	S	S	*	*	S	Bend	trans	-135.7	56	-160.9	-64.8	-67	0	0	0	115.5
188	S	28.9	Very low	29.7	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	80%	0.797	S	S	*	*			trans	-161	120.2	158.9	44.6	0	0	0	0	112.9
189	V	28.6	Very low	29.4	Very low	135 Å²	135	145.1 Å²	145.1	82%	0.818	79%	0.79	S	S	*	*			trans	-135.5	118.9	162.3	179.2	0	0	0	0	107.4
190	R	29.4	Very low	29.2	Very low	210 Å²	210	144.6 Å²	144.6	79%	0.792	79%	0.794	S	S	*	*			trans	-87.7	149.4	165.4	-87.5	-172.7	169.5	-159.1	-0.5	109.6	E192	R190-E192 IonicContact NH1-OE1 3.34Å; R190-E192 PolarHBondContact NH1-OE1 2.9Å
191	V	29.9	Very low	28.8	Very low	111 Å²	111	143.4 Å²	143.4	67%	0.673	79%	0.787	S	S	*	*			trans	-97	121.8	161.1	-179.1	0	0	0	0	107
192	E	29.5	Very low	28.5	Very low	155 Å²	155	140.3 Å²	140.3	72%	0.724	78%	0.78	S	S	*	*			trans	-121.9	149.4	165	-67.6	-173.2	177.1	0	0	107.9	R190	R190-E192 IonicContact NH1-OE1 3.34Å; R190-E192 PolarHBondContact NH1-OE1 2.9Å
193	E	27.2	Very low	28.4	Very low	164 Å²	164	138 Å²	138	77%	0.766	77%	0.769	S	S	*	*			trans	-138.1	150.8	-158.6	-157.8	176.8	-122.1	0	0	111.8
194	V	32.7	Very low	27.9	Very low	141 Å²	141	145.2 Å²	145.2	86%	0.855	78%	0.779	S	S	*	*			trans	71.9	119.8	173.6	-166.2	0	0	0	0	117.2
195	G	25.6	Very low	27	Very low	79 Å²	79	148.4 Å²	148.4	81%	0.814	77%	0.771	S	S	*	*			trans	178	98.2	165.3	0	0	0	0	0	113.2
196	K	26	Very low	26.7	Very low	208 Å²	208	152.3 Å²	152.3	90%	0.904	78%	0.78	S	S	*	*			trans	-93.9	129.7	177.3	-78.4	-179	176.1	175.2	0	112
197	M	22.3	Very low	26.2	Very low	186 Å²	186	154.3 Å²	154.3	92%	0.916	78%	0.777	S	S	*	*			trans	173.1	155.1	142.9	-98.1	177.8	-172.9	0	0	108.9
198	V	23.2	Very low	25.8	Very low	126 Å²	126	151.7 Å²	151.7	76%	0.764	77%	0.768	S	S	*	*			cis	-176.6	152.5	-31.1	124.8	0	0	0	0	106.4
199	A	25.8	Very low	25.5	Very low	82 Å²	82	155.8 Å²	155.8	68%	0.678	78%	0.775	S	S	*	*			trans	66.5	159.2	169.5	0	0	0	0	0	116.7
200	Q	24.4	Very low	25.2	Very low	173 Å²	173	152.7 Å²	152.7	81%	0.808	77%	0.771	S	S	*	*			cis	-164.2	131.4	-13.9	-106.9	173.2	15.6	0	0	105.7
201	T	23	Very low	25.9	Very low	115 Å²	115	149.4 Å²	149.4	71%	0.706	78%	0.776	S	S	*	*				108.3	142.5	74	-73.9	0	0	0	0	114.3
202	K	25.3	Very low	25.6	Very low	171 Å²	171	148.1 Å²	148.1	74%	0.743	79%	0.786	S	S	*	*			trans	75.7	128.1	169	-78.8	174	178.6	178.9	0	117.5
203	Q	23.7	Very low	25.4	Very low	150 Å²	150	144.6 Å²	144.6	70%	0.701	79%	0.791	S	S	*	*				76	116.6	63.9	-72.3	-174.5	-32.7	0	0	114.4
204	Y	22.7	Very low	25.2	Very low	213 Å²	213	140.8 Å²	140.8	84%	0.835	80%	0.796	S	S	*	*				-168.5	-159.2	100.7	-126.1	-92.7	0	0	0	113.5
205	Y	23.6	Very low	24.9	Very low	204 Å²	204	139.2 Å²	139.2	80%	0.8	80%	0.798	S	S	*	*			trans	-132.9	176.8	-158.3	-142.3	-86.8	0	0	0	110.9
206	Q	22.7	Very low	24.9	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	80%	0.796	S	S	*	*			trans	71.9	168.5	165.1	-64.9	-174.9	-36.2	0	0	118.6
207	K	23.6	Very low	24.8	Very low	151 Å²	151	138.2 Å²	138.2	66%	0.657	80%	0.798	S	S	*	*			cis	-172.9	135.3	-48	-156.7	-160	-176.3	-145.4	0	109.2
208	E	24.1	Very low	24.9	Very low	139 Å²	139	132.7 Å²	132.7	65%	0.65	79%	0.789	S	S	*	*			trans	66.9	164.8	149.9	-93.8	167.1	-158.9	0	0	123.9
209	E	22.2	Very low	24.9	Very low	189 Å²	189	133.9 Å²	133.9	88%	0.883	80%	0.796	S	S	*	*			trans	75.6	143.7	165.5	-45.7	-144.7	138.6	0	0	121.4
210	G	23.4	Very low	24.8	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	80%	0.799	S	S	*	*			trans	-121.6	-130.9	171.6	0	0	0	0	0	109.2
211	P	42.3	Very low	24.8	Very low	140 Å²	140	131.2 Å²	131.2	91%	0.909	80%	0.797	S	S	*	*			cis	-136.1	-175.7	-15.2	42.1	-25.8	0	0	0	113.8
212	G	24.2	Very low	24.9	Very low	85 Å²	85	133.2 Å²	133.2	88%	0.876	80%	0.803	S	S	*	*			trans	108.8	151.4	160.1	0	0	0	0	0	116.6
213	G	24.8	Very low	24.8	Very low	81 Å²	81	129.3 Å²	129.3	84%	0.835	80%	0.796	S	S	*	*			cis	174.2	167.5	-6.4	0	0	0	0	0	114.1
214	G	24.3	Very low	24.8	Very low	84 Å²	84	131.1 Å²	131.1	87%	0.866	80%	0.801	S	S	*	*			trans	84.4	149.2	174.9	0	0	0	0	0	115.3
215	A	25.3	Very low	24.9	Very low	108 Å²	108	125.7 Å²	125.7	89%	0.893	79%	0.79	S	S	*	*			cis	-149.9	176.9	-3.7	0	0	0	0	0	110.8
216	S	26.1	Very low	25	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	79%	0.793	S	S	*	*			trans	-134.6	143	-159	59.2	0	0	0	0	116.7
217	T	24	Very low	25	Very low	153 Å²	153	120.5 Å²	120.5	94%	0.939	79%	0.794	S	S	*	*			trans	-150.9	138.7	148.1	38.6	0	0	0	0	108.6
218	G	23.5	Very low	25.1	Very low	70 Å²	70	121.8 Å²	121.8	72%	0.722	81%	0.808	S	S	*	*			cis	-162.7	-177.4	-5	0	0	0	0	0	113.6
219	V	24.6	Very low	25.1	Very low	152 Å²	152	118.9 Å²	118.9	92%	0.921	82%	0.815	S	S	*	*			trans	-31.2	153.8	174.1	-109	0	0	0	0	117.4
220	A	23.4	Very low	25.4	Very low	89 Å²	89	119.4 Å²	119.4	74%	0.736	82%	0.818	S	S	*	*			cis	-154.6	168.5	15.1	0	0	0	0	0	115.2
221	S	24.3	Very low	25.3	Very low	110 Å²	110	124.9 Å²	124.9	77%	0.769	83%	0.825	S	S	*	*			trans	-86.2	-177	162.6	-41.3	0	0	0	0	110.9
222	L	25	Very low	24.4	Very low	157 Å²	157	122.7 Å²	122.7	82%	0.822	81%	0.813	S	S	*	*			cis	-159.5	-159.7	15.2	-154.2	65.4	0	0	0	105.7
223	C	23	Very low	24.3	Very low	88 Å²	88	127.9 Å²	127.9	60%	0.595	81%	0.811	S	S	*	*			cis	-169.2	144.9	0.2	-156.2	0	0	0	0	111.1
224	K	24.4	Very low	24.8	Very low	188 Å²	188	129.8 Å²	129.8	82%	0.817	81%	0.809	S	S	*	*			trans	61.4	164.4	145.5	-85.3	-171.5	173.1	-168.1	0	121.2
225	V	24.6	Very low	24.9	Very low	100 Å²	100	130.2 Å²	130.2	61%	0.606	80%	0.804	S	S	*	*			cis	-166.6	157	-32.6	99.8	0	0	0	0	110.8
226	E	24.2	Very low	24.8	Very low	186 Å²	186	132.5 Å²	132.5	87%	0.869	80%	0.801	S	S	*	*			trans	30.8	141.5	158.5	-61.4	155.7	179	0	0	123.5
227	G	24.1	Very low	24.8	Very low	78 Å²	78	131.5 Å²	131.5	80%	0.804	80%	0.795	S	S	*	*			trans	140	120.8	149.7	0	0	0	0	0	116.5
228	D	24.7	Very low	24.9	Very low	178 Å²	178	132.3 Å²	132.3	95%	0.952	79%	0.787	S	S	*	*			trans	-93.7	145.4	176	-62.1	-71.4	0	0	0	113.2
229	G	24.9	Very low	25	Very low	78 Å²	78	133.7 Å²	133.7	80%	0.804	78%	0.782	S	S	*	*			trans	166.1	121.1	170.1	0	0	0	0	0	114.2
230	E	28.1	Very low	25.1	Very low	200 Å²	200	131.6 Å²	131.6	94%	0.935	77%	0.774	S	S	*	*			trans	-44.2	129.3	-174.9	-55.6	176.4	118.1	0	0	116.6
231	E	22.3	Very low	25.2	Very low	185 Å²	185	135.6 Å²	135.6	86%	0.864	78%	0.775	S	S	*	*			trans	-159.5	-163.5	148.8	-124.7	-141.5	86.4	0	0	116.5
232	S	22.1	Very low	25.3	Very low	94 Å²	94	134.8 Å²	134.8	66%	0.657	76%	0.762	S	S	*	*			trans	-86.4	172.4	-151.1	58.5	0	0	0	0	118.7
233	K	23.2	Very low	25.6	Very low	195 Å²	195	138.4 Å²	138.4	85%	0.848	77%	0.765	S	S	*	*			trans	-66.7	159.7	162.6	-64.9	179.4	-179.9	177.9	0	110.1
234	P	35.5	Very low	25.7	Very low	120 Å²	120	137.7 Å²	137.7	78%	0.779	76%	0.755	S	S	*	*			cis	-146.9	-172.8	30	42.9	-22.5	0	0	0	117.3
235	A	25.7	Very low	26	Very low	93 Å²	93	136.2 Å²	136.2	77%	0.769	75%	0.751	S	S	*	*			trans	66.5	137.6	178.5	0	0	0	0	0	114.3
236	D	23	Very low	26.2	Very low	156 Å²	156	136.7 Å²	136.7	83%	0.834	75%	0.749	S	S	*	*			cis	-142.4	-168.9	38.1	-134.3	-36.9	0	0	0	115.3
237	S	25.6	Very low	26.6	Very low	92 Å²	92	133.9 Å²	133.9	64%	0.643	74%	0.739	S	S	*	*			trans	-68.9	156.3	-164.9	61.4	0	0	0	0	120.7
238	H	26	Very low	26.8	Very low	169 Å²	169	133.9 Å²	133.9	78%	0.782	72%	0.723	S	S	*	*			trans	1.1	149.1	146	-64.3	-90.3	0	0	0	119.7
239	T	25.5	Very low	27.2	Very low	99 Å²	99	133.3 Å²	133.3	61%	0.607	71%	0.714	S	S	*	*			cis	-161.7	159	22.7	-16.9	0	0	0	0	111.6	F241	T239-F241 HydrophobicContact CG2-CD2 4.47Å; T239-F241 HydrophobicContact CG2-CE2 4.15Å
240	S	28.1	Very low	27.4	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	71%	0.705	S	S	*	*			trans	-101.6	151.4	163.8	54.1	0	0	0	0	112.3
241	F	25.8	Very low	27.6	Very low	174 Å²	174	130 Å²	130	76%	0.763	69%	0.688	S	S	*	*			trans	-149.1	160.7	172.2	-93.4	-69.9	0	0	0	113.4	T239	T239-F241 HydrophobicContact CG2-CD2 4.47Å; T239-F241 HydrophobicContact CG2-CE2 4.15Å
242	N	26.2	Very low	28.4	Very low	93 Å²	93	128.4 Å²	128.4	50%	0.497	69%	0.685	S	S	.	*			trans	-89.9	178.7	-162.2	-62.8	-52.4	0	0	0	114.8	D264	N242-D264 HydrophobicContact CB-CB 3.78Å; N242-D264 WeakPolarHBondContact ND2-CB 3.22Å; N242-D264 PolarHBondContact ND2-O 3.35Å
243	R	29.8	Very low	29.1	Very low	232 Å²	232	130.8 Å²	130.8	88%	0.875	69%	0.69	S	S	*	*			trans	-148.3	90.2	162.5	-152	172.3	-172.8	179.8	0.8	113.6
244	D	26.2	Very low	29.7	Very low	73 Å²	73	127.3 Å²	127.3	39%	0.39	68%	0.681	S	S	.	*			trans	25.5	121.4	156.3	-38.4	-24.5	0	0	0	120.3	K261	D244-K261 WeakPolarHBondContact OD2-CE 3.35Å; D244-K261 IonicContact OD2-NZ 2.7Å; D244-K261 PolarHBondContact OD2-NZ 3.33Å
245	Q	29.8	Very low	29.9	Very low	157 Å²	157	130.7 Å²	130.7	73%	0.734	69%	0.686	S	S	*	*			trans	-96.7	156.9	153.5	-73.2	-170.1	-3.3	0	0	112.3
246	I	29.1	Very low	30.2	Very low	110 Å²	110	130.9 Å²	130.9	56%	0.564	68%	0.678	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-125.4	134.2	175.3	-58.2	174.1	0	0	0	108.3	V248 V259	I246-V248 HydrophobicContact CG2-CG2 4.39Å; I246-V259 HydrophobicContact CG2-CG1 3.9Å
247	I	32.5	Very low	30.5	Very low	127 Å²	127	129.1 Å²	129.1	65%	0.651	67%	0.668	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114	140.5	178	-58.7	174.9	0	0	0	108.4
248	V	29.7	Very low	30.8	Very low	79 Å²	79	131.4 Å²	131.4	48%	0.479	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.8	120.7	177.6	-176.4	0	0	0	0	109.1	I246 L257 V259	I246-V248 HydrophobicContact CG2-CG2 4.39Å; V248-L257 HydrophobicContact CG1-CD2 3.76Å; V248-V259 HydrophobicContact CG2-CG2 4.3Å
249	E	31.3	Very low	31.2	Very low	165 Å²	165	128.1 Å²	128.1	77%	0.771	67%	0.665	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.1	148.2	171.3	-65	-172.6	143.7	0	0	110.3
250	V	29.6	Very low	31.6	Very low	101 Å²	101	127.9 Å²	127.9	61%	0.612	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.8	114.1	-177.6	-177.6	0	0	0	0	109.9	L257	V250-L257 HydrophobicContact CG2-CD2 4.14Å
251	N	32.7	Very low	31.7	Very low	107 Å²	107	129.3 Å²	129.3	57%	0.572	66%	0.66	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.8	115.3	175.7	-172.3	-29.9	0	0	0	110.3	N253	N251-N253 PolarHBondContact O-N 3.04Å; N251-N253 PolarHBondContact OD1-N 3.39Å
252	L	39	Very low	32	Very low	152 Å²	152	123 Å²	123	80%	0.796	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-14.7	-167.1	-76.1	167.1	0	0	0	115.4
253	N	36.1	Very low	32.1	Very low	145 Å²	145	124 Å²	124	78%	0.775	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-18.6	-173.8	-75	4.4	0	0	0	114.6	N251	N251-N253 PolarHBondContact O-N 3.04Å; N251-N253 PolarHBondContact OD1-N 3.39Å
254	N	37.1	Very low	32	Very low	122 Å²	122	117 Å²	117	65%	0.652	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	2.4	-168.2	-73.3	73.4	0	0	0	115.6	T256	N254-T256 PolarHBondContact O-N 3.44Å
255	Q	39.7	Very low	32.3	Very low	190 Å²	190	116.7 Å²	116.7	89%	0.888	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.4	46.1	174.2	-60.7	-170	12.9	0	0	115.8
256	T	30.6	Very low	32	Very low	97 Å²	97	117.7 Å²	117.7	60%	0.595	65%	0.653	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-125.7	149	169.6	50.7	0	0	0	0	111.7	N254	N254-T256 PolarHBondContact O-N 3.44Å
257	L	30.8	Very low	32	Very low	120 Å²	120	117.3 Å²	117.3	63%	0.628	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.7	126.4	178.2	-96.9	163.5	0	0	0	108.5	V248 V250	V248-L257 HydrophobicContact CG1-CD2 3.76Å; V250-L257 HydrophobicContact CG2-CD2 4.14Å
258	N	32.4	Very low	31.6	Very low	139 Å²	139	116.9 Å²	116.9	74%	0.743	67%	0.669	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.8	142.2	168.8	-77.5	-11.7	0	0	0	108.7
259	V	33.2	Very low	31.3	Very low	101 Å²	101	118.7 Å²	118.7	61%	0.612	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.3	128.6	175.4	-177.2	0	0	0	0	107.9	I246 V248	I246-V259 HydrophobicContact CG2-CG1 3.9Å; V248-V259 HydrophobicContact CG2-CG2 4.3Å
260	S	33.6	Very low	30.9	Very low	93 Å²	93	117.9 Å²	117.9	65%	0.65	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.6	151.2	171.6	56.3	0	0	0	0	109.5
261	K	31.6	Very low	30.5	Very low	139 Å²	139	119.4 Å²	119.4	60%	0.604	69%	0.69	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.8	120.6	-176.2	-166.2	-172.4	177.8	-160.9	0	109.8	D244	D244-K261 WeakPolarHBondContact OD2-CE 3.35Å; D244-K261 IonicContact OD2-NZ 2.7Å; D244-K261 PolarHBondContact OD2-NZ 3.33Å
262	G	31.1	Very low	30.2	Very low	41 Å²	41	122.8 Å²	122.8	42%	0.423	70%	0.702	S	S	.	*			trans	-75.7	155.8	174.9	0	0	0	0	0	112.3
263	S	29.2	Very low	29.5	Very low	113 Å²	113	121.3 Å²	121.3	79%	0.79	70%	0.701	S	S	*	*			trans	-131.7	126.4	170.5	51.7	0	0	0	0	110
264	D	27.8	Very low	29.1	Very low	86 Å²	86	121.8 Å²	121.8	46%	0.46	70%	0.701	S	S	.	*			trans	-85.3	123.2	-167.2	-69.6	-59.6	0	0	0	114	N242	N242-D264 HydrophobicContact CB-CB 3.78Å; N242-D264 WeakPolarHBondContact ND2-CB 3.22Å; N242-D264 PolarHBondContact ND2-O 3.35Å
265	G	30.5	Very low	28.4	Very low	66 Å²	66	126.3 Å²	126.3	68%	0.68	72%	0.715	S	S	*	*				78.1	130.9	116.7	0	0	0	0	0	120.3
266	K	25.1	Very low	27.5	Very low	178 Å²	178	120.8 Å²	120.8	77%	0.774	71%	0.709	S	S	*	*			trans	-150.9	146.1	146.7	-152.7	154.9	-169.9	165.6	0	112.2
267	S	27.7	Very low	27.4	Very low	103 Å²	103	127 Å²	127	72%	0.72	72%	0.722	S	S	*	*			trans	-128.7	146.1	174.9	175.8	0	0	0	0	109.4
268	S	23.8	Very low	27	Very low	117 Å²	117	127.7 Å²	127.7	82%	0.818	74%	0.735	S	S	*	*			trans	-152.7	154.1	167	-79.9	0	0	0	0	109.2
269	T	23.8	Very low	26.7	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.724	73%	0.729	S	S	*	*			trans	-124.7	157.6	-162.9	41.2	0	0	0	0	114.4
270	I	24.5	Very low	26.3	Very low	148 Å²	148	131.9 Å²	131.9	76%	0.759	74%	0.743	S	S	*	*			trans	65.9	111.4	155.9	-61.5	149.8	0	0	0	117.8
271	T	20.3	Very low	25.8	Very low	133 Å²	133	133.6 Å²	133.6	82%	0.816	75%	0.745	S	S	*	*				-176.8	138.7	113.6	18.3	0	0	0	0	111.4
272	E	27.1	Very low	25.5	Very low	177 Å²	177	135.4 Å²	135.4	83%	0.827	76%	0.755	S	S	*	*			trans	-82.6	155.7	147.7	-74.8	-163.8	143.9	0	0	108.5
273	P	24.1	Very low	25.3	Very low	121 Å²	121	143.5 Å²	143.5	79%	0.786	77%	0.773	S	S	*	*				-135.6	161.8	104.5	38.3	-30.5	0	0	0	114.4
274	M	27	Very low	25.1	Very low	155 Å²	155	144.5 Å²	144.5	76%	0.764	77%	0.77	S	S	*	*			trans	-60.5	145.2	170.5	-52.5	174.8	77.8	0	0	112
275	F	22	Very low	25.2	Very low	217 Å²	217	144.7 Å²	144.7	95%	0.952	78%	0.778	S	S	*	*				168.5	162.3	119.8	-100.6	-76	0	0	0	110.3
276	G	22.2	Very low	25.2	Very low	74 Å²	74	150.4 Å²	150.4	76%	0.763	79%	0.787	S	S	*	*			trans	119.7	60.8	165.6	0	0	0	0	0	117
277	R	27.8	Very low	25.4	Very low	229 Å²	229	145 Å²	145	86%	0.864	78%	0.781	S	S	*	*			trans	-78.8	117.5	166	177.2	-164.2	-171.8	-172.6	4.8	110
278	C	22.7	Very low	25.6	Very low	133 Å²	133	147.7 Å²	147.7	90%	0.899	79%	0.788	S	S	*	*			trans	-129.5	144.8	158.2	-77.6	0	0	0	0	109.5
279	H	24.6	Very low	26.1	Very low	135 Å²	135	150.9 Å²	150.9	63%	0.625	79%	0.79	S	S	*	*			trans	-156.3	97.2	-170	-173.5	-36.8	0	0	0	111.1	N281	H279-N281 PolarHBondContact CE1-OD1 3.31Å
280	E	24.7	Very low	26.5	Very low	194 Å²	194	153.4 Å²	153.4	91%	0.907	80%	0.799	S	S	*	*			trans	-148	116.4	170.4	-96	148.2	-151.7	0	0	104.7
281	N	23.3	Very low	26.6	Very low	129 Å²	129	153.5 Å²	153.5	69%	0.69	80%	0.801	S	S	*	*			cis	72.7	75.7	37.9	-77.3	11.6	0	0	0	116.3	H279	H279-N281 PolarHBondContact CE1-OD1 3.31Å
282	E	25	Very low	27.2	Very low	176 Å²	176	156.6 Å²	156.6	82%	0.822	81%	0.806	S	S	*	*			trans	-154.5	124.1	137.2	-103.8	155.6	-164	0	0	106.1
283	R	28	Very low	27.4	Very low	211 Å²	211	156.3 Å²	156.3	80%	0.796	81%	0.807	S	S	*	*				66.2	132.7	68.3	-87.7	-164.7	-80.4	-159.9	-1.7	113.3
284	D	24.9	Very low	27.6	Very low	134 Å²	134	158.1 Å²	158.1	72%	0.717	81%	0.805	S	S	*	*			cis	-137.9	177.1	14.9	-80	-56.9	0	0	0	113.7
285	S	30.1	Very low	27.6	Very low	91 Å²	91	158.1 Å²	158.1	64%	0.636	81%	0.808	S	S	*	*			trans	21.4	149.6	148.5	-68.9	0	0	0	0	122.5
286	E	31.3	Very low	28	Very low	186 Å²	186	151.3 Å²	151.3	87%	0.869	80%	0.799	S	S	*	*			cis	-165.2	161.7	1.4	-103.4	147.7	-133	0	0	105.8
287	G	28.8	Very low	28.1	Very low	63 Å²	63	155.4 Å²	155.4	65%	0.649	80%	0.803	S	S	*	*			cis	-175.8	-171.7	2.1	0	0	0	0	0	110.1
288	D	31	Very low	28.1	Very low	160 Å²	160	147.8 Å²	147.8	86%	0.856	80%	0.796	S	S	*	*			trans	47.7	97.8	168.9	-53.4	-11.3	0	0	0	117.2
289	E	34.1	Very low	28.8	Very low	184 Å²	184	148.9 Å²	148.9	86%	0.86	78%	0.781	S	S	*	*				62.7	111.4	55.6	-59.9	-154.4	166.6	0	0	116.5
290	D	32.2	Very low	29.1	Very low	171 Å²	171	149.8 Å²	149.8	91%	0.914	79%	0.786	S	S	*	*			trans	-154	94.2	151.4	-132.6	-12.4	0	0	0	108.2
291	N	28.1	Very low	29.4	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	78%	0.775	S	S	*	*			trans	-131.8	115.4	-174	-103	-44	0	0	0	110.3
292	E	32.9	Very low	29.9	Very low	197 Å²	197	151 Å²	151	92%	0.921	79%	0.787	S	S	*	*			trans	-122.5	138.6	163.4	-75.8	-156.4	142.4	0	0	111.4
293	M	29.5	Very low	29.9	Very low	171 Å²	171	146 Å²	146	84%	0.842	78%	0.783	S	S	*	*			trans	-97.5	129.8	-171.2	-55.8	177.2	-171.7	0	0	111.5	N295	M293-N295 PolarHBondContact O-N 2.96Å
294	E	30.2	Very low	29.9	Very low	160 Å²	160	141.9 Å²	141.9	75%	0.748	78%	0.777	S	S	*	*			trans	-80.8	103.9	167.2	-75.9	-177.9	122.8	0	0	110.7	K576	E294-K576 IonicContact OE2-NZ 2.6Å; E294-K576 PolarHBondContact OE2-NZ 3.43Å
295	N	26.3	Very low	30.1	Very low	154 Å²	154	145 Å²	145	82%	0.824	79%	0.787	S	S	*	*			trans	-101.6	141.8	155.9	-83.5	-67.8	0	0	0	109	M293	M293-N295 PolarHBondContact O-N 2.96Å
296	G	29.4	Very low	30	Very low	74 Å²	74	146.6 Å²	146.6	76%	0.763	79%	0.788	S	S	*	*			trans	-109.7	-161.7	-165	0	0	0	0	0	116.6
297	D	25.1	Very low	30	Very low	161 Å²	161	145.9 Å²	145.9	86%	0.861	79%	0.79	S	S	*	*			trans	69	160.6	176.5	-139	-21.6	0	0	0	117
298	G	27.3	Very low	29.9	Very low	69 Å²	69	151.6 Å²	151.6	71%	0.711	80%	0.797	S	S	*	*			trans	119.3	113.1	178.7	0	0	0	0	0	114.5
299	R	38.8	Very low	29.7	Very low	155 Å²	155	154.9 Å²	154.9	59%	0.585	80%	0.797	S	S	*	*			trans	-92	142.1	164.3	-53.7	178.6	-162.8	-175	2.5	109.7	Q555	R299-Q555 VanDerWaalsContact CZ-OE1 3.28Å
300	E	30	Very low	29.3	Very low	154 Å²	154	152 Å²	152	72%	0.72	79%	0.792	S	S	*	*			trans	-127.5	122.7	158.6	-66.3	-174	161.8	0	0	107.9	S637	E300-S637 WeakPolarHBondContact OE2-CB 3.45Å; E300-S637 PolarHBondContact OE2-OG 3.45Å
301	E	32	Very low	28.9	Very low	146 Å²	146	151.1 Å²	151.1	68%	0.682	79%	0.788	S	S	*	*			trans	-93	123.4	169	-70.6	-172.1	143.6	0	0	109.2	Q534	E301-Q534 PolarHBondContact OE1-NE2 3.27Å
302	E	32.7	Very low	29	Very low	203 Å²	203	151.7 Å²	151.7	95%	0.949	79%	0.789	S	S	*	*			trans	-163.8	154.3	148	-73.4	-153.4	151.5	0	0	105.4
303	G	26	Very low	28.7	Very low	72 Å²	72	150.8 Å²	150.8	74%	0.742	79%	0.79	S	S	*	*			cis	163.9	132.4	6.4	0	0	0	0	0	105
304	D	27.5	Very low	28.4	Very low	123 Å²	123	145.6 Å²	145.6	66%	0.658	78%	0.779	S	S	*	*			trans	-81.5	139.2	-171.3	-64.3	-68.3	0	0	0	112.6	K520	D304-K520 WeakPolarHBondContact OD2-CE 3.28Å; D304-K520 IonicContact OD2-NZ 2.6Å; D304-K520 PolarHBondContact OD2-NZ 3.49Å
305	E	27.9	Very low	28.1	Very low	201 Å²	201	147.2 Å²	147.2	94%	0.939	79%	0.787	S	S	*	*			trans	-132.9	140.9	140.1	-79	-155.2	156.7	0	0	110.1
306	D	29.5	Very low	28.3	Very low	123 Å²	123	146.4 Å²	146.4	66%	0.658	79%	0.788	S	S	*	*			trans	-99.6	127.3	-167.6	-167.3	2.7	0	0	0	110.6
307	L	30.3	Very low	28.1	Very low	171 Å²	171	148.1 Å²	148.1	90%	0.895	79%	0.788	S	S	*	*			trans	-143.3	114.4	158.6	-85.3	-171	0	0	0	111.2
308	K	28.2	Very low	28.4	Very low	184 Å²	184	144.3 Å²	144.3	80%	0.8	79%	0.786	S	S	*	*			trans	-78.2	126.1	170.6	-65.2	162.5	-172.8	154.4	0	110.2
309	R	25.4	Very low	28.3	Very low	228 Å²	228	149.4 Å²	149.4	86%	0.86	79%	0.792	S	S	*	*			trans	-142.6	135.2	143.4	-160.9	167.5	-176.9	150	2.1	110.3
310	T	26	Very low	27.8	Very low	123 Å²	123	151 Å²	151	76%	0.755	81%	0.806	S	S	*	*			trans	-78.9	136.8	170	47.8	0	0	0	0	109.8
311	D	24.1	Very low	27.6	Very low	153 Å²	153	149 Å²	149	82%	0.818	80%	0.8	S	S	*	*			trans	-144.3	143.8	146.8	-87.4	-52.7	0	0	0	109
312	I	30	Very low	27.4	Very low	164 Å²	164	148.4 Å²	148.4	84%	0.841	80%	0.797	S	S	*	*			trans	-110.6	110.1	-175.7	-62.2	168.6	0	0	0	108.4
313	L	27.1	Very low	27.3	Very low	178 Å²	178	145.9 Å²	145.9	93%	0.932	79%	0.785	S	S	*	*			trans	-147.1	126	151.9	-92.7	177.9	0	0	0	107.5
314	G	23.1	Very low	27.3	Very low	61 Å²	61	149.7 Å²	149.7	63%	0.629	79%	0.789	S	S	*	*			trans	-99.1	147.5	178.5	0	0	0	0	0	111.5
315	H	24.1	Very low	27.4	Very low	195 Å²	195	148.1 Å²	148.1	90%	0.903	78%	0.778	S	S	*	*			trans	-145.8	153.7	147	-105.6	-69.9	0	0	0	110.5
316	T	29.1	Very low	27.5	Very low	137 Å²	137	144.2 Å²	144.2	84%	0.84	76%	0.759	S	S	*	*			trans	-88.8	132.2	-169.2	48.5	0	0	0	0	112.8
317	S	26.2	Very low	27.5	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	75%	0.751	S	S	*	*			trans	-143.1	136.3	154.4	54.5	0	0	0	0	107.8
318	G	30.3	Very low	27.4	Very low	80 Å²	80	143 Å²	143	83%	0.825	75%	0.745	S	S	*	*			trans	-70.1	143.9	-178.9	0	0	0	0	0	112.1
319	E	26.3	Very low	27.4	Very low	177 Å²	177	139 Å²	139	83%	0.827	73%	0.729	S	S	*	*			trans	-116.3	128	162.1	-67.5	-177.3	147.9	0	0	106.7	D321	E319-D321 PolarHBondContact O-N 3.01Å
320	E	27.2	Very low	27.5	Very low	187 Å²	187	137.7 Å²	137.7	87%	0.874	73%	0.733	S	S	*	*			trans	-84.8	100.2	-179.8	-65.4	-178.9	149.5	0	0	108.4	E322	E320-E322 VanDerWaalsContact C-N 3.3Å; E320-E322 PolarHBondContact O-N 3.41Å
321	D	26.7	Very low	27.6	Very low	112 Å²	112	139 Å²	139	60%	0.599	73%	0.73	S	S	*	*			trans	-65.2	82.4	176.3	-80.2	-37.1	0	0	0	109.8	E319 E323 K492	E319-D321 PolarHBondContact O-N 3.01Å; D321-E323 PolarHBondContact O-N 3.38Å; D321-K492 IonicContact OD2-NZ 3.88Å; D321-K492 PolarHBondContact OD2-NZ 3.22Å
322	E	28.4	Very low	28.1	Very low	135 Å²	135	140.3 Å²	140.3	63%	0.631	73%	0.732	S	S	*	*			trans	-68.1	94.9	164.4	-86	-173.5	-157.5	0	0	109.7	E320 D324 K581	E320-E322 VanDerWaalsContact C-N 3.3Å; E320-E322 PolarHBondContact O-N 3.41Å; E322-D324 PolarHBondContact O-N 3.27Å; E322-K581 IonicContact OE1-NZ 2.77Å; E322-K581 PolarHBondContact OE1-NZ 3.44Å; E322-K581 IonicContact OE2-NZ 3.81Å; E322-K581 PolarHBondContact OE2-NZ 3.04Å
323	E	29.1	Very low	27.9	Very low	149 Å²	149	138.7 Å²	138.7	70%	0.696	73%	0.725	S	S	*	*			trans	-75.6	88.7	176.4	-66.7	-171.7	148	0	0	111.2	D321 E325	D321-E323 PolarHBondContact O-N 3.38Å; E323-E325 PolarHBondContact O-N 3.05Å
324	D	26.4	Very low	28.2	Very low	153 Å²	153	135.7 Å²	135.7	82%	0.818	71%	0.714	S	S	*	*			trans	-64.1	91.6	168.2	-106.2	-22.9	0	0	0	110.7	E322 E326	E322-D324 PolarHBondContact O-N 3.27Å; D324-E326 VanDerWaalsContact C-N 3.32Å; D324-E326 PolarHBondContact O-N 2.6Å
325	E	30.9	Very low	28.5	Very low	90 Å²	90	139.5 Å²	139.5	42%	0.421	72%	0.719	S	S	.	*			trans	-71.5	76.4	174.2	-67.4	-177.9	128.1	0	0	112	E323 E327 K462	E323-E325 PolarHBondContact O-N 3.05Å; E325-E327 PolarHBondContact O-N 3.3Å; E325-K462 IonicContact OE2-NZ 2.71Å
326	E	29.1	Very low	28.6	Very low	118 Å²	118	137.1 Å²	137.1	55%	0.551	71%	0.713	S	S	*	*			trans	-68.6	108.1	161.9	-67.4	-148.9	149	0	0	109.8	D324 E328 R557	D324-E326 VanDerWaalsContact C-N 3.32Å; D324-E326 PolarHBondContact O-N 2.6Å; E326-E328 PolarHBondContact O-N 3.08Å; E326-R557 IonicContact OE1-CZ 3.63Å; E326-R557 IonicContact OE1-NH1 2.8Å; E326-R557 PolarHBondContact OE1-NH1 3.38Å; E326-R557 IonicContact OE1-NH2 3.84Å; E326-R557 PolarHBondContact OE1-NH2 3.22Å
327	E	28.8	Very low	28.7	Very low	106 Å²	106	138.5 Å²	138.5	50%	0.495	71%	0.714	S	S	.	*			trans	-63	99.9	171.4	-72.1	-165.2	133.4	0	0	110.3	E325 E329	E325-E327 PolarHBondContact O-N 3.3Å; E327-E329 PolarHBondContact O-N 3.42Å
328	E	28.9	Very low	28.8	Very low	164 Å²	164	139.2 Å²	139.2	77%	0.766	72%	0.715	S	S	*	*			trans	-67.9	91.2	166.2	-75	-169.7	151.9	0	0	109.8	E326 E330	E326-E328 PolarHBondContact O-N 3.08Å; E328-E330 PolarHBondContact O-N 2.6Å
329	E	27.9	Very low	28.5	Very low	98 Å²	98	138.8 Å²	138.8	46%	0.458	71%	0.711	S	S	.	*			trans	-72.9	116.3	166.3	-73.3	-171.4	124.3	0	0	110.9	E327 E331 K465	E327-E329 PolarHBondContact O-N 3.42Å; E329-E331 VanDerWaalsContact C-N 3.33Å; E329-E331 PolarHBondContact O-N 2.68Å; E329-K465 VanDerWaalsContact OE1-CD 3.25Å; E329-K465 WeakPolarHBondContact OE1-CD 3.5Å; E329-K465 WeakPolarHBondContact OE1-CE 3.09Å; E329-K465 IonicContact OE1-NZ 3.51Å; E329-K465 PolarHBondContact OE1-NZ 3.45Å; E329-K465 IonicContact OE2-NZ 2.66Å; E329-K465 PolarHBondContact OE2-NZ 2.8Å
330	E	28.6	Very low	28.6	Very low	201 Å²	201	138.9 Å²	138.9	94%	0.939	72%	0.717	S	S	*	*			trans	-70.4	82.8	170.3	-66.1	-177.4	151.7	0	0	110.8	E328	E328-E330 PolarHBondContact O-N 2.6Å
331	E	27.5	Very low	28.5	Very low	151 Å²	151	139 Å²	139	71%	0.706	72%	0.717	S	S	*	*			trans	-85.4	118.4	163.9	-71	-163.1	144.8	0	0	111	E329 N333	E329-E331 VanDerWaalsContact C-N 3.33Å; E329-E331 PolarHBondContact O-N 2.68Å; E331-N333 VanDerWaalsContact C-N 3.26Å; E331-N333 PolarHBondContact O-N 3.42Å
332	E	34.9	Very low	28.5	Very low	181 Å²	181	142.2 Å²	142.2	85%	0.846	73%	0.728	S	S	*	*			trans	-68	78.6	169.6	-75.9	-169.6	112.1	0	0	111.2	T334	E332-T334 PolarHBondContact O-N 3.31Å; E332-T334 PolarHBondContact O-OG1 2.76Å
333	N	25.1	Very low	28.4	Very low	130 Å²	130	141.6 Å²	141.6	70%	0.695	74%	0.736	S	S	*	*			trans	-77.6	82.8	-174.1	-143.3	-36.7	0	0	0	112.2	E331	E331-N333 VanDerWaalsContact C-N 3.26Å; E331-N333 PolarHBondContact O-N 3.42Å
334	T	33.8	Very low	28.2	Very low	114 Å²	114	140 Å²	140	70%	0.699	74%	0.737	S	S	*	*			trans	-104.2	70.3	-174.2	43.8	0	0	0	0	112.8	E332	E332-T334 PolarHBondContact O-N 3.31Å; E332-T334 PolarHBondContact O-OG1 2.76Å
335	L	30.3	Very low	28.1	Very low	141 Å²	141	138.4 Å²	138.4	74%	0.738	73%	0.732	S	S	*	*			trans	-129	110.1	168.1	-67.6	174.6	0	0	0	109.3
336	N	25.4	Very low	27.7	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	75%	0.75	S	S	*	*				62.4	103.8	81.3	-79.7	-45.4	0	0	0	113.9
337	I	30.2	Very low	27.4	Very low	166 Å²	166	143.2 Å²	143.2	85%	0.851	76%	0.761	S	S	*	*			trans	-117	122.8	160.7	-59.7	172	0	0	0	106.6
338	P	28.3	Very low	27.3	Very low	124 Å²	124	149.1 Å²	149.1	81%	0.805	78%	0.779	S	S	*	*			trans	-83.4	135.5	-175.5	31.8	-34.3	0	0	0	113.3
339	G	25	Very low	27.4	Very low	72 Å²	72	146.5 Å²	146.5	74%	0.742	78%	0.776	S	S	*	*			trans	48.7	114.1	143.8	0	0	0	0	0	120.8
340	L	27.4	Very low	27.2	Very low	179 Å²	179	152.6 Å²	152.6	94%	0.937	80%	0.795	S	S	*	*			trans	-127.1	159.4	134.6	-133.9	86.2	0	0	0	109.5
341	E	25.3	Very low	27.1	Very low	188 Å²	188	155.3 Å²	155.3	88%	0.879	80%	0.797	S	S	*	*			trans	-81.3	156.9	-151.4	-57.4	175.8	127.5	0	0	115.9
342	Q	27.5	Very low	26.9	Very low	180 Å²	180	151.2 Å²	151.2	84%	0.841	80%	0.795	S	S	*	*			trans	-89.3	155.6	164.4	-66.1	-178	-0.6	0	0	111
343	P	27.1	Very low	26.3	Very low	122 Å²	122	148.6 Å²	148.6	79%	0.792	79%	0.791	S	S	*	*			trans	-121.2	105.5	141.3	33.6	-25.4	0	0	0	113.6
344	V	23.6	Very low	26.3	Very low	117 Å²	117	153.4 Å²	153.4	71%	0.709	80%	0.8	S	S	*	*			trans	29.3	134.4	136.5	-140	0	0	0	0	121.6
345	V	24.8	Very low	25.8	Very low	119 Å²	119	152.7 Å²	152.7	72%	0.721	81%	0.805	S	S	*	*			trans	59.5	139.7	161.4	-78.3	0	0	0	0	118.4
346	M	23.3	Very low	25.5	Very low	162 Å²	162	154.3 Å²	154.3	80%	0.798	81%	0.814	S	S	*	*			cis	-145.8	158.6	45	-85.1	-67.7	-179.1	0	0	116.2
347	D	22.3	Very low	25.6	Very low	147 Å²	147	152 Å²	152	79%	0.786	82%	0.815	S	S	*	*			trans	64	149.4	149.9	-109.3	-52.2	0	0	0	124.9
348	R	26.2	Very low	25.5	Very low	229 Å²	229	150.6 Å²	150.6	86%	0.864	81%	0.814	S	S	*	*			trans	-155.3	119.7	176.9	176	-166.6	-176.6	-164.1	4.9	110.5
349	P	30.6	Very low	25.5	Very low	109 Å²	109	151.4 Å²	151.4	71%	0.708	82%	0.816	S	S	*	*			trans	-140	133.5	143.4	29.8	-11.9	0	0	0	117
350	R	24.6	Very low	25.4	Very low	227 Å²	227	151.3 Å²	151.3	86%	0.857	82%	0.815	S	S	*	*			trans	47.2	106.4	135.4	-62.7	178.9	173.1	179	-2.1	120.7
351	R	26.8	Very low	25.4	Very low	258 Å²	258	146.9 Å²	146.9	97%	0.974	81%	0.805	S	S	*	*				29	104	115	-175.6	-163.4	-95.5	-154.6	-3.8	117
352	G	21.8	Very low	25.5	Very low	65 Å²	65	144.7 Å²	144.7	67%	0.67	81%	0.805	S	S	*	*				134	148.9	118.3	0	0	0	0	0	120.3
353	T	23.9	Very low	25.4	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	81%	0.806	S	S	*	*			trans	94.1	113	148.8	-29.4	0	0	0	0	119.4
354	R	24.3	Very low	25.5	Very low	230 Å²	230	143 Å²	143	87%	0.868	81%	0.806	S	S	*	*			trans	39.9	117.8	148.7	-61.2	173.7	177.4	161.4	-1.8	118.9
355	A	22.8	Very low	25.9	Very low	99 Å²	99	146.7 Å²	146.7	82%	0.818	81%	0.807	S	S	*	*				78.5	124.7	54.7	0	0	0	0	0	115.4
356	L	25	Very low	26.2	Very low	176 Å²	176	148.7 Å²	148.7	92%	0.921	81%	0.809	S	S	*	*			trans	-141	134.2	162.8	-106	169.6	0	0	0	107.7
357	A	27.3	Very low	26.5	Very low	98 Å²	98	147 Å²	147	81%	0.81	81%	0.808	S	S	*	*			trans	-157.1	141.3	179.4	0	0	0	0	0	111.1
358	V	27.5	Very low	26.7	Very low	135 Å²	135	147.8 Å²	147.8	82%	0.818	81%	0.811	S	S	*	*			trans	-154.8	135.1	-178.9	164.7	0	0	0	0	105.6
359	V	28.4	Very low	26.7	Very low	141 Å²	141	140.5 Å²	140.5	86%	0.855	80%	0.8	S	S	*	*			cis	-157.8	156.7	-8.4	125.5	0	0	0	0	105.2
360	G	23.7	Very low	26.5	Very low	70 Å²	70	144.5 Å²	144.5	72%	0.722	81%	0.809	S	S	*	*			cis	-164.2	-155.2	0.5	0	0	0	0	0	108.4
361	A	27.6	Very low	26.5	Very low	87 Å²	87	137.6 Å²	137.6	72%	0.719	80%	0.8	S	S	*	*			cis	-157.8	165	1.6	0	0	0	0	0	112.3
362	T	25.5	Very low	26.4	Very low	142 Å²	142	132 Å²	132	87%	0.871	80%	0.795	S	S	*	*			trans	53.2	103.5	156.7	51	0	0	0	0	121.9
363	A	25.6	Very low	26.6	Very low	106 Å²	106	136.4 Å²	136.4	88%	0.876	80%	0.802	S	S	*	*				-160.9	149.3	129.6	0	0	0	0	0	111.8
364	M	29.9	Very low	26.8	Very low	161 Å²	161	136.6 Å²	136.6	79%	0.793	80%	0.804	S	S	*	*			trans	-152.9	152.6	178.2	-104.6	-162.9	-173.8	0	0	107.2
365	R	31.8	Very low	26.8	Very low	193 Å²	193	132.3 Å²	132.3	73%	0.728	80%	0.798	S	S	*	*			cis	-146	151.1	13	-101.3	157.8	-168	-165.7	1.9	108.5
366	Q	31	Very low	27	Very low	161 Å²	161	135.2 Å²	135.2	75%	0.752	80%	0.795	S	S	*	*				50.4	139.4	101.1	-47.6	177.9	-33.2	0	0	115.5
367	T	29.9	Very low	27.1	Very low	128 Å²	128	136.5 Å²	136.5	79%	0.785	79%	0.787	S	S	*	*			cis	-152.5	177.8	37.5	44.4	0	0	0	0	115
368	L	27.6	Very low	27.3	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	79%	0.789	S	S	*	*			trans	-34	167.6	162.5	-85.4	71.4	0	0	0	118.1
369	A	24.6	Very low	27.1	Very low	76 Å²	76	137.8 Å²	137.8	63%	0.628	79%	0.789	S	S	*	*			cis	-170.8	169.8	-9.8	0	0	0	0	0	113.2
370	E	26	Very low	27.1	Very low	193 Å²	193	134 Å²	134	90%	0.902	78%	0.779	S	S	*	*			trans	71	151.1	144.1	-86.8	-176.7	155.6	0	0	125.2
371	A	25.1	Very low	27.5	Very low	81 Å²	81	140.4 Å²	140.4	67%	0.669	79%	0.787	S	S	*	*			trans	83.7	110.6	146.8	0	0	0	0	0	123.4
372	T	25.7	Very low	27.5	Very low	141 Å²	141	145.6 Å²	145.6	87%	0.865	79%	0.793	S	S	*	*			trans	77.5	142.3	132.1	52.8	0	0	0	0	123.3
373	L	26.1	Very low	27.7	Very low	157 Å²	157	142.5 Å²	142.5	82%	0.822	78%	0.782	S	S	*	*			trans	-74.7	144	165.3	-60.2	151.9	0	0	0	110
374	T	26.6	Very low	27.9	Very low	130 Å²	130	145 Å²	145	80%	0.798	78%	0.78	S	S	*	*				171.3	126.1	100.8	40.2	0	0	0	0	113.6
375	N	25.8	Very low	27.8	Very low	141 Å²	141	144.3 Å²	144.3	75%	0.754	78%	0.779	S	S	*	*				60	149.4	125.6	-150.4	3.1	0	0	0	122
376	Q	27.3	Very low	27.7	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	78%	0.78	S	S	*	*			trans	70.4	153.2	166.1	-59.2	-161	57.4	0	0	118.9
377	R	26.4	Very low	27.6	Very low	202 Å²	202	140.9 Å²	140.9	76%	0.762	79%	0.787	S	S	*	*			cis	-168.8	153.5	-39.5	-145.2	176.1	-174.4	-174.8	1.7	108.2
378	Q	30.4	Very low	27.5	Very low	180 Å²	180	138.3 Å²	138.3	84%	0.841	79%	0.785	S	S	*	*			trans	68.3	148.3	175.2	-49.8	169.2	9.8	0	0	112.4
379	G	24.1	Very low	27.5	Very low	80 Å²	80	139.4 Å²	139.4	83%	0.825	79%	0.791	S	S	*	*			cis	104.4	118.9	14.8	0	0	0	0	0	109.1
380	G	28.1	Very low	27.7	Very low	63 Å²	63	139.2 Å²	139.2	65%	0.649	80%	0.797	S	S	*	*			cis	165.4	-157.7	14.2	0	0	0	0	0	106.7
381	K	32	Very low	28.1	Very low	204 Å²	204	139.6 Å²	139.6	89%	0.887	80%	0.799	S	S	*	*			trans	77.5	146.8	-168	-52.6	156.9	-173.8	169.6	0	110.9
382	K	29	Very low	28.4	Very low	196 Å²	196	145.3 Å²	145.3	85%	0.852	81%	0.809	S	S	*	*			cis	-159.6	163.4	-5.3	-111	168.4	175.3	-167.8	0	104.4
383	A	27.9	Very low	28.7	Very low	77 Å²	77	145 Å²	145	64%	0.636	81%	0.806	S	S	*	*			cis	161.6	144.1	-18.4	0	0	0	0	0	105
384	L	29.9	Very low	28.9	Very low	157 Å²	157	148.6 Å²	148.6	82%	0.822	81%	0.809	S	S	*	*			trans	71.1	147.7	171.2	-53.3	174.4	0	0	0	115.3
385	D	27.6	Very low	29.5	Very low	147 Å²	147	150.5 Å²	150.5	79%	0.786	81%	0.813	S	S	*	*			cis	-133.4	-171.7	10.2	-101.9	-47.9	0	0	0	114.3
386	A	30	Very low	30	Very low	89 Å²	89	152.4 Å²	152.4	74%	0.736	82%	0.818	S	S	*	*			trans	-64.5	171.2	-175.1	0	0	0	0	0	114.8
387	E	28.8	Very low	30.5	Very low	194 Å²	194	153.6 Å²	153.6	91%	0.907	82%	0.823	S	S	*	*			cis	-143.8	-176.1	33.8	-63.9	-177.2	102.8	0	0	114.6
388	G	28.3	Very low	31.6	Very low	73 Å²	73	152.1 Å²	152.1	75%	0.753	82%	0.822	S	S	*	*			trans	-85.4	-177.9	179.7	0	0	0	0	0	114.7
389	L	28.5	Very low	32.8	Very low	186 Å²	186	150.4 Å²	150.4	97%	0.974	81%	0.814	S	S	*	*			cis	-142.7	149.5	11.2	-89.6	160.3	0	0	0	110.7
390	G	29.1	Very low	34.7	Very low	73 Å²	73	152.6 Å²	152.6	75%	0.753	80%	0.803	S	S	*	*			trans	-176.3	110.8	172	0	0	0	0	0	112.9	K392	G390-K392 PolarHBondContact O-N 2.79Å
391	Q	33.4	Very low	36.6	Very low	200 Å²	200	152 Å²	152	94%	0.935	78%	0.782	S	S	*	*			trans	-72.6	112.6	-175.3	-74.3	165.5	-71.2	0	0	111.9	V393	Q391-V393 PolarHBondContact O-N 2.91Å
392	K	31.7	Very low	38.2	Very low	202 Å²	202	145.9 Å²	145.9	88%	0.878	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-72.2	117.4	162.5	-80.5	-175.6	174.7	177.4	0	109.7	G390 R394	G390-K392 PolarHBondContact O-N 2.79Å; K392-R394 PolarHBondContact O-N 2.96Å
393	V	32.3	Very low	40.1	Very low	135 Å²	135	137.1 Å²	137.1	82%	0.818	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-58.5	125.1	164.7	177.1	0	0	0	0	108.5	Q391 L395	Q391-V393 PolarHBondContact O-N 2.91Å; V393-L395 PolarHBondContact O-N 2.96Å
394	R	29.5	Very low	41.9	Very low	231 Å²	231	143 Å²	143	87%	0.872	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-68.2	122	170.2	-99.8	175.4	154.2	156.4	-8.5	108.4	K392 E396	K392-R394 PolarHBondContact O-N 2.96Å; R394-E396 PolarHBondContact O-N 2.97Å
395	L	39.1	Very low	43.2	Very low	171 Å²	171	141.5 Å²	141.5	90%	0.895	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-66.1	120.2	162.7	-78.8	161.9	0	0	0	108	V393 E397	V393-L395 PolarHBondContact O-N 2.96Å; L395-E397 PolarHBondContact O-N 3.19Å
396	E	35.9	Very low	45.1	Very low	180 Å²	180	136.1 Å²	136.1	84%	0.841	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-68.9	126.9	176.5	-68.5	-170.1	130.5	0	0	110.8	R394 K398	R394-E396 PolarHBondContact O-N 2.97Å; E396-K398 PolarHBondContact O-N 2.71Å
397	E	38.3	Very low	46.9	Very low	185 Å²	185	138.2 Å²	138.2	86%	0.864	71%	0.705	S	S	*	*			trans	-72	100.3	177.9	-171.9	166.8	-137	0	0	109	L395 Q399	L395-E397 PolarHBondContact O-N 3.19Å; E397-Q399 PolarHBondContact O-N 3.49Å
398	K	49.4	Very low	48.6	Very low	171 Å²	171	136.8 Å²	136.8	74%	0.743	69%	0.691	S	S	*	*			trans	-55.8	111	-177.1	-69.5	-177.6	179.7	177.3	0	109.9	E396 H400	E396-K398 PolarHBondContact O-N 2.71Å; K398-H400 PolarHBondContact O-CE1 3.41Å; K398-H400 PolarHBondContact O-N 2.77Å; K398-H400 PolarHBondContact O-ND1 3.26Å
399	Q	55.3	Low	50.6	Low	144 Å²	144	138.5 Å²	138.5	67%	0.673	68%	0.682	S	S	*	*			trans	-66.9	116.8	179.4	-66.2	-176.4	5.3	0	0	109.7	E397 F401	E397-Q399 PolarHBondContact O-N 3.49Å; Q399-F401 HydrophobicContact CB-CE2 3.69Å; Q399-F401 HydrophobicContact CB-CZ 3.78Å; Q399-F401 VanDerWaalsContact O-CD2 3.25Å; Q399-F401 WeakPolarHBondContact O-CD2 3.47Å; Q399-F401 VanDerWaalsContact O-CE2 3.22Å; Q399-F401 WeakPolarHBondContact O-CE2 3.21Å
400	H	65.1	Low	52.9	Low	127 Å²	127	131.4 Å²	131.4	59%	0.588	64%	0.643	S	S	*	*			trans	-96	127.5	177.3	-73.5	79.8	0	0	0	109.2	K398 P402 I409	K398-H400 PolarHBondContact O-CE1 3.41Å; K398-H400 PolarHBondContact O-N 2.77Å; K398-H400 PolarHBondContact O-ND1 3.26Å; H400-P402 WeakPolarHBondContact O-CD 3.43Å; H400-I409 HydrophobicContact CB-CG2 3.74Å
401	F	68.4	Low	54.9	Low	49 Å²	49	133.7 Å²	133.7	22%	0.215	64%	0.638	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108	92.5	-172.8	-65.8	-85.3	0	0	0	109.8	Q399 F410 R413 L416	Q399-F401 HydrophobicContact CB-CE2 3.69Å; Q399-F401 HydrophobicContact CB-CZ 3.78Å; Q399-F401 VanDerWaalsContact O-CD2 3.25Å; Q399-F401 WeakPolarHBondContact O-CD2 3.47Å; Q399-F401 VanDerWaalsContact O-CE2 3.22Å; Q399-F401 WeakPolarHBondContact O-CE2 3.21Å; F401-F410 PolarHBondContact N-O 3.21Å; F401-F410 PolarHBondContact O-N 3.43Å; F401-R413 HydrophobicContact CD1-CB 4.05Å; F401-R413 HydrophobicContact CD1-CG 4.38Å; F401-R413 HydrophobicContact CD2-CB 4.43Å; F401-R413 VanDerWaalsContact CD2-N 3.31Å; F401-R413 HydrophobicContact CE1-CB 3.89Å; F401-R413 HydrophobicContact CE1-CG 4.33Å; F401-R413 HydrophobicContact CE2-CB 4.27Å; F401-R413 HydrophobicContact CG-CB 4.33Å; F401-R413 HydrophobicContact CZ-CB 4Å; F401-L416 HydrophobicContact CB-CB 4.08Å; F401-L416 HydrophobicContact CB-CD2 3.81Å
402	P	65.6	Low	56.9	Low	76 Å²	76	128.1 Å²	128.1	49%	0.494	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.1	142.9	177.5	29.6	-35.5	0	0	0	111.8	H400 I409	H400-P402 WeakPolarHBondContact O-CD 3.43Å; P402-I409 HydrophobicContact CB-CG1 4.2Å
403	C	67.9	Low	58.5	Low	13 Å²	13	126.2 Å²	126.2	9%	0.088	60%	0.602	C	S	.	*			trans	-73.2	135.8	172.1	-176	0	0	0	0	111.5	K405 C406 R408 F410 L416 H419 H424	C403-K405 VanDerWaalsContact C-N 3.26Å; C403-K405 PolarHBondContact O-N 2.95Å; C403-K405 PolarHBondContact SG-N 3.47Å; C403-K405 VanDerWaalsContact SG-N 3.42Å; C403-C406 WeakPolarHBondContact CB-O 3.15Å; C403-C406 VanDerWaalsContact O-O 3.1Å; C403-R408 WeakPolarHBondContact CB-O 3.38Å; C403-R408 PolarHBondContact N-O 2.79Å; C403-F410 HydrophobicContact CB-CE2 4.33Å; C403-L416 HydrophobicContact CB-CD1 3.82Å; C403-H419 PolarHBondContact SG-NE2 3.2Å; C403-H419 VanDerWaalsContact SG-NE2 3.37Å; C403-H424 PolarHBondContact SG-CD2 3.24Å
404	K	65	Low	60.3	Low	199 Å²	199	126.8 Å²	126.8	87%	0.865	59%	0.59	S	S	*	*	S	Bend	trans	-76.1	-7	178.7	-62.3	-175.3	179.9	-179.2	0	114.3
405	K	58	Low	62.2	Low	127 Å²	127	121.6 Å²	121.6	55%	0.552	57%	0.571	S	S	*	*	S	Bend	trans	-127.8	-2.7	-177.2	-58.2	-166.9	-155.7	176	0	114.8	C403 M420 H424	C403-K405 VanDerWaalsContact C-N 3.26Å; C403-K405 PolarHBondContact O-N 2.95Å; C403-K405 PolarHBondContact SG-N 3.47Å; C403-K405 VanDerWaalsContact SG-N 3.42Å; K405-M420 HydrophobicContact CB-CE 4.45Å; K405-M420 HydrophobicContact CD-CE 4.38Å; K405-M420 HydrophobicContact CG-CE 4.16Å; K405-H424 HydrophobicContact CB-CB 4.47Å; K405-H424 HydrophobicContact CD-CB 3.97Å; K405-H424 PolarHBondContact NZ-O 2.88Å
406	C	67.1	Low	63.7	Low	33 Å²	33	114.6 Å²	114.6	22%	0.223	53%	0.534	C	S	.	.	S	Bend	trans	-154.1	161.9	172.2	84.4	0	0	0	0	111.1	C403 R408 H419 H424	C403-C406 WeakPolarHBondContact CB-O 3.15Å; C403-C406 VanDerWaalsContact O-O 3.1Å; C406-R408 PolarHBondContact O-N 2.93Å; C406-H419 PolarHBondContact SG-NE2 2.56Å; C406-H424 WeakPolarHBondContact CB-NE2 3.29Å
407	P	68.5	Low	65.1	Low	134 Å²	134	110.4 Å²	110.4	87%	0.87	51%	0.514	S	S	*	.	S	Bend	trans	-76.2	19.6	-173.8	32.2	-37.2	0	0	0	114.9
408	R	65.3	Low	66.3	Low	163 Å²	163	107 Å²	107	62%	0.615	50%	0.497	S	S	*	.			trans	-86.1	137.5	178.2	-67.7	-173.2	175.3	-155.9	-1.3	111.4	C403 C406 F410	C403-R408 WeakPolarHBondContact CB-O 3.38Å; C403-R408 PolarHBondContact N-O 2.79Å; C406-R408 PolarHBondContact O-N 2.93Å; R408-F410 HydrophobicContact CB-CE2 3.59Å; R408-F410 HydrophobicContact CB-CZ 3.72Å
409	I	68.6	Low	67.3	Low	109 Å²	109	100 Å²	100	56%	0.559	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.3	179	-51.2	-177.8	0	0	0	108.7	H400 P402	H400-I409 HydrophobicContact CB-CG2 3.74Å; P402-I409 HydrophobicContact CB-CG1 4.2Å
410	F	77.8	Confident	67.6	Low	38 Å²	38	94.3 Å²	94.3	17%	0.167	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	149.5	-175.1	-61	-89.1	0	0	0	111.3	F401 C403 R408 L416 H419	F401-F410 PolarHBondContact N-O 3.21Å; F401-F410 PolarHBondContact O-N 3.43Å; C403-F410 HydrophobicContact CB-CE2 4.33Å; R408-F410 HydrophobicContact CB-CE2 3.59Å; R408-F410 HydrophobicContact CB-CZ 3.72Å; F410-L416 HydrophobicContact CB-CB 4.2Å; F410-L416 HydrophobicContact CD2-CB 4.11Å; F410-L416 HydrophobicContact CD2-CD1 3.99Å; F410-L416 HydrophobicContact CE2-CD1 4.31Å; F410-L416 HydrophobicContact CG-CB 4.32Å; F410-H419 HydrophobicContact CE1-CB 3.99Å; F410-H419 HydrophobicContact CE2-CB 4.06Å; F410-H419 AromaticContact CE2-CD2 3.16Å; F410-H419 WeakPolarHBondContact CE2-CD2 3.49Å; F410-H419 AromaticContact CE2-CG 3.67Å; F410-H419 AromaticContact CE2-NE2 3.81Å; F410-H419 HydrophobicContact CZ-CB 3.6Å; F410-H419 AromaticContact CZ-CD2 3.31Å; F410-H419 WeakPolarHBondContact CZ-CD2 3.22Å; F410-H419 AromaticContact CZ-CG 3.31Å; F410-H419 AromaticContact CZ-ND1 3.93Å; F410-H419 AromaticContact CZ-NE2 3.92Å
411	N	71.3	Confident	67.5	Low	121 Å²	121	91.4 Å²	91.4	65%	0.647	43%	0.429	S	S	*	.	S	Bend	trans	-86.6	-2.6	-178	61.6	-6.5	0	0	0	114.2	Y415	N411-Y415 WeakPolarHBondContact OD1-CD2 3.13Å
412	N	75.4	Confident	67.1	Low	83 Å²	83	91.9 Å²	91.9	44%	0.444	44%	0.436	S	S	.	.	S	Bend	trans	-152.6	140.1	177	-175	-31	0	0	0	108.7	W414 Y415 L416	N412-W414 PolarHBondContact O-N 3.48Å; N412-W414 PolarHBondContact OD1-N 3.45Å; N412-Y415 HydrophobicContact CB-CD2 3.98Å; N412-Y415 PolarHBondContact O-N 2.93Å; N412-Y415 VanDerWaalsContact O-N 3.08Å; N412-L416 PolarHBondContact O-N 2.94Å
413	R	64.4	Low	66.4	Low	162 Å²	162	91.8 Å²	91.8	61%	0.611	43%	0.434	S	S	*	.	H	α-helix	trans	-51.5	-38.6	174.8	-170.4	174.1	178.9	165.3	-0.6	112.4	F401 Y415 L416 E417	F401-R413 HydrophobicContact CD1-CB 4.05Å; F401-R413 HydrophobicContact CD1-CG 4.38Å; F401-R413 HydrophobicContact CD2-CB 4.43Å; F401-R413 VanDerWaalsContact CD2-N 3.31Å; F401-R413 HydrophobicContact CE1-CB 3.89Å; F401-R413 HydrophobicContact CE1-CG 4.33Å; F401-R413 HydrophobicContact CE2-CB 4.27Å; F401-R413 HydrophobicContact CG-CB 4.33Å; F401-R413 HydrophobicContact CZ-CB 4Å; R413-Y415 VanDerWaalsContact C-N 3.35Å; R413-Y415 PolarHBondContact O-N 2.92Å; R413-L416 CarbonylContact O-C 3.5Å; R413-L416 WeakPolarHBondContact O-CB 3.23Å; R413-L416 PolarHBondContact O-N 3.4Å; R413-L416 VanDerWaalsContact O-N 3.14Å; R413-E417 IonicContact NE-OE2 2.67Å; R413-E417 WeakPolarHBondContact O-CB 3.47Å; R413-E417 PolarHBondContact O-N 3.14Å
414	W	70.4	Confident	65.9	Low	147 Å²	147	93.3 Å²	93.3	56%	0.557	44%	0.44	S	S	*	.	H	α-helix	trans	-61	-38.7	178.1	-172.2	90.1	0	0	0	113.4	N412 E417 K418	N412-W414 PolarHBondContact O-N 3.48Å; N412-W414 PolarHBondContact OD1-N 3.45Å; W414-E417 PolarHBondContact O-N 3.15Å; W414-K418 HydrophobicContact CH2-CD 3.79Å; W414-K418 HydrophobicContact CZ2-CD 4.4Å; W414-K418 HydrophobicContact CZ3-CD 3.92Å; W414-K418 WeakPolarHBondContact O-CB 3.3Å; W414-K418 PolarHBondContact O-N 2.89Å
415	Y	69.8	Low	65.4	Low	122 Å²	122	87.5 Å²	87.5	48%	0.478	42%	0.418	S	S	.	.	H	α-helix	trans	-71.7	-34.6	175.4	-73.8	-62.1	0	0	0	112	N411 N412 R413 H419	N411-Y415 WeakPolarHBondContact OD1-CD2 3.13Å; N412-Y415 HydrophobicContact CB-CD2 3.98Å; N412-Y415 PolarHBondContact O-N 2.93Å; N412-Y415 VanDerWaalsContact O-N 3.08Å; R413-Y415 VanDerWaalsContact C-N 3.35Å; R413-Y415 PolarHBondContact O-N 2.92Å; Y415-H419 VanDerWaalsContact O-CB 3.22Å; Y415-H419 WeakPolarHBondContact O-CB 3.31Å; Y415-H419 PolarHBondContact O-N 3.08Å
416	L	71.2	Confident	65.1	Low	23 Å²	23	92.4 Å²	92.4	12%	0.12	43%	0.433	C	S	.	.	H	α-helix	trans	-64	-47	169.7	172.6	60.1	0	0	0	111.1	F401 C403 F410 N412 R413 K418 H419 M420	F401-L416 HydrophobicContact CB-CB 4.08Å; F401-L416 HydrophobicContact CB-CD2 3.81Å; C403-L416 HydrophobicContact CB-CD1 3.82Å; F410-L416 HydrophobicContact CB-CB 4.2Å; F410-L416 HydrophobicContact CD2-CB 4.11Å; F410-L416 HydrophobicContact CD2-CD1 3.99Å; F410-L416 HydrophobicContact CE2-CD1 4.31Å; F410-L416 HydrophobicContact CG-CB 4.32Å; N412-L416 PolarHBondContact O-N 2.94Å; R413-L416 CarbonylContact O-C 3.5Å; R413-L416 WeakPolarHBondContact O-CB 3.23Å; R413-L416 PolarHBondContact O-N 3.4Å; R413-L416 VanDerWaalsContact O-N 3.14Å; L416-K418 PolarHBondContact O-N 3.04Å; L416-H419 PolarHBondContact O-N 3.5Å; L416-M420 HydrophobicContact CD1-CG 3.6Å; L416-M420 HydrophobicContact CD1-SD 4.13Å; L416-M420 HydrophobicContact CG-CG 4.04Å; L416-M420 WeakPolarHBondContact O-CB 3.47Å; L416-M420 WeakPolarHBondContact O-CG 3.37Å; L416-M420 PolarHBondContact O-N 3.07Å
417	E	63.4	Low	64.6	Low	92 Å²	92	93 Å²	93	43%	0.43	43%	0.434	S	S	.	.	H	α-helix	trans	-57.4	-49.8	178.9	-144.7	73.7	-114.9	0	0	110.5	R413 W414 H419 M420 N421	R413-E417 IonicContact NE-OE2 2.67Å; R413-E417 WeakPolarHBondContact O-CB 3.47Å; R413-E417 PolarHBondContact O-N 3.14Å; W414-E417 PolarHBondContact O-N 3.15Å; E417-H419 PolarHBondContact O-N 3.35Å; E417-M420 PolarHBondContact O-N 3.05Å; E417-N421 WeakPolarHBondContact O-CB 3.45Å; E417-N421 VanDerWaalsContact O-CG 3.31Å; E417-N421 PolarHBondContact O-N 2.82Å
418	K	64.5	Low	64	Low	115 Å²	115	89.4 Å²	89.4	50%	0.5	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-41.2	176.3	-173.8	170.5	-178.5	173.9	0	112.1	W414 L416 N421 V422	W414-K418 HydrophobicContact CH2-CD 3.79Å; W414-K418 HydrophobicContact CZ2-CD 4.4Å; W414-K418 HydrophobicContact CZ3-CD 3.92Å; W414-K418 WeakPolarHBondContact O-CB 3.3Å; W414-K418 PolarHBondContact O-N 2.89Å; L416-K418 PolarHBondContact O-N 3.04Å; K418-N421 PolarHBondContact O-N 2.97Å; K418-V422 HydrophobicContact CG-CG2 4.38Å; K418-V422 WeakPolarHBondContact O-CB 3.25Å; K418-V422 VanDerWaalsContact O-CG2 3.22Å; K418-V422 WeakPolarHBondContact O-CG2 3.16Å; K418-V422 PolarHBondContact O-N 2.87Å
419	H	69.8	Low	63.5	Low	23 Å²	23	85.1 Å²	85.1	11%	0.106	39%	0.393	C	S	.	.	H	α-helix	trans	-65.5	-42.6	175.1	164.4	59.8	0	0	0	112.2	C403 C406 F410 Y415 L416 E417 V422 T423 H424	C403-H419 PolarHBondContact SG-NE2 3.2Å; C403-H419 VanDerWaalsContact SG-NE2 3.37Å; C406-H419 PolarHBondContact SG-NE2 2.56Å; F410-H419 HydrophobicContact CE1-CB 3.99Å; F410-H419 HydrophobicContact CE2-CB 4.06Å; F410-H419 AromaticContact CE2-CD2 3.16Å; F410-H419 WeakPolarHBondContact CE2-CD2 3.49Å; F410-H419 AromaticContact CE2-CG 3.67Å; F410-H419 AromaticContact CE2-NE2 3.81Å; F410-H419 HydrophobicContact CZ-CB 3.6Å; F410-H419 AromaticContact CZ-CD2 3.31Å; F410-H419 WeakPolarHBondContact CZ-CD2 3.22Å; F410-H419 AromaticContact CZ-CG 3.31Å; F410-H419 AromaticContact CZ-ND1 3.93Å; F410-H419 AromaticContact CZ-NE2 3.92Å; Y415-H419 VanDerWaalsContact O-CB 3.22Å; Y415-H419 WeakPolarHBondContact O-CB 3.31Å; Y415-H419 PolarHBondContact O-N 3.08Å; L416-H419 PolarHBondContact O-N 3.5Å; E417-H419 PolarHBondContact O-N 3.35Å; H419-V422 PolarHBondContact O-N 3Å; H419-T423 PolarHBondContact CE1-OG1 2.95Å; H419-T423 PolarHBondContact ND1-OG1 2.76Å; H419-T423 PolarHBondContact O-N 3.31Å; H419-T423 PolarHBondContact O-OG1 2.87Å; H419-H424 AromaticContact CE1-CD2 3.76Å; H419-H424 AromaticContact CE1-NE2 3.68Å; H419-H424 AromaticContact NE2-CD2 3.55Å; H419-H424 AromaticContact NE2-NE2 3.56Å
420	M	62.1	Low	63.1	Low	24 Å²	24	80 Å²	80	12%	0.118	37%	0.367	C	S	.	.	H	α-helix	trans	-60.3	-46.9	175.7	-65.4	-110.4	55.5	0	0	110	K405 L416 E417 V422 H424 N425	K405-M420 HydrophobicContact CB-CE 4.45Å; K405-M420 HydrophobicContact CD-CE 4.38Å; K405-M420 HydrophobicContact CG-CE 4.16Å; L416-M420 HydrophobicContact CD1-CG 3.6Å; L416-M420 HydrophobicContact CD1-SD 4.13Å; L416-M420 HydrophobicContact CG-CG 4.04Å; L416-M420 WeakPolarHBondContact O-CB 3.47Å; L416-M420 WeakPolarHBondContact O-CG 3.37Å; L416-M420 PolarHBondContact O-N 3.07Å; E417-M420 PolarHBondContact O-N 3.05Å; M420-V422 PolarHBondContact O-N 3.47Å; M420-H424 HydrophobicContact CE-CB 3.39Å; M420-H424 CarbonylContact O-C 3.34Å; M420-H424 WeakPolarHBondContact O-CA 3.46Å; M420-H424 WeakPolarHBondContact O-CB 3.48Å; M420-H424 PolarHBondContact O-N 2.94Å; M420-N425 PolarHBondContact O-N 3.14Å
421	N	63.5	Low	62	Low	67 Å²	67	85.2 Å²	85.2	36%	0.358	40%	0.397	S	S	.	.	H	α-helix	trans	-65.8	-37.8	179	-69.9	-15.7	0	0	0	113.7	E417 K418 N425	E417-N421 WeakPolarHBondContact O-CB 3.45Å; E417-N421 VanDerWaalsContact O-CG 3.31Å; E417-N421 PolarHBondContact O-N 2.82Å; K418-N421 PolarHBondContact O-N 2.97Å; N421-N425 PolarHBondContact OD1-ND2 3.25Å
422	V	58.8	Low	61.3	Low	58 Å²	58	86 Å²	86	35%	0.352	40%	0.401	S	S	.	.	H	α-helix	trans	-81.6	-27.2	-178.4	172.5	0	0	0	0	113.5	K418 H419 M420 M427 L438	K418-V422 HydrophobicContact CG-CG2 4.38Å; K418-V422 WeakPolarHBondContact O-CB 3.25Å; K418-V422 VanDerWaalsContact O-CG2 3.22Å; K418-V422 WeakPolarHBondContact O-CG2 3.16Å; K418-V422 PolarHBondContact O-N 2.87Å; H419-V422 PolarHBondContact O-N 3Å; M420-V422 PolarHBondContact O-N 3.47Å; V422-M427 WeakPolarHBondContact O-CE 3.4Å; V422-L438 HydrophobicContact CG2-CD2 4.07Å
423	T	52.6	Low	60.5	Low	74 Å²	74	84.6 Å²	84.6	45%	0.454	40%	0.397	S	S	.	.	H	α-helix	trans	-126.1	-11.7	-169.5	66.1	0	0	0	0	115.9	H419	H419-T423 PolarHBondContact CE1-OG1 2.95Å; H419-T423 PolarHBondContact ND1-OG1 2.76Å; H419-T423 PolarHBondContact O-N 3.31Å; H419-T423 PolarHBondContact O-OG1 2.87Å
424	H	56.6	Low	60.1	Low	46 Å²	46	79.1 Å²	79.1	21%	0.213	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	-18.5	-166	-73.8	-42.6	0	0	0	115.5	C403 K405 C406 H419 M420	C403-H424 PolarHBondContact SG-CD2 3.24Å; K405-H424 HydrophobicContact CB-CB 4.47Å; K405-H424 HydrophobicContact CD-CB 3.97Å; K405-H424 PolarHBondContact NZ-O 2.88Å; C406-H424 WeakPolarHBondContact CB-NE2 3.29Å; H419-H424 AromaticContact CE1-CD2 3.76Å; H419-H424 AromaticContact CE1-NE2 3.68Å; H419-H424 AromaticContact NE2-CD2 3.55Å; H419-H424 AromaticContact NE2-NE2 3.56Å; M420-H424 HydrophobicContact CE-CB 3.39Å; M420-H424 CarbonylContact O-C 3.34Å; M420-H424 WeakPolarHBondContact O-CA 3.46Å; M420-H424 WeakPolarHBondContact O-CB 3.48Å; M420-H424 PolarHBondContact O-N 2.94Å
425	N	55.1	Low	59.5	Low	77 Å²	77	76 Å²	76	41%	0.412	38%	0.382	S	S	.	.	S	Bend	trans	-93	157.6	163.5	-67.4	-21.2	0	0	0	109.2	M420 N421 M427	M420-N425 PolarHBondContact O-N 3.14Å; N421-N425 PolarHBondContact OD1-ND2 3.25Å; N425-M427 PolarHBondContact O-N 2.98Å
426	R	51.2	Low	58.9	Low	230 Å²	230	77.5 Å²	77.5	87%	0.868	39%	0.387	S	S	*	.			trans	-77.6	90.8	-170.8	-170.4	175.6	-175.2	168.1	-0.4	110.1	Q428	R426-Q428 PolarHBondContact O-N 2.91Å
427	M	56.3	Low	58.4	Low	46 Å²	46	78.2 Å²	78.2	23%	0.227	39%	0.389	C	S	.	.			trans	-46.6	121.5	170.5	-39.3	174.6	82.4	0	0	109	V422 N425 I429 R436	V422-M427 WeakPolarHBondContact O-CE 3.4Å; N425-M427 PolarHBondContact O-N 2.98Å; M427-I429 PolarHBondContact O-N 2.77Å; M427-R436 HydrophobicContact CE-CB 4.42Å; M427-R436 PolarHBondContact SD-NH2 3.08Å; M427-R436 VanDerWaalsContact SD-NH2 3.45Å
428	Q	55.7	Low	57.8	Low	58 Å²	58	78.3 Å²	78.3	27%	0.271	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.3	-177.2	-62.6	-69.6	33.1	0	0	108.6	R426 R436 F437 E440 L443	R426-Q428 PolarHBondContact O-N 2.91Å; Q428-R436 WeakPolarHBondContact O-CA 3.43Å; Q428-F437 PolarHBondContact N-O 3.22Å; Q428-F437 VanDerWaalsContact N-O 3.09Å; Q428-F437 PolarHBondContact O-N 3.43Å; Q428-E440 PolarHBondContact NE2-OE2 3.34Å; Q428-L443 HydrophobicContact CB-CB 4.43Å; Q428-L443 HydrophobicContact CB-CD2 3.82Å
429	I	54.8	Low	57.3	Low	72 Å²	72	77.3 Å²	77.3	37%	0.369	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.6	-175	-52.6	-176.2	0	0	0	108.5	M427 N431 K435 R436	M427-I429 PolarHBondContact O-N 2.77Å; I429-N431 PolarHBondContact O-N 2.94Å; I429-K435 WeakPolarHBondContact CA-O 3.35Å; I429-R436 HydrophobicContact CG1-CG 4.28Å
430	C	60.6	Low	56.2	Low	1 Å²	1	81.9 Å²	81.9	1%	0.007	41%	0.413	C	S	.	.			trans	-71.8	111.2	172.6	-175.4	0	0	0	0	109.8	N432 C433 G434 K435 F437 L443	C430-N432 PolarHBondContact O-N 2.82Å; C430-N432 VanDerWaalsContact O-N 3.08Å; C430-C433 PolarHBondContact O-N 3.21Å; C430-C433 VanDerWaalsContact O-N 3.16Å; C430-G434 WeakPolarHBondContact O-CA 3.47Å; C430-G434 PolarHBondContact O-N 2.98Å; C430-K435 PolarHBondContact N-O 3.23Å; C430-F437 HydrophobicContact CB-CE2 4.09Å; C430-L443 HydrophobicContact CB-CD1 3.52Å
431	N	55.3	Low	55.7	Low	149 Å²	149	84.4 Å²	84.4	80%	0.797	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-25	-178.3	-65.3	-28.3	0	0	0	113.4	I429	I429-N431 PolarHBondContact O-N 2.94Å
432	N	55.4	Low	55.5	Low	136 Å²	136	84.9 Å²	84.9	73%	0.727	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-16.5	-176.5	-62.7	40.5	0	0	0	113.6	C430	C430-N432 PolarHBondContact O-N 2.82Å; C430-N432 VanDerWaalsContact O-N 3.08Å
433	C	59.5	Low	55.7	Low	54 Å²	54	82.9 Å²	82.9	37%	0.365	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.3	-1.9	-175.8	79.8	0	0	0	0	116.3	C430 K435 H446 C451	C430-C433 PolarHBondContact O-N 3.21Å; C430-C433 VanDerWaalsContact O-N 3.16Å; C433-K435 PolarHBondContact O-N 3.1Å; C433-K435 VanDerWaalsContact O-N 3.14Å; C433-K435 VanDerWaalsContact SG-CG 3.58Å; C433-H446 PolarHBondContact SG-NE2 3.09Å; C433-C451 HydrophobicContact CB-CB 4.14Å
434	G	56.5	Low	56.1	Low	48 Å²	48	84.1 Å²	84.1	50%	0.495	42%	0.423	S	S	.	.			trans	73.3	-4.9	177.7	0	0	0	0	0	116.4	C430	C430-G434 WeakPolarHBondContact O-CA 3.47Å; C430-G434 PolarHBondContact O-N 2.98Å
435	K	57.6	Low	56.3	Low	80 Å²	80	85.6 Å²	85.6	35%	0.348	43%	0.433	S	S	.	.			trans	-60.6	141.5	174.9	-69.4	174.1	-176	170.1	0	110.3	I429 C430 C433 F437 E452	I429-K435 WeakPolarHBondContact CA-O 3.35Å; C430-K435 PolarHBondContact N-O 3.23Å; C433-K435 PolarHBondContact O-N 3.1Å; C433-K435 VanDerWaalsContact O-N 3.14Å; C433-K435 VanDerWaalsContact SG-CG 3.58Å; K435-F437 HydrophobicContact CB-CE2 3.51Å; K435-F437 HydrophobicContact CB-CZ 3.67Å; K435-F437 HydrophobicContact CD-CZ 4.2Å; K435-E452 PolarHBondContact NZ-O 2.82Å
436	R	57	Low	56.8	Low	155 Å²	155	82.8 Å²	82.8	59%	0.585	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.9	-174.2	-46.3	-179.7	81.6	172.3	5.6	109.4	M427 Q428 I429	M427-R436 HydrophobicContact CE-CB 4.42Å; M427-R436 PolarHBondContact SD-NH2 3.08Å; M427-R436 VanDerWaalsContact SD-NH2 3.45Å; Q428-R436 WeakPolarHBondContact O-CA 3.43Å; I429-R436 HydrophobicContact CG1-CG 4.28Å
437	F	60.8	Low	57.1	Low	37 Å²	37	75.5 Å²	75.5	16%	0.162	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	156.6	-175.6	-61.4	-85.4	0	0	0	110.9	Q428 C430 K435 E442 L443 H446	Q428-F437 PolarHBondContact N-O 3.22Å; Q428-F437 VanDerWaalsContact N-O 3.09Å; Q428-F437 PolarHBondContact O-N 3.43Å; C430-F437 HydrophobicContact CB-CE2 4.09Å; K435-F437 HydrophobicContact CB-CE2 3.51Å; K435-F437 HydrophobicContact CB-CZ 3.67Å; K435-F437 HydrophobicContact CD-CZ 4.2Å; F437-E442 HydrophobicContact CB-CB 4.17Å; F437-E442 HydrophobicContact CD1-CB 3.89Å; F437-E442 HydrophobicContact CG-CB 4.36Å; F437-L443 HydrophobicContact CB-CB 4.28Å; F437-L443 HydrophobicContact CD2-CB 4.19Å; F437-L443 HydrophobicContact CD2-CD1 3.91Å; F437-L443 HydrophobicContact CE2-CD1 4.16Å; F437-L443 HydrophobicContact CG-CB 4.32Å; F437-H446 HydrophobicContact CE1-CB 4Å; F437-H446 HydrophobicContact CE2-CB 4.27Å; F437-H446 AromaticContact CE2-CD2 3.25Å; F437-H446 WeakPolarHBondContact CE2-CD2 3.11Å; F437-H446 AromaticContact CE2-CG 3.83Å; F437-H446 AromaticContact CE2-NE2 3.89Å; F437-H446 HydrophobicContact CZ-CB 3.71Å; F437-H446 AromaticContact CZ-CD2 3.21Å; F437-H446 WeakPolarHBondContact CZ-CD2 3.19Å; F437-H446 AromaticContact CZ-CG 3.31Å; F437-H446 AromaticContact CZ-ND1 3.95Å; F437-H446 AromaticContact CZ-NE2 3.8Å
438	L	50.1	Low	57.4	Low	94 Å²	94	81 Å²	81	49%	0.492	42%	0.418	S	S	.	.	S	Bend	trans	-97.2	-30.5	-177.6	-68	175.6	0	0	0	111.7	V422 E442	V422-L438 HydrophobicContact CG2-CD2 4.07Å; L438-E442 PolarHBondContact N-OE2 3.33Å
439	L	53.4	Low	57.6	Low	94 Å²	94	80.5 Å²	80.5	49%	0.492	42%	0.419	S	S	.	.	S	Bend	trans	-116	151.4	173	-71.9	77.5	0	0	0	111.3	S441 E442 L443	L439-S441 VanDerWaalsContact C-N 3.35Å; L439-E442 HydrophobicContact CB-CG 3.97Å; L439-E442 PolarHBondContact N-OE2 2.96Å; L439-E442 WeakPolarHBondContact O-CB 3.43Å; L439-E442 PolarHBondContact O-N 2.62Å; L439-L443 PolarHBondContact O-N 2.83Å
440	E	47.6	Very low	57.6	Low	120 Å²	120	84.1 Å²	84.1	56%	0.561	44%	0.439	S	S	*	.	H	α-helix	trans	-69.4	-33.6	177.7	-162.3	156.5	144.7	0	0	112.2	Q428 E442 L443 L444	Q428-E440 PolarHBondContact NE2-OE2 3.34Å; E440-E442 VanDerWaalsContact C-N 3.3Å; E440-E442 PolarHBondContact O-N 3.05Å; E440-L443 PolarHBondContact O-N 3.05Å; E440-L444 WeakPolarHBondContact O-CG 3.29Å; E440-L444 PolarHBondContact O-N 3.23Å
441	S	50.9	Low	57.5	Low	77 Å²	77	85.4 Å²	85.4	54%	0.538	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-31	171.8	49.3	0	0	0	0	113.5	L439 L445	L439-S441 VanDerWaalsContact C-N 3.35Å; S441-L445 WeakPolarHBondContact O-CB 3.27Å; S441-L445 PolarHBondContact O-N 3.13Å
442	E	59.5	Low	57.5	Low	77 Å²	77	83 Å²	83	36%	0.36	43%	0.432	S	S	.	.	H	α-helix	trans	-69.7	-40.3	172.8	-64.1	169.5	157.8	0	0	111.2	F437 L438 L439 E440 H446	F437-E442 HydrophobicContact CB-CB 4.17Å; F437-E442 HydrophobicContact CD1-CB 3.89Å; F437-E442 HydrophobicContact CG-CB 4.36Å; L438-E442 PolarHBondContact N-OE2 3.33Å; L439-E442 HydrophobicContact CB-CG 3.97Å; L439-E442 PolarHBondContact N-OE2 2.96Å; L439-E442 WeakPolarHBondContact O-CB 3.43Å; L439-E442 PolarHBondContact O-N 2.62Å; E440-E442 VanDerWaalsContact C-N 3.3Å; E440-E442 PolarHBondContact O-N 3.05Å; E442-H446 VanDerWaalsContact O-CB 3.25Å; E442-H446 WeakPolarHBondContact O-CB 3.25Å; E442-H446 PolarHBondContact O-N 3.04Å
443	L	63.7	Low	57.5	Low	16 Å²	16	87.2 Å²	87.2	8%	0.084	44%	0.438	C	S	.	.	H	α-helix	trans	-66.1	-46.2	175.2	173.5	60	0	0	0	111.3	Q428 C430 F437 L439 E440 L445 H446 Q447	Q428-L443 HydrophobicContact CB-CB 4.43Å; Q428-L443 HydrophobicContact CB-CD2 3.82Å; C430-L443 HydrophobicContact CB-CD1 3.52Å; F437-L443 HydrophobicContact CB-CB 4.28Å; F437-L443 HydrophobicContact CD2-CB 4.19Å; F437-L443 HydrophobicContact CD2-CD1 3.91Å; F437-L443 HydrophobicContact CE2-CD1 4.16Å; F437-L443 HydrophobicContact CG-CB 4.32Å; L439-L443 PolarHBondContact O-N 2.83Å; E440-L443 PolarHBondContact O-N 3.05Å; L443-L445 PolarHBondContact O-N 3.5Å; L443-H446 CarbonylContact O-C 3.55Å; L443-H446 WeakPolarHBondContact O-CB 3.44Å; L443-H446 PolarHBondContact O-N 2.81Å; L443-H446 VanDerWaalsContact O-N 3.16Å; L443-Q447 HydrophobicContact CD1-CG 3.93Å; L443-Q447 HydrophobicContact CG-CG 4.37Å; L443-Q447 WeakPolarHBondContact O-CB 3.42Å; L443-Q447 WeakPolarHBondContact O-CG 3.36Å; L443-Q447 PolarHBondContact O-N 2.95Å
444	L	61	Low	57.3	Low	99 Å²	99	86.4 Å²	86.4	52%	0.518	43%	0.432	S	S	.	.	H	α-helix	trans	-60.8	-44.8	178.9	-73.7	172.5	0	0	0	111.6	E440 H446 Q447 Q448	E440-L444 WeakPolarHBondContact O-CG 3.29Å; E440-L444 PolarHBondContact O-N 3.23Å; L444-H446 VanDerWaalsContact C-N 3.32Å; L444-H446 PolarHBondContact O-N 3.06Å; L444-Q447 PolarHBondContact O-N 3.46Å; L444-Q448 WeakPolarHBondContact O-CB 3.47Å; L444-Q448 PolarHBondContact O-N 2.7Å
445	L	61.3	Low	57.8	Low	78 Å²	78	86.7 Å²	86.7	41%	0.408	42%	0.422	S	S	.	.	H	α-helix	trans	-61	-41.8	174.2	-178.6	62.9	0	0	0	111.6	S441 L443 Q448 T449 L467	S441-L445 WeakPolarHBondContact O-CB 3.27Å; S441-L445 PolarHBondContact O-N 3.13Å; L443-L445 PolarHBondContact O-N 3.5Å; L445-Q448 PolarHBondContact O-N 2.86Å; L445-T449 WeakPolarHBondContact O-CG2 3.46Å; L445-T449 PolarHBondContact O-N 3.33Å; L445-T449 VanDerWaalsContact O-N 3.09Å; L445-T449 PolarHBondContact O-OG1 3.47Å; L445-L467 HydrophobicContact CD2-CD2 4.28Å
446	H	64.3	Low	58.2	Low	17 Å²	17	87.9 Å²	87.9	8%	0.079	43%	0.429	C	S	.	.	H	α-helix	trans	-68.5	-32.3	178.3	169.1	58.2	0	0	0	113.9	C433 F437 E442 L443 L444 T449 C451	C433-H446 PolarHBondContact SG-NE2 3.09Å; F437-H446 HydrophobicContact CE1-CB 4Å; F437-H446 HydrophobicContact CE2-CB 4.27Å; F437-H446 AromaticContact CE2-CD2 3.25Å; F437-H446 WeakPolarHBondContact CE2-CD2 3.11Å; F437-H446 AromaticContact CE2-CG 3.83Å; F437-H446 AromaticContact CE2-NE2 3.89Å; F437-H446 HydrophobicContact CZ-CB 3.71Å; F437-H446 AromaticContact CZ-CD2 3.21Å; F437-H446 WeakPolarHBondContact CZ-CD2 3.19Å; F437-H446 AromaticContact CZ-CG 3.31Å; F437-H446 AromaticContact CZ-ND1 3.95Å; F437-H446 AromaticContact CZ-NE2 3.8Å; E442-H446 VanDerWaalsContact O-CB 3.25Å; E442-H446 WeakPolarHBondContact O-CB 3.25Å; E442-H446 PolarHBondContact O-N 3.04Å; L443-H446 CarbonylContact O-C 3.55Å; L443-H446 WeakPolarHBondContact O-CB 3.44Å; L443-H446 PolarHBondContact O-N 2.81Å; L443-H446 VanDerWaalsContact O-N 3.16Å; L444-H446 VanDerWaalsContact C-N 3.32Å; L444-H446 PolarHBondContact O-N 3.06Å; H446-T449 PolarHBondContact O-OG1 2.86Å; H446-C451 VanDerWaalsContact CE1-CA 3.46Å; H446-C451 WeakPolarHBondContact CE1-CA 3.37Å; H446-C451 PolarHBondContact O-N 2.8Å
447	Q	58.6	Low	58.6	Low	78 Å²	78	80.6 Å²	80.6	36%	0.364	40%	0.402	S	S	.	.	H	α-helix	trans	-71.4	-38.4	171.2	-74.3	174.1	-37.5	0	0	111.2	L443 L444 T449 D450	L443-Q447 HydrophobicContact CD1-CG 3.93Å; L443-Q447 HydrophobicContact CG-CG 4.37Å; L443-Q447 WeakPolarHBondContact O-CB 3.42Å; L443-Q447 WeakPolarHBondContact O-CG 3.36Å; L443-Q447 PolarHBondContact O-N 2.95Å; L444-Q447 PolarHBondContact O-N 3.46Å; Q447-T449 PolarHBondContact O-N 3.12Å; Q447-D450 PolarHBondContact O-N 2.66Å
448	Q	62.5	Low	58.7	Low	160 Å²	160	86 Å²	86	75%	0.748	44%	0.437	S	S	*	.	H	α-helix	trans	-69.3	-16.6	176.3	-169.2	172.7	12.5	0	0	113.5	L444 L445	L444-Q448 WeakPolarHBondContact O-CB 3.47Å; L444-Q448 PolarHBondContact O-N 2.7Å; L445-Q448 PolarHBondContact O-N 2.86Å
449	T	58.6	Low	59.1	Low	48 Å²	48	85.6 Å²	85.6	29%	0.294	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	34.1	170.4	64.6	0	0	0	0	112.4	L445 H446 Q447 C451 E452	L445-T449 WeakPolarHBondContact O-CG2 3.46Å; L445-T449 PolarHBondContact O-N 3.33Å; L445-T449 VanDerWaalsContact O-N 3.09Å; L445-T449 PolarHBondContact O-OG1 3.47Å; H446-T449 PolarHBondContact O-OG1 2.86Å; Q447-T449 PolarHBondContact O-N 3.12Å; T449-C451 PolarHBondContact O-N 3.22Å; T449-E452 WeakPolarHBondContact O-CB 3.44Å; T449-E452 WeakPolarHBondContact O-CG 3.42Å; T449-E452 PolarHBondContact O-N 3.24Å
450	D	55.9	Low	59.6	Low	148 Å²	148	83.9 Å²	83.9	79%	0.791	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.4	35.8	174	-71.6	-40.1	0	0	0	115.9	Q447 E452	Q447-D450 PolarHBondContact O-N 2.66Å; D450-E452 PolarHBondContact O-N 3.12Å
451	C	57.9	Low	60.5	Low	29 Å²	29	80.3 Å²	80.3	20%	0.196	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	17.4	-174	-64.2	0	0	0	0	117.1	C433 H446 T449	C433-C451 HydrophobicContact CB-CB 4.14Å; H446-C451 VanDerWaalsContact CE1-CA 3.46Å; H446-C451 WeakPolarHBondContact CE1-CA 3.37Å; H446-C451 PolarHBondContact O-N 2.8Å; T449-C451 PolarHBondContact O-N 3.22Å
452	E	55.7	Low	61.4	Low	98 Å²	98	81.1 Å²	81.1	46%	0.458	42%	0.423	S	S	.	.			trans	-45.7	145.5	-179.3	-76.8	-160.1	158.8	0	0	113.2	K435 T449 D450 S454	K435-E452 PolarHBondContact NZ-O 2.82Å; T449-E452 WeakPolarHBondContact O-CB 3.44Å; T449-E452 WeakPolarHBondContact O-CG 3.42Å; T449-E452 PolarHBondContact O-N 3.24Å; D450-E452 PolarHBondContact O-N 3.12Å; E452-S454 VanDerWaalsContact C-N 3.26Å; E452-S454 PolarHBondContact O-N 3.2Å
453	R	54.1	Low	61.9	Low	225 Å²	225	80 Å²	80	85%	0.849	43%	0.427	S	S	*	.	S	Bend	trans	-74.3	-14.6	-177.8	-96.6	-178.5	165	118.2	-6.4	113.6
454	S	57	Low	62.2	Low	36 Å²	36	80 Å²	80	25%	0.252	43%	0.426	S	S	.	.	S	Bend	trans	-152.1	124.5	-171.5	50.3	0	0	0	0	111.3	E452 F464	E452-S454 VanDerWaalsContact C-N 3.26Å; E452-S454 PolarHBondContact O-N 3.2Å; S454-F464 CarbonylContact C-O 3.6Å; S454-F464 WeakPolarHBondContact CA-O 3.35Å
455	I	66.7	Low	62.4	Low	55 Å²	55	81 Å²	81	28%	0.282	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.9	-179.5	-45.2	174.8	0	0	0	108.7	F464 L467 L470	I455-F464 PolarHBondContact N-O 2.97Å; I455-F464 PolarHBondContact O-N 3.08Å; I455-L467 HydrophobicContact CD1-CB 3.81Å; I455-L467 HydrophobicContact CD1-CD1 4.14Å; I455-L470 HydrophobicContact CB-CD2 4.15Å; I455-L470 HydrophobicContact CG2-CD2 3.56Å
456	Q	64.9	Low	62.6	Low	104 Å²	104	83.6 Å²	83.6	49%	0.486	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.5	-171.6	-56.9	-178.3	38	0	0	113	K462 A463	Q456-K462 CarbonylContact C-O 3.34Å; Q456-A463 HydrophobicContact CG-CB 3.98Å
457	C	66.9	Low	62.3	Low	3 Å²	3	87 Å²	87	2%	0.02	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-76.3	119.6	170.2	178.2	0	0	0	0	110.9	T459 C460 G461 K462 F464 L470 H473 N474 H478	C457-T459 PolarHBondContact O-N 2.71Å; C457-T459 VanDerWaalsContact O-N 3.14Å; C457-T459 PolarHBondContact SG-N 3.08Å; C457-T459 VanDerWaalsContact SG-N 3.38Å; C457-C460 PolarHBondContact O-N 2.93Å; C457-C460 VanDerWaalsContact SG-SG 3.61Å; C457-G461 WeakPolarHBondContact O-CA 3.22Å; C457-G461 PolarHBondContact O-N 3.42Å; C457-K462 PolarHBondContact N-O 3.46Å; C457-F464 HydrophobicContact CB-CE2 4.29Å; C457-L470 HydrophobicContact CB-CD1 3.62Å; C457-H473 WeakPolarHBondContact CB-NE2 3.15Å; C457-H473 PolarHBondContact SG-NE2 2.79Å; C457-N474 PolarHBondContact SG-OD1 3.16Å; C457-H478 VanDerWaalsContact SG-CD2 3.5Å; C457-H478 PolarHBondContact SG-NE2 3.07Å; C457-H478 VanDerWaalsContact SG-NE2 3.42Å
458	V	62	Low	62.4	Low	149 Å²	149	91.9 Å²	91.9	90%	0.903	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.4	178.3	-174.6	0	0	0	0	112.8
459	T	58.2	Low	63	Low	86 Å²	86	85.8 Å²	85.8	53%	0.528	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-19.4	-175	-45.6	0	0	0	0	113.9	C457 H478	C457-T459 PolarHBondContact O-N 2.71Å; C457-T459 VanDerWaalsContact O-N 3.14Å; C457-T459 PolarHBondContact SG-N 3.08Å; C457-T459 VanDerWaalsContact SG-N 3.38Å; T459-H478 HydrophobicContact CG2-CB 4.48Å
460	C	65.1	Low	63.6	Low	58 Å²	58	84.2 Å²	84.2	39%	0.392	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.4	4.1	179.3	71.6	0	0	0	0	116.3	C457 K462 H473 H478	C457-C460 PolarHBondContact O-N 2.93Å; C457-C460 VanDerWaalsContact SG-SG 3.61Å; C460-K462 PolarHBondContact O-N 3.39Å; C460-H473 PolarHBondContact SG-CE1 2.67Å; C460-H473 PolarHBondContact SG-NE2 3.1Å; C460-H478 PolarHBondContact SG-NE2 2.81Å
461	G	65.8	Low	64	Low	45 Å²	45	82.1 Å²	82.1	46%	0.464	42%	0.418	S	S	.	.			trans	72.9	-11.9	179.6	0	0	0	0	0	116.3	C457 A463	C457-G461 WeakPolarHBondContact O-CA 3.22Å; C457-G461 PolarHBondContact O-N 3.42Å; G461-A463 PolarHBondContact O-N 2.83Å
462	K	68.8	Low	64.5	Low	95 Å²	95	82 Å²	82	41%	0.413	42%	0.415	S	S	.	.			trans	-53.6	131.5	177.5	-75.3	-168.2	-178.6	-173.8	0	110.8	E325 Q456 C457 C460 F464 H473	E325-K462 IonicContact OE2-NZ 2.71Å; Q456-K462 CarbonylContact C-O 3.34Å; C457-K462 PolarHBondContact N-O 3.46Å; C460-K462 PolarHBondContact O-N 3.39Å; K462-F464 HydrophobicContact CB-CE2 3.56Å; K462-F464 HydrophobicContact CB-CZ 3.71Å; K462-F464 HydrophobicContact CD-CZ 4.08Å; K462-F464 WeakPolarHBondContact O-CD2 3Å; K462-F464 WeakPolarHBondContact O-CE2 3.09Å; K462-H473 VanDerWaalsContact CD-CE1 3.48Å; K462-H473 WeakPolarHBondContact CD-CE1 3.37Å
463	A	70.3	Confident	65.3	Low	53 Å²	53	77.7 Å²	77.7	44%	0.438	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.4	-170.4	0	0	0	0	0	112.1	Q456 G461	Q456-A463 HydrophobicContact CG-CB 3.98Å; G461-A463 PolarHBondContact O-N 2.83Å
464	F	69.9	Low	65.9	Low	16 Å²	16	69.1 Å²	69.1	7%	0.07	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.5	-169.5	-64.1	-82.3	0	0	0	112.9	S454 I455 C457 K462 K466 L470 H473	S454-F464 CarbonylContact C-O 3.6Å; S454-F464 WeakPolarHBondContact CA-O 3.35Å; I455-F464 PolarHBondContact N-O 2.97Å; I455-F464 PolarHBondContact O-N 3.08Å; C457-F464 HydrophobicContact CB-CE2 4.29Å; K462-F464 HydrophobicContact CB-CE2 3.56Å; K462-F464 HydrophobicContact CB-CZ 3.71Å; K462-F464 HydrophobicContact CD-CZ 4.08Å; K462-F464 WeakPolarHBondContact O-CD2 3Å; K462-F464 WeakPolarHBondContact O-CE2 3.09Å; F464-K466 PolarHBondContact O-N 3.31Å; F464-K466 VanDerWaalsContact O-N 3.1Å; F464-L470 HydrophobicContact CB-CB 4.1Å; F464-L470 HydrophobicContact CD2-CB 3.93Å; F464-L470 HydrophobicContact CD2-CD1 3.8Å; F464-L470 HydrophobicContact CD2-CG 4.45Å; F464-L470 HydrophobicContact CE2-CD1 4.09Å; F464-L470 HydrophobicContact CG-CB 4.19Å; F464-H473 HydrophobicContact CE1-CB 3.93Å; F464-H473 HydrophobicContact CE2-CB 3.86Å; F464-H473 AromaticContact CE2-CD2 3.56Å; F464-H473 AromaticContact CE2-CG 3.51Å; F464-H473 HydrophobicContact CZ-CB 3.44Å; F464-H473 VanDerWaalsContact CZ-CB 3.44Å; F464-H473 AromaticContact CZ-CD2 3.76Å; F464-H473 AromaticContact CZ-CG 3.21Å; F464-H473 AromaticContact CZ-ND1 3.51Å
465	K	66.3	Low	66.6	Low	119 Å²	119	69.5 Å²	69.5	52%	0.517	36%	0.362	S	S	.	.	S	Bend	trans	-67.6	-12.1	-178.7	-59.3	178.4	-167.9	-179.4	0	114.4	E329	E329-K465 VanDerWaalsContact OE1-CD 3.25Å; E329-K465 WeakPolarHBondContact OE1-CD 3.5Å; E329-K465 WeakPolarHBondContact OE1-CE 3.09Å; E329-K465 IonicContact OE1-NZ 3.51Å; E329-K465 PolarHBondContact OE1-NZ 3.45Å; E329-K465 IonicContact OE2-NZ 2.66Å; E329-K465 PolarHBondContact OE2-NZ 2.8Å
466	K	64.9	Low	66.6	Low	134 Å²	134	68 Å²	68	58%	0.583	36%	0.355	S	S	*	.	S	Bend	trans	-140.3	137.2	-175.1	-64.4	167.8	-173	158.8	0	110.4	F464 W468 S469 L470	F464-K466 PolarHBondContact O-N 3.31Å; F464-K466 VanDerWaalsContact O-N 3.1Å; K466-W468 PolarHBondContact O-N 3.33Å; K466-S469 WeakPolarHBondContact O-CB 3.43Å; K466-S469 PolarHBondContact O-N 2.96Å; K466-L470 PolarHBondContact O-N 3.27Å
467	L	59.1	Low	66.5	Low	88 Å²	88	66.1 Å²	66.1	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-31.7	178.9	-175.1	60.1	0	0	0	112.9	L445 I455 L470 H471	L445-L467 HydrophobicContact CD2-CD2 4.28Å; I455-L467 HydrophobicContact CD1-CB 3.81Å; I455-L467 HydrophobicContact CD1-CD1 4.14Å; L467-L470 HydrophobicContact CD1-CD2 4.35Å; L467-L470 PolarHBondContact O-N 2.76Å; L467-H471 WeakPolarHBondContact O-CB 3.39Å; L467-H471 PolarHBondContact O-N 2.85Å
468	W	60.7	Low	66.4	Low	181 Å²	181	68.1 Å²	68.1	69%	0.686	36%	0.359	S	S	*	.	H	α-helix	trans	-65.4	-39.9	173.3	179.8	-90.6	0	0	0	112.8	K466 H471 E472	K466-W468 PolarHBondContact O-N 3.33Å; W468-H471 PolarHBondContact O-N 2.93Å; W468-E472 PolarHBondContact O-N 2.86Å
469	S	73.3	Confident	66.3	Low	32 Å²	32	63.1 Å²	63.1	22%	0.224	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-44.6	175.4	-59.7	0	0	0	0	110.7	K466 H471 E472 H473	K466-S469 WeakPolarHBondContact O-CB 3.43Å; K466-S469 PolarHBondContact O-N 2.96Å; S469-H471 VanDerWaalsContact C-N 3.32Å; S469-H471 PolarHBondContact O-N 3.24Å; S469-E472 PolarHBondContact O-N 3.3Å; S469-H473 VanDerWaalsContact O-CB 3.28Å; S469-H473 WeakPolarHBondContact O-CB 3.28Å; S469-H473 PolarHBondContact O-N 3.49Å
470	L	72.1	Confident	66.1	Low	14 Å²	14	68.1 Å²	68.1	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-39.4	173.4	174.2	58.7	0	0	0	112.3	I455 C457 F464 K466 L467 N474	I455-L470 HydrophobicContact CB-CD2 4.15Å; I455-L470 HydrophobicContact CG2-CD2 3.56Å; C457-L470 HydrophobicContact CB-CD1 3.62Å; F464-L470 HydrophobicContact CB-CB 4.1Å; F464-L470 HydrophobicContact CD2-CB 3.93Å; F464-L470 HydrophobicContact CD2-CD1 3.8Å; F464-L470 HydrophobicContact CD2-CG 4.45Å; F464-L470 HydrophobicContact CE2-CD1 4.09Å; F464-L470 HydrophobicContact CG-CB 4.19Å; K466-L470 PolarHBondContact O-N 3.27Å; L467-L470 HydrophobicContact CD1-CD2 4.35Å; L467-L470 PolarHBondContact O-N 2.76Å; L470-N474 WeakPolarHBondContact CD1-OD1 3.23Å; L470-N474 VanDerWaalsContact O-CB 3.32Å; L470-N474 WeakPolarHBondContact O-CB 3.48Å; L470-N474 PolarHBondContact O-N 2.93Å; L470-N474 PolarHBondContact O-ND2 3.26Å
471	H	63.7	Low	65.7	Low	104 Å²	104	67 Å²	67	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-45.9	177.3	-176.8	78.1	0	0	0	112.1	L467 W468 S469 N474 K475	L467-H471 WeakPolarHBondContact O-CB 3.39Å; L467-H471 PolarHBondContact O-N 2.85Å; W468-H471 PolarHBondContact O-N 2.93Å; S469-H471 VanDerWaalsContact C-N 3.32Å; S469-H471 PolarHBondContact O-N 3.24Å; H471-N474 PolarHBondContact O-N 3.45Å; H471-K475 WeakPolarHBondContact O-CB 3.45Å; H471-K475 PolarHBondContact O-N 3.22Å
472	E	68.7	Low	65.3	Low	27 Å²	27	71 Å²	71	13%	0.126	35%	0.35	C	S	.	.	H	α-helix	trans	-69	-37.1	178.3	-163.1	66.8	-163	0	0	111.3	W468 S469 K475 I476 T496	W468-E472 PolarHBondContact O-N 2.86Å; S469-E472 PolarHBondContact O-N 3.3Å; E472-K475 WeakPolarHBondContact O-CB 3.17Å; E472-K475 PolarHBondContact O-N 3.37Å; E472-K475 IonicContact OE1-NZ 2.68Å; E472-K475 PolarHBondContact OE1-NZ 3.23Å; E472-K475 IonicContact OE2-NZ 3.16Å; E472-K475 PolarHBondContact OE2-NZ 2.89Å; E472-I476 HydrophobicContact CG-CD1 3.83Å; E472-I476 HydrophobicContact CG-CG1 4.38Å; E472-I476 WeakPolarHBondContact O-CB 3.25Å; E472-I476 VanDerWaalsContact O-CG1 3.31Å; E472-I476 WeakPolarHBondContact O-CG1 3.41Å; E472-I476 PolarHBondContact O-N 3.42Å; E472-T496 WeakPolarHBondContact OE1-CG2 3.42Å
473	H	72.8	Confident	65.2	Low	7 Å²	7	71.2 Å²	71.2	3%	0.032	35%	0.351	C	S	.	.	H	α-helix	trans	-58.7	-51.4	169.5	164.7	77.9	0	0	0	112.1	C457 C460 K462 F464 S469 K475 I476 V477 H478	C457-H473 WeakPolarHBondContact CB-NE2 3.15Å; C457-H473 PolarHBondContact SG-NE2 2.79Å; C460-H473 PolarHBondContact SG-CE1 2.67Å; C460-H473 PolarHBondContact SG-NE2 3.1Å; K462-H473 VanDerWaalsContact CD-CE1 3.48Å; K462-H473 WeakPolarHBondContact CD-CE1 3.37Å; F464-H473 HydrophobicContact CE1-CB 3.93Å; F464-H473 HydrophobicContact CE2-CB 3.86Å; F464-H473 AromaticContact CE2-CD2 3.56Å; F464-H473 AromaticContact CE2-CG 3.51Å; F464-H473 HydrophobicContact CZ-CB 3.44Å; F464-H473 VanDerWaalsContact CZ-CB 3.44Å; F464-H473 AromaticContact CZ-CD2 3.76Å; F464-H473 AromaticContact CZ-CG 3.21Å; F464-H473 AromaticContact CZ-ND1 3.51Å; S469-H473 VanDerWaalsContact O-CB 3.28Å; S469-H473 WeakPolarHBondContact O-CB 3.28Å; S469-H473 PolarHBondContact O-N 3.49Å; H473-K475 PolarHBondContact O-N 3.25Å; H473-K475 VanDerWaalsContact O-N 3.14Å; H473-I476 PolarHBondContact O-N 2.66Å; H473-V477 WeakPolarHBondContact CE1-CB 3.5Å; H473-V477 WeakPolarHBondContact CE1-CG1 3.35Å; H473-V477 VanDerWaalsContact CE1-CG2 3.49Å; H473-V477 WeakPolarHBondContact CE1-CG2 3.06Å; H473-V477 WeakPolarHBondContact ND1-CG2 3.28Å; H473-V477 WeakPolarHBondContact O-CB 3.21Å; H473-V477 PolarHBondContact O-N 2.91Å; H473-H478 AromaticContact CE1-NE2 3.59Å; H473-H478 AromaticContact NE2-CD2 2.68Å; H473-H478 PolarHBondContact NE2-CD2 3.26Å; H473-H478 AromaticContact NE2-CE1 3.51Å; H473-H478 AromaticContact NE2-CG 3.97Å; H473-H478 AromaticContact NE2-NE2 2.26Å; H473-H478 PolarHBondContact NE2-NE2 3.03Å
474	N	67.6	Low	65	Low	45 Å²	45	75.9 Å²	75.9	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-60.7	-26.7	177.8	-73	-13.4	0	0	0	112.6	C457 L470 H471 H478 G479	C457-N474 PolarHBondContact SG-OD1 3.16Å; L470-N474 WeakPolarHBondContact CD1-OD1 3.23Å; L470-N474 VanDerWaalsContact O-CB 3.32Å; L470-N474 WeakPolarHBondContact O-CB 3.48Å; L470-N474 PolarHBondContact O-N 2.93Å; L470-N474 PolarHBondContact O-ND2 3.26Å; H471-N474 PolarHBondContact O-N 3.45Å; N474-H478 CarbonylContact O-C 3.56Å; N474-H478 WeakPolarHBondContact O-CA 3.48Å; N474-H478 WeakPolarHBondContact O-CB 3.36Å; N474-H478 PolarHBondContact O-N 3.04Å; N474-G479 PolarHBondContact O-N 3.41Å
475	K	70.1	Confident	65.2	Low	44 Å²	44	78.7 Å²	78.7	19%	0.191	37%	0.374	C	S	.	.	H	α-helix	trans	-84.1	-37.4	-179.7	175.7	176	158.9	-117.8	0	112.7	H471 E472 H473 A481 Y495	H471-K475 WeakPolarHBondContact O-CB 3.45Å; H471-K475 PolarHBondContact O-N 3.22Å; E472-K475 WeakPolarHBondContact O-CB 3.17Å; E472-K475 PolarHBondContact O-N 3.37Å; E472-K475 IonicContact OE1-NZ 2.68Å; E472-K475 PolarHBondContact OE1-NZ 3.23Å; E472-K475 IonicContact OE2-NZ 3.16Å; E472-K475 PolarHBondContact OE2-NZ 2.89Å; H473-K475 PolarHBondContact O-N 3.25Å; H473-K475 VanDerWaalsContact O-N 3.14Å; K475-A481 HydrophobicContact CD-CB 4.35Å; K475-A481 HydrophobicContact CG-CB 3.68Å; K475-Y495 VanDerWaalsContact O-CE1 3.28Å; K475-Y495 WeakPolarHBondContact O-CE1 3.27Å
476	I	68.1	Low	65.8	Low	23 Å²	23	76.3 Å²	76.3	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-81.2	-64.6	176.8	-67	175	0	0	0	109.9	E472 H473 Y495	E472-I476 HydrophobicContact CG-CD1 3.83Å; E472-I476 HydrophobicContact CG-CG1 4.38Å; E472-I476 WeakPolarHBondContact O-CB 3.25Å; E472-I476 VanDerWaalsContact O-CG1 3.31Å; E472-I476 WeakPolarHBondContact O-CG1 3.41Å; E472-I476 PolarHBondContact O-N 3.42Å; H473-I476 PolarHBondContact O-N 2.66Å; I476-Y495 HydrophobicContact CB-CD2 4.17Å; I476-Y495 HydrophobicContact CB-CE2 4.16Å; I476-Y495 HydrophobicContact CG1-CD2 3.77Å; I476-Y495 HydrophobicContact CG1-CE2 4.29Å; I476-Y495 HydrophobicContact CG1-CG 4.03Å; I476-Y495 HydrophobicContact CG2-CD2 4.07Å; I476-Y495 HydrophobicContact CG2-CE2 3.82Å; I476-Y495 PolarHBondContact O-OH 2.61Å
477	V	61.7	Low	66.5	Low	66 Å²	66	70 Å²	70	40%	0.4	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-32.5	-169.9	-175.9	0	0	0	0	112.6	H473	H473-V477 WeakPolarHBondContact CE1-CB 3.5Å; H473-V477 WeakPolarHBondContact CE1-CG1 3.35Å; H473-V477 VanDerWaalsContact CE1-CG2 3.49Å; H473-V477 WeakPolarHBondContact CE1-CG2 3.06Å; H473-V477 WeakPolarHBondContact ND1-CG2 3.28Å; H473-V477 WeakPolarHBondContact O-CB 3.21Å; H473-V477 PolarHBondContact O-N 2.91Å
478	H	65.9	Low	67.4	Low	45 Å²	45	74.4 Å²	74.4	21%	0.208	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	10.7	178.8	-57.6	-51.2	0	0	0	114.4	C457 T459 C460 H473 N474 Y480	C457-H478 VanDerWaalsContact SG-CD2 3.5Å; C457-H478 PolarHBondContact SG-NE2 3.07Å; C457-H478 VanDerWaalsContact SG-NE2 3.42Å; T459-H478 HydrophobicContact CG2-CB 4.48Å; C460-H478 PolarHBondContact SG-NE2 2.81Å; H473-H478 AromaticContact CE1-NE2 3.59Å; H473-H478 AromaticContact NE2-CD2 2.68Å; H473-H478 PolarHBondContact NE2-CD2 3.26Å; H473-H478 AromaticContact NE2-CE1 3.51Å; H473-H478 AromaticContact NE2-CG 3.97Å; H473-H478 AromaticContact NE2-NE2 2.26Å; H473-H478 PolarHBondContact NE2-NE2 3.03Å; N474-H478 CarbonylContact O-C 3.56Å; N474-H478 WeakPolarHBondContact O-CA 3.48Å; N474-H478 WeakPolarHBondContact O-CB 3.36Å; N474-H478 PolarHBondContact O-N 3.04Å; H478-Y480 HydrophobicContact CB-CD2 4.21Å; H478-Y480 HydrophobicContact CB-CE2 4.17Å; H478-Y480 WeakPolarHBondContact O-CD2 3.47Å; H478-Y480 PolarHBondContact O-N 3.22Å
479	G	58.9	Low	68.3	Low	44 Å²	44	70.9 Å²	70.9	45%	0.454	36%	0.356	S	S	.	.			trans	67.8	8.1	156.9	0	0	0	0	0	117.6	N474 A481	N474-G479 PolarHBondContact O-N 3.41Å; G479-A481 PolarHBondContact O-N 3.4Å
480	Y	55	Low	68.6	Low	191 Å²	191	72 Å²	72	75%	0.749	36%	0.363	S	S	*	.			trans	-65.5	-4.9	-179.7	-72.7	-74	0	0	0	114.8	H478	H478-Y480 HydrophobicContact CB-CD2 4.21Å; H478-Y480 HydrophobicContact CB-CE2 4.17Å; H478-Y480 WeakPolarHBondContact O-CD2 3.47Å; H478-Y480 PolarHBondContact O-N 3.22Å
481	A	56.2	Low	69	Low	33 Å²	33	79 Å²	79	27%	0.273	40%	0.396	S	S	.	.	S	Bend	trans	-121.8	134.8	164.1	0	0	0	0	0	110.8	K475 G479 Y495	K475-A481 HydrophobicContact CD-CB 4.35Å; K475-A481 HydrophobicContact CG-CB 3.68Å; G479-A481 PolarHBondContact O-N 3.4Å; A481-Y495 VanDerWaalsContact O-CE1 3.32Å; A481-Y495 WeakPolarHBondContact O-CE1 3.43Å
482	E	57.5	Low	69.6	Low	129 Å²	129	79 Å²	79	60%	0.603	39%	0.394	S	S	*	.			trans	-57.3	145.4	169.3	-59.4	163.6	140.1	0	0	110.6	K484	E482-K484 HydrophobicContact CB-CG 4.06Å; E482-K484 PolarHBondContact O-N 2.89Å; E482-K484 WeakPolarHBondContact OE2-CE 3.42Å; E482-K484 IonicContact OE2-NZ 2.62Å
483	K	67.3	Low	70.1	Confident	101 Å²	101	84.3 Å²	84.3	44%	0.439	42%	0.417	S	S	.	.			trans	-72.1	71.6	172.4	-68.7	177.7	165.9	-168.6	0	110.4	F485 K493 F494 Y495	K483-F485 VanDerWaalsContact C-N 3.26Å; K483-F485 PolarHBondContact O-N 2.79Å; K483-K493 HydrophobicContact CB-CB 3.6Å; K483-K493 HydrophobicContact CD-CB 4.17Å; K483-K493 WeakPolarHBondContact CD-O 3.43Å; K483-K493 HydrophobicContact CG-CB 4.5Å; K483-F494 CarbonylContact C-O 3.46Å; K483-Y495 HydrophobicContact CD-CE2 4.18Å; K483-Y495 WeakPolarHBondContact CE-OH 3.5Å; K483-Y495 HydrophobicContact CG-CD1 3.89Å; K483-Y495 HydrophobicContact CG-CD2 4.2Å; K483-Y495 HydrophobicContact CG-CE1 3.57Å; K483-Y495 HydrophobicContact CG-CE2 3.89Å; K483-Y495 HydrophobicContact CG-CG 4.2Å
484	K	66.3	Low	70.4	Confident	151 Å²	151	85.7 Å²	85.7	66%	0.657	42%	0.423	S	S	*	.			trans	-66.7	-15.5	-169.6	-68.2	-165.6	176.6	-164.2	0	115.7	E482 F494	E482-K484 HydrophobicContact CB-CG 4.06Å; E482-K484 PolarHBondContact O-N 2.89Å; E482-K484 WeakPolarHBondContact OE2-CE 3.42Å; E482-K484 IonicContact OE2-NZ 2.62Å; K484-F494 PolarHBondContact N-O 2.83Å
485	F	73.1	Confident	70.4	Confident	75 Å²	75	85.7 Å²	85.7	33%	0.329	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	100.8	-174.9	-52.8	-78.8	0	0	0	110.4	K483 F494 M497 V500	K483-F485 VanDerWaalsContact C-N 3.26Å; K483-F485 PolarHBondContact O-N 2.79Å; F485-F494 PolarHBondContact N-O 2.8Å; F485-F494 VanDerWaalsContact N-O 3.12Å; F485-F494 PolarHBondContact O-N 3.39Å; F485-M497 HydrophobicContact CD1-CB 4.07Å; F485-M497 HydrophobicContact CD1-CE 3.64Å; F485-M497 HydrophobicContact CD1-SD 4.28Å; F485-M497 HydrophobicContact CE1-CB 4.11Å; F485-M497 HydrophobicContact CE1-CE 4.1Å; F485-M497 HydrophobicContact CG-CB 4.36Å; F485-M497 HydrophobicContact CZ-CB 4.44Å; F485-V500 HydrophobicContact CB-CG2 3.48Å; F485-V500 VanDerWaalsContact CB-CG2 3.48Å; F485-V500 WeakPolarHBondContact O-CG2 3.24Å
486	S	78.6	Confident	70.7	Confident	69 Å²	69	84.8 Å²	84.8	48%	0.483	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	150.3	171.6	42.5	0	0	0	0	112
487	C	81.2	Confident	70.9	Confident	1 Å²	1	88 Å²	88	1%	0.007	43%	0.434	C	S	.	.			trans	-77.5	128.3	160.8	179	0	0	0	0	110	I489 E491 K492 F494 H507	C487-I489 PolarHBondContact O-N 3.23Å; C487-I489 PolarHBondContact SG-N 3.14Å; C487-I489 VanDerWaalsContact SG-N 3.44Å; C487-E491 WeakPolarHBondContact O-CA 3.28Å; C487-E491 PolarHBondContact O-N 3.26Å; C487-K492 PolarHBondContact N-O 3.35Å; C487-F494 HydrophobicContact CB-CE2 4.3Å; C487-H507 PolarHBondContact SG-CD2 3.22Å; C487-H507 PolarHBondContact SG-NE2 2.83Å
488	E	77.4	Confident	71.7	Confident	180 Å²	180	86.9 Å²	86.9	84%	0.841	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-13.9	179.4	-64.8	167.5	-175.6	0	0	113.8
489	I	78.8	Confident	72.2	Confident	107 Å²	107	87.8 Å²	87.8	55%	0.549	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-27.6	-171.9	-60.1	174.7	0	0	0	112.8	C487 M504 H507	C487-I489 PolarHBondContact O-N 3.23Å; C487-I489 PolarHBondContact SG-N 3.14Å; C487-I489 VanDerWaalsContact SG-N 3.44Å; I489-M504 HydrophobicContact CD1-CE 3.6Å; I489-M504 HydrophobicContact CD1-SD 4.49Å; I489-M504 HydrophobicContact CG1-CE 4.21Å; I489-H507 HydrophobicContact CB-CB 4.36Å; I489-H507 HydrophobicContact CD1-CB 3.61Å; I489-H507 HydrophobicContact CG2-CB 4.09Å
490	C	80.6	Confident	73.1	Confident	56 Å²	56	86.1 Å²	86.1	38%	0.378	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143	18.1	178.6	80.5	0	0	0	0	114.4	K492 H503 H507	C490-K492 PolarHBondContact O-N 3.46Å; C490-H503 PolarHBondContact SG-NE2 3.42Å; C490-H507 PolarHBondContact SG-CE1 3.26Å; C490-H507 PolarHBondContact SG-NE2 3.39Å
491	E	79.4	Confident	74.3	Confident	160 Å²	160	84.5 Å²	84.5	75%	0.748	41%	0.409	S	S	*	.			trans	58.4	-5.4	173	-57.7	-175.7	-174.2	0	0	117.5	C487 K493	C487-E491 WeakPolarHBondContact O-CA 3.28Å; C487-E491 PolarHBondContact O-N 3.26Å; E491-K493 WeakPolarHBondContact O-CG 3.46Å; E491-K493 PolarHBondContact O-N 3.29Å
492	K	77.1	Confident	75.2	Confident	105 Å²	105	90.2 Å²	90.2	46%	0.457	43%	0.428	S	S	.	.			trans	-51.6	127.2	174.2	-81.4	-157.5	169.3	-159.9	0	109.3	D321 C487 C490 F494	D321-K492 IonicContact OD2-NZ 3.88Å; D321-K492 PolarHBondContact OD2-NZ 3.22Å; C487-K492 PolarHBondContact N-O 3.35Å; C490-K492 PolarHBondContact O-N 3.46Å; K492-F494 HydrophobicContact CB-CE2 3.75Å; K492-F494 HydrophobicContact CB-CZ 3.95Å; K492-F494 VanDerWaalsContact O-CD2 3.25Å; K492-F494 WeakPolarHBondContact O-CD2 3.26Å; K492-F494 WeakPolarHBondContact O-CE2 3.26Å
493	K	77.8	Confident	76.2	Confident	138 Å²	138	85.8 Å²	85.8	60%	0.6	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.5	-174.9	-56.2	-176	-179.8	176	0	110.9	K483 E491	K483-K493 HydrophobicContact CB-CB 3.6Å; K483-K493 HydrophobicContact CD-CB 4.17Å; K483-K493 WeakPolarHBondContact CD-O 3.43Å; K483-K493 HydrophobicContact CG-CB 4.5Å; E491-K493 WeakPolarHBondContact O-CG 3.46Å; E491-K493 PolarHBondContact O-N 3.29Å
494	F	79.9	Confident	76.5	Confident	36 Å²	36	83.6 Å²	83.6	16%	0.158	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.5	-174.2	-60.5	-90.4	0	0	0	111.9	K483 K484 F485 C487 K492 H499 V500 H503	K483-F494 CarbonylContact C-O 3.46Å; K484-F494 PolarHBondContact N-O 2.83Å; F485-F494 PolarHBondContact N-O 2.8Å; F485-F494 VanDerWaalsContact N-O 3.12Å; F485-F494 PolarHBondContact O-N 3.39Å; C487-F494 HydrophobicContact CB-CE2 4.3Å; K492-F494 HydrophobicContact CB-CE2 3.75Å; K492-F494 HydrophobicContact CB-CZ 3.95Å; K492-F494 VanDerWaalsContact O-CD2 3.25Å; K492-F494 WeakPolarHBondContact O-CD2 3.26Å; K492-F494 WeakPolarHBondContact O-CE2 3.26Å; F494-H499 HydrophobicContact CB-CB 4.22Å; F494-H499 HydrophobicContact CD1-CB 3.98Å; F494-H499 HydrophobicContact CG-CB 4.38Å; F494-V500 HydrophobicContact CB-CG2 3.84Å; F494-V500 HydrophobicContact CD2-CG2 3.75Å; F494-V500 HydrophobicContact CG-CG2 4.07Å; F494-H503 HydrophobicContact CE1-CB 4.17Å; F494-H503 HydrophobicContact CE2-CB 4.1Å; F494-H503 AromaticContact CE2-CD2 3.54Å; F494-H503 AromaticContact CE2-CG 3.74Å; F494-H503 HydrophobicContact CZ-CB 3.67Å; F494-H503 AromaticContact CZ-CD2 3.62Å; F494-H503 AromaticContact CZ-CE1 4Å; F494-H503 AromaticContact CZ-CG 3.35Å; F494-H503 AromaticContact CZ-ND1 3.62Å
495	Y	68.1	Low	76.9	Confident	45 Å²	45	78.7 Å²	78.7	18%	0.176	38%	0.382	C	S	.	.	S	Bend	trans	-78.6	-18	179.2	-58.2	-85.1	0	0	0	114.1	K475 I476 A481 K483	K475-Y495 VanDerWaalsContact O-CE1 3.28Å; K475-Y495 WeakPolarHBondContact O-CE1 3.27Å; I476-Y495 HydrophobicContact CB-CD2 4.17Å; I476-Y495 HydrophobicContact CB-CE2 4.16Å; I476-Y495 HydrophobicContact CG1-CD2 3.77Å; I476-Y495 HydrophobicContact CG1-CE2 4.29Å; I476-Y495 HydrophobicContact CG1-CG 4.03Å; I476-Y495 HydrophobicContact CG2-CD2 4.07Å; I476-Y495 HydrophobicContact CG2-CE2 3.82Å; I476-Y495 PolarHBondContact O-OH 2.61Å; A481-Y495 VanDerWaalsContact O-CE1 3.32Å; A481-Y495 WeakPolarHBondContact O-CE1 3.43Å; K483-Y495 HydrophobicContact CD-CE2 4.18Å; K483-Y495 WeakPolarHBondContact CE-OH 3.5Å; K483-Y495 HydrophobicContact CG-CD1 3.89Å; K483-Y495 HydrophobicContact CG-CD2 4.2Å; K483-Y495 HydrophobicContact CG-CE1 3.57Å; K483-Y495 HydrophobicContact CG-CE2 3.89Å; K483-Y495 HydrophobicContact CG-CG 4.2Å
496	T	76	Confident	76.8	Confident	26 Å²	26	77.4 Å²	77.4	16%	0.16	39%	0.385	C	S	.	.			trans	-140.2	146.2	178.8	78.4	0	0	0	0	112.4	E472 A498 H499 V500	E472-T496 WeakPolarHBondContact OE1-CG2 3.42Å; T496-A498 PolarHBondContact O-N 3.21Å; T496-A498 PolarHBondContact OG1-N 3.45Å; T496-H499 PolarHBondContact O-N 2.83Å; T496-H499 VanDerWaalsContact OG1-CG 3.27Å; T496-H499 PolarHBondContact OG1-N 3.46Å; T496-H499 PolarHBondContact OG1-ND1 3.32Å; T496-V500 PolarHBondContact O-N 3.3Å
497	M	72.9	Confident	76.4	Confident	90 Å²	90	76.8 Å²	76.8	44%	0.443	38%	0.375	S	S	.	.	H	α-helix	trans	-64.3	-16.5	170.6	-168.7	61.1	90.7	0	0	112.7	F485 V500 R501	F485-M497 HydrophobicContact CD1-CB 4.07Å; F485-M497 HydrophobicContact CD1-CE 3.64Å; F485-M497 HydrophobicContact CD1-SD 4.28Å; F485-M497 HydrophobicContact CE1-CB 4.11Å; F485-M497 HydrophobicContact CE1-CE 4.1Å; F485-M497 HydrophobicContact CG-CB 4.36Å; F485-M497 HydrophobicContact CZ-CB 4.44Å; M497-V500 HydrophobicContact SD-CB 4.04Å; M497-V500 HydrophobicContact SD-CG1 4.23Å; M497-V500 HydrophobicContact SD-CG2 4.49Å; M497-R501 WeakPolarHBondContact O-CB 3.4Å; M497-R501 WeakPolarHBondContact O-CG 3.45Å; M497-R501 PolarHBondContact O-N 2.87Å; M497-R501 PolarHBondContact O-NE 2.82Å
498	A	77.7	Confident	75.9	Confident	42 Å²	42	79.5 Å²	79.5	35%	0.347	39%	0.391	S	S	.	.	H	α-helix	trans	-72.8	-38.6	170.6	0	0	0	0	0	111.6	T496 R501 K502	T496-A498 PolarHBondContact O-N 3.21Å; T496-A498 PolarHBondContact OG1-N 3.45Å; A498-R501 PolarHBondContact O-N 3.49Å; A498-K502 WeakPolarHBondContact O-CG 3.44Å; A498-K502 PolarHBondContact O-N 3.16Å
499	H	76.9	Confident	75.2	Confident	64 Å²	64	80.3 Å²	80.3	30%	0.296	39%	0.392	S	S	.	.	H	α-helix	trans	-71.2	-38.9	174.2	-63	166.3	0	0	0	111.4	F494 T496 R501 K502 H503	F494-H499 HydrophobicContact CB-CB 4.22Å; F494-H499 HydrophobicContact CD1-CB 3.98Å; F494-H499 HydrophobicContact CG-CB 4.38Å; T496-H499 PolarHBondContact O-N 2.83Å; T496-H499 VanDerWaalsContact OG1-CG 3.27Å; T496-H499 PolarHBondContact OG1-N 3.46Å; T496-H499 PolarHBondContact OG1-ND1 3.32Å; H499-R501 PolarHBondContact O-N 3.42Å; H499-K502 PolarHBondContact O-N 3.06Å; H499-H503 VanDerWaalsContact O-CB 3.29Å; H499-H503 WeakPolarHBondContact O-CB 3.44Å; H499-H503 PolarHBondContact O-N 3.2Å
500	V	78.2	Confident	74.6	Confident	10 Å²	10	80.8 Å²	80.8	6%	0.061	40%	0.396	C	S	.	.	H	α-helix	trans	-56.9	-50.7	167.3	-179.9	0	0	0	0	110.9	F485 F494 T496 M497 K502 H503 M504	F485-V500 HydrophobicContact CB-CG2 3.48Å; F485-V500 VanDerWaalsContact CB-CG2 3.48Å; F485-V500 WeakPolarHBondContact O-CG2 3.24Å; F494-V500 HydrophobicContact CB-CG2 3.84Å; F494-V500 HydrophobicContact CD2-CG2 3.75Å; F494-V500 HydrophobicContact CG-CG2 4.07Å; T496-V500 PolarHBondContact O-N 3.3Å; M497-V500 HydrophobicContact SD-CB 4.04Å; M497-V500 HydrophobicContact SD-CG1 4.23Å; M497-V500 HydrophobicContact SD-CG2 4.49Å; V500-K502 PolarHBondContact O-N 2.87Å; V500-H503 CarbonylContact O-C 3.56Å; V500-H503 WeakPolarHBondContact O-CA 3.45Å; V500-H503 WeakPolarHBondContact O-CB 3.48Å; V500-H503 PolarHBondContact O-N 3.19Å; V500-M504 HydrophobicContact CG1-CG 4Å; V500-M504 HydrophobicContact CG1-SD 4.44Å; V500-M504 WeakPolarHBondContact O-CG 3.32Å; V500-M504 PolarHBondContact O-N 2.84Å
501	R	78.6	Confident	74.1	Confident	157 Å²	157	81.8 Å²	81.8	59%	0.592	40%	0.396	S	S	*	.	H	α-helix	trans	-60.6	-38.6	179.3	-84.2	-178.6	-87.1	108.4	-5.6	113.7	M497 A498 H499 H503 V505	M497-R501 WeakPolarHBondContact O-CB 3.4Å; M497-R501 WeakPolarHBondContact O-CG 3.45Å; M497-R501 PolarHBondContact O-N 2.87Å; M497-R501 PolarHBondContact O-NE 2.82Å; A498-R501 PolarHBondContact O-N 3.49Å; H499-R501 PolarHBondContact O-N 3.42Å; R501-H503 VanDerWaalsContact C-N 3.34Å; R501-V505 WeakPolarHBondContact O-CG2 3.21Å
502	K	75.7	Confident	73.8	Confident	153 Å²	153	78.4 Å²	78.4	67%	0.665	39%	0.388	S	S	*	.	H	α-helix	trans	-61.9	-41.3	170.6	-74.3	179.1	179.6	179.9	0	111.6	A498 H499 V500 V505	A498-K502 WeakPolarHBondContact O-CG 3.44Å; A498-K502 PolarHBondContact O-N 3.16Å; H499-K502 PolarHBondContact O-N 3.06Å; V500-K502 PolarHBondContact O-N 2.87Å; K502-V505 WeakPolarHBondContact O-CB 3.39Å; K502-V505 WeakPolarHBondContact O-CG2 3.39Å; K502-V505 PolarHBondContact O-N 3.43Å
503	H	79.8	Confident	73.8	Confident	36 Å²	36	77 Å²	77	17%	0.167	38%	0.381	C	S	.	.	H	α-helix	trans	-73.3	-31.3	179.9	175.8	76.2	0	0	0	113.6	C490 F494 H499 V500 R501 V505 A506 H507	C490-H503 PolarHBondContact SG-NE2 3.42Å; F494-H503 HydrophobicContact CE1-CB 4.17Å; F494-H503 HydrophobicContact CE2-CB 4.1Å; F494-H503 AromaticContact CE2-CD2 3.54Å; F494-H503 AromaticContact CE2-CG 3.74Å; F494-H503 HydrophobicContact CZ-CB 3.67Å; F494-H503 AromaticContact CZ-CD2 3.62Å; F494-H503 AromaticContact CZ-CE1 4Å; F494-H503 AromaticContact CZ-CG 3.35Å; F494-H503 AromaticContact CZ-ND1 3.62Å; H499-H503 VanDerWaalsContact O-CB 3.29Å; H499-H503 WeakPolarHBondContact O-CB 3.44Å; H499-H503 PolarHBondContact O-N 3.2Å; V500-H503 CarbonylContact O-C 3.56Å; V500-H503 WeakPolarHBondContact O-CA 3.45Å; V500-H503 WeakPolarHBondContact O-CB 3.48Å; V500-H503 PolarHBondContact O-N 3.19Å; R501-H503 VanDerWaalsContact C-N 3.34Å; H503-V505 PolarHBondContact O-N 2.82Å; H503-A506 WeakPolarHBondContact O-CA 3.48Å; H503-A506 WeakPolarHBondContact O-CB 3.46Å; H503-A506 PolarHBondContact O-N 3.07Å; H503-H507 AromaticContact CD2-CD2 3.98Å; H503-H507 AromaticContact CD2-NE2 3.67Å; H503-H507 AromaticContact CE1-NE2 3.58Å; H503-H507 AromaticContact NE2-CD2 3.73Å; H503-H507 AromaticContact NE2-CE1 3.99Å; H503-H507 AromaticContact NE2-NE2 2.96Å; H503-H507 PolarHBondContact NE2-NE2 2.7Å
504	M	72.4	Confident	73.9	Confident	54 Å²	54	74.4 Å²	74.4	27%	0.266	38%	0.377	S	S	.	.	H	α-helix	trans	-61.5	-26.5	174.7	-68.4	-58.3	-77.4	0	0	112.3	I489 V500 A506 H507 T508	I489-M504 HydrophobicContact CD1-CE 3.6Å; I489-M504 HydrophobicContact CD1-SD 4.49Å; I489-M504 HydrophobicContact CG1-CE 4.21Å; V500-M504 HydrophobicContact CG1-CG 4Å; V500-M504 HydrophobicContact CG1-SD 4.44Å; V500-M504 WeakPolarHBondContact O-CG 3.32Å; V500-M504 PolarHBondContact O-N 2.84Å; M504-A506 PolarHBondContact O-N 3.34Å; M504-H507 PolarHBondContact O-N 3.04Å; M504-T508 PolarHBondContact O-N 2.26Å; M504-T508 PolarHBondContact O-OG1 2.64Å
505	V	74.2	Confident	74.1	Confident	48 Å²	48	73 Å²	73	29%	0.291	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-23.2	171.1	-161.6	0	0	0	0	111.9	R501 K502 H503 T508 K523	R501-V505 WeakPolarHBondContact O-CG2 3.21Å; K502-V505 WeakPolarHBondContact O-CB 3.39Å; K502-V505 WeakPolarHBondContact O-CG2 3.39Å; K502-V505 PolarHBondContact O-N 3.43Å; H503-V505 PolarHBondContact O-N 2.82Å; V505-T508 WeakPolarHBondContact CA-OG1 3.47Å; V505-T508 PolarHBondContact O-OG1 3.38Å; V505-K523 HydrophobicContact CG1-CB 3.98Å; V505-K523 HydrophobicContact CG1-CG 4.46Å; V505-K523 WeakPolarHBondContact O-CD 3.48Å; V505-K523 WeakPolarHBondContact O-CE 3.25Å
506	A	70.8	Confident	74.5	Confident	49 Å²	49	80.1 Å²	80.1	41%	0.405	41%	0.406	S	S	.	.	H	α-helix	trans	-71.1	-29	172.3	0	0	0	0	0	112.8	H503 M504 K523	H503-A506 WeakPolarHBondContact O-CA 3.48Å; H503-A506 WeakPolarHBondContact O-CB 3.46Å; H503-A506 PolarHBondContact O-N 3.07Å; M504-A506 PolarHBondContact O-N 3.34Å; A506-K523 PolarHBondContact O-NZ 3.12Å
507	H	71.3	Confident	74.6	Confident	56 Å²	56	83.8 Å²	83.8	26%	0.259	43%	0.429	S	S	.	.	H	α-helix	trans	-92	-34.3	-178.6	-64.7	-57.7	0	0	0	113.5	C487 I489 C490 H503 M504 K509	C487-H507 PolarHBondContact SG-CD2 3.22Å; C487-H507 PolarHBondContact SG-NE2 2.83Å; I489-H507 HydrophobicContact CB-CB 4.36Å; I489-H507 HydrophobicContact CD1-CB 3.61Å; I489-H507 HydrophobicContact CG2-CB 4.09Å; C490-H507 PolarHBondContact SG-CE1 3.26Å; C490-H507 PolarHBondContact SG-NE2 3.39Å; H503-H507 AromaticContact CD2-CD2 3.98Å; H503-H507 AromaticContact CD2-NE2 3.67Å; H503-H507 AromaticContact CE1-NE2 3.58Å; H503-H507 AromaticContact NE2-CD2 3.73Å; H503-H507 AromaticContact NE2-CE1 3.99Å; H503-H507 AromaticContact NE2-NE2 2.96Å; H503-H507 PolarHBondContact NE2-NE2 2.7Å; M504-H507 PolarHBondContact O-N 3.04Å; H507-K509 PolarHBondContact O-N 3.42Å
508	T	70.9	Confident	75	Confident	57 Å²	57	81.9 Å²	81.9	35%	0.35	42%	0.424	S	S	.	.			trans	-61.3	130.2	168.9	52.2	0	0	0	0	109.6	M504 V505 D510	M504-T508 PolarHBondContact O-N 2.26Å; M504-T508 PolarHBondContact O-OG1 2.64Å; V505-T508 WeakPolarHBondContact CA-OG1 3.47Å; V505-T508 PolarHBondContact O-OG1 3.38Å; T508-D510 PolarHBondContact O-N 2.68Å
509	K	62	Low	75.1	Confident	197 Å²	197	82.4 Å²	82.4	86%	0.857	43%	0.433	S	S	*	.			trans	-74.6	-11.2	171	-71.9	179.2	179.3	171.5	0	112.4	H507 M511	H507-K509 PolarHBondContact O-N 3.42Å; K509-M511 PolarHBondContact O-N 3.11Å
510	D	65.9	Low	75.2	Confident	118 Å²	118	83.7 Å²	83.7	63%	0.631	44%	0.438	S	S	*	.			trans	-64.2	121	176.1	-55.6	-37.6	0	0	0	110.1	T508 P512	T508-D510 PolarHBondContact O-N 2.68Å; D510-P512 VanDerWaalsContact C-CD 3.47Å; D510-P512 VanDerWaalsContact O-CD 3.25Å; D510-P512 WeakPolarHBondContact O-CD 3.44Å
511	M	70.6	Confident	75.3	Confident	77 Å²	77	85.5 Å²	85.5	38%	0.379	45%	0.451	S	S	.	.			trans	-115.3	75.6	179.8	-68.7	-76.1	-135.9	0	0	108.2	K509 F513 S521 F522 K523	K509-M511 PolarHBondContact O-N 3.11Å; M511-F513 PolarHBondContact O-N 3.26Å; M511-S521 VanDerWaalsContact CE-O 3.31Å; M511-S521 WeakPolarHBondContact CE-O 3.43Å; M511-F522 CarbonylContact C-O 3.6Å; M511-F522 VanDerWaalsContact SD-C 3.58Å; M511-K523 HydrophobicContact CE-CG 4.23Å; M511-K523 HydrophobicContact SD-CB 4.33Å; M511-K523 HydrophobicContact SD-CD 4.17Å; M511-K523 HydrophobicContact SD-CG 3.27Å; M511-K523 WeakPolarHBondContact SD-CG 3.48Å
512	P	73.2	Confident	75.4	Confident	89 Å²	89	80.2 Å²	80.2	58%	0.578	43%	0.433	S	S	*	.			trans	-69.3	-5.1	-165.7	27.3	-35.9	0	0	0	114.8	D510	D510-P512 VanDerWaalsContact C-CD 3.47Å; D510-P512 VanDerWaalsContact O-CD 3.25Å; D510-P512 WeakPolarHBondContact O-CD 3.44Å
513	F	76.8	Confident	75.3	Confident	75 Å²	75	76.6 Å²	76.6	33%	0.329	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	86.3	-179.6	-57.2	-71.9	0	0	0	110.4	M511 F522 S525 L528	M511-F513 PolarHBondContact O-N 3.26Å; F513-F522 HydrophobicContact CB-CB 4.35Å; F513-F522 PolarHBondContact N-O 3.28Å; F513-F522 PolarHBondContact O-N 3.46Å; F513-S525 VanDerWaalsContact CD2-N 3.26Å; F513-L528 HydrophobicContact CB-CB 3.92Å; F513-L528 HydrophobicContact CB-CD2 3.81Å; F513-L528 HydrophobicContact CB-CG 4.49Å
514	T	79.2	Confident	75.2	Confident	84 Å²	84	82.7 Å²	82.7	52%	0.515	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	135.4	177.7	49	0	0	0	0	111.9
515	C	84.6	Confident	75.4	Confident	5 Å²	5	83.5 Å²	83.5	3%	0.034	45%	0.45	C	S	.	.			trans	-81.6	119.7	170.9	-172.5	0	0	0	0	111.1	T517 C518 G519 K520 F522 L528	C515-T517 VanDerWaalsContact C-N 3.28Å; C515-T517 PolarHBondContact O-N 3.45Å; C515-C518 VanDerWaalsContact CB-SG 3.57Å; C515-C518 PolarHBondContact O-N 3.01Å; C515-G519 VanDerWaalsContact O-CA 3.31Å; C515-G519 WeakPolarHBondContact O-CA 3.49Å; C515-G519 PolarHBondContact O-N 3.47Å; C515-K520 WeakPolarHBondContact CB-O 3.49Å; C515-K520 PolarHBondContact N-O 2.97Å; C515-F522 HydrophobicContact CB-CE2 4.3Å; C515-L528 HydrophobicContact CB-CD1 3.55Å
516	E	77.9	Confident	75.5	Confident	195 Å²	195	86 Å²	86	91%	0.911	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.2	-178.4	-61.7	178.8	176.2	0	0	112.6
517	T	77.4	Confident	76	Confident	103 Å²	103	85.2 Å²	85.2	63%	0.632	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-25	-177.1	-37.6	0	0	0	0	114.2	C515 H535	C515-T517 VanDerWaalsContact C-N 3.28Å; C515-T517 PolarHBondContact O-N 3.45Å; T517-H535 HydrophobicContact CG2-CB 4.03Å
518	C	80.8	Confident	76.5	Confident	50 Å²	50	84.3 Å²	84.3	34%	0.338	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.9	3.1	-170.7	69.3	0	0	0	0	115.3	C515 K520 H531 H535	C515-C518 VanDerWaalsContact CB-SG 3.57Å; C515-C518 PolarHBondContact O-N 3.01Å; C518-K520 PolarHBondContact O-N 3.31Å; C518-H531 PolarHBondContact SG-NE2 3.02Å; C518-H535 PolarHBondContact SG-NE2 3.14Å; C518-H535 VanDerWaalsContact SG-NE2 3.43Å
519	G	79.3	Confident	76.9	Confident	53 Å²	53	88.5 Å²	88.5	55%	0.546	46%	0.461	S	S	.	.			trans	69.9	-7.9	-178.5	0	0	0	0	0	116	C515 S521	C515-G519 VanDerWaalsContact O-CA 3.31Å; C515-G519 WeakPolarHBondContact O-CA 3.49Å; C515-G519 PolarHBondContact O-N 3.47Å; G519-S521 PolarHBondContact O-N 2.88Å; G519-S521 PolarHBondContact O-OG 3.38Å
520	K	80.2	Confident	77.8	Confident	92 Å²	92	81.6 Å²	81.6	40%	0.4	44%	0.435	S	S	.	.			trans	-65.5	130.1	-177.9	-66.1	-175.2	178	-172	0	111.3	D304 C515 C518 F522	D304-K520 WeakPolarHBondContact OD2-CE 3.28Å; D304-K520 IonicContact OD2-NZ 2.6Å; D304-K520 PolarHBondContact OD2-NZ 3.49Å; C515-K520 WeakPolarHBondContact CB-O 3.49Å; C515-K520 PolarHBondContact N-O 2.97Å; C518-K520 PolarHBondContact O-N 3.31Å; K520-F522 HydrophobicContact CB-CE2 3.85Å; K520-F522 HydrophobicContact CB-CZ 4Å; K520-F522 WeakPolarHBondContact O-CD2 3.48Å; K520-F522 VanDerWaalsContact O-CE2 3.23Å; K520-F522 WeakPolarHBondContact O-CE2 3.09Å
521	S	80.8	Confident	78.5	Confident	48 Å²	48	76.7 Å²	76.7	34%	0.336	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.6	-172.9	-39.9	0	0	0	0	111.8	M511 G519	M511-S521 VanDerWaalsContact CE-O 3.31Å; M511-S521 WeakPolarHBondContact CE-O 3.43Å; G519-S521 PolarHBondContact O-N 2.88Å; G519-S521 PolarHBondContact O-OG 3.38Å
522	F	79.9	Confident	78.9	Confident	45 Å²	45	75.4 Å²	75.4	20%	0.197	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.9	-171.3	-62	-88.2	0	0	0	113.3	M511 F513 C515 K520 R524 L528 H531	M511-F522 CarbonylContact C-O 3.6Å; M511-F522 VanDerWaalsContact SD-C 3.58Å; F513-F522 HydrophobicContact CB-CB 4.35Å; F513-F522 PolarHBondContact N-O 3.28Å; F513-F522 PolarHBondContact O-N 3.46Å; C515-F522 HydrophobicContact CB-CE2 4.3Å; K520-F522 HydrophobicContact CB-CE2 3.85Å; K520-F522 HydrophobicContact CB-CZ 4Å; K520-F522 WeakPolarHBondContact O-CD2 3.48Å; K520-F522 VanDerWaalsContact O-CE2 3.23Å; K520-F522 WeakPolarHBondContact O-CE2 3.09Å; F522-R524 VanDerWaalsContact C-N 3.34Å; F522-L528 HydrophobicContact CB-CB 4.36Å; F522-L528 HydrophobicContact CD2-CB 4.1Å; F522-L528 HydrophobicContact CD2-CD1 4Å; F522-L528 HydrophobicContact CE2-CD1 4.26Å; F522-L528 HydrophobicContact CG-CB 4.43Å; F522-H531 HydrophobicContact CE1-CB 4.11Å; F522-H531 HydrophobicContact CE2-CB 3.88Å; F522-H531 AromaticContact CE2-CD2 3.39Å; F522-H531 WeakPolarHBondContact CE2-CD2 3.49Å; F522-H531 AromaticContact CE2-CG 3.74Å; F522-H531 HydrophobicContact CZ-CB 3.55Å; F522-H531 AromaticContact CZ-CD2 3.39Å; F522-H531 WeakPolarHBondContact CZ-CD2 3.32Å; F522-H531 AromaticContact CZ-CG 3.33Å; F522-H531 AromaticContact CZ-ND1 3.99Å
523	K	73.8	Confident	79.2	Confident	77 Å²	77	72.8 Å²	72.8	34%	0.335	39%	0.388	S	S	.	.	S	Bend	trans	-76	-17.2	177.5	-64.9	-171.3	155.7	165.6	0	114.1	V505 A506 M511	V505-K523 HydrophobicContact CG1-CB 3.98Å; V505-K523 HydrophobicContact CG1-CG 4.46Å; V505-K523 WeakPolarHBondContact O-CD 3.48Å; V505-K523 WeakPolarHBondContact O-CE 3.25Å; A506-K523 PolarHBondContact O-NZ 3.12Å; M511-K523 HydrophobicContact CE-CG 4.23Å; M511-K523 HydrophobicContact SD-CB 4.33Å; M511-K523 HydrophobicContact SD-CD 4.17Å; M511-K523 HydrophobicContact SD-CG 3.27Å; M511-K523 WeakPolarHBondContact SD-CG 3.48Å
524	R	76.8	Confident	79.1	Confident	165 Å²	165	72.8 Å²	72.8	62%	0.623	39%	0.389	S	S	*	.	S	Bend	trans	-139.9	139.6	-175.9	-61.5	-173.1	-68.1	176.7	-7.6	110.7	F522 M526 S527 L528	F522-R524 VanDerWaalsContact C-N 3.34Å; R524-M526 VanDerWaalsContact C-N 3.28Å; R524-M526 PolarHBondContact O-N 2.95Å; R524-S527 PolarHBondContact NE-OG 3.12Å; R524-S527 WeakPolarHBondContact O-CB 3.28Å; R524-S527 PolarHBondContact O-N 2.82Å; R524-L528 PolarHBondContact O-N 2.84Å
525	S	76.3	Confident	78.9	Confident	71 Å²	71	72.4 Å²	72.4	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-56.8	-40.7	172.7	50.7	0	0	0	0	112.3	F513 S527 L528 K529	F513-S525 VanDerWaalsContact CD2-N 3.26Å; S525-S527 VanDerWaalsContact C-N 3.31Å; S525-S527 PolarHBondContact O-N 3.33Å; S525-L528 PolarHBondContact O-N 3.29Å; S525-K529 PolarHBondContact O-N 3.21Å
526	M	77.7	Confident	78.4	Confident	101 Å²	101	75.1 Å²	75.1	50%	0.498	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-38.4	175.4	-167.2	68.2	90.6	0	0	112	R524 K529 V530	R524-M526 VanDerWaalsContact C-N 3.28Å; R524-M526 PolarHBondContact O-N 2.95Å; M526-K529 PolarHBondContact O-N 3.11Å; M526-V530 WeakPolarHBondContact O-CB 3.29Å; M526-V530 PolarHBondContact O-N 3.41Å
527	S	81.3	Confident	78.1	Confident	32 Å²	32	68.3 Å²	68.3	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-69.4	-35.9	176.6	-60.2	0	0	0	0	112.3	R524 S525 H531	R524-S527 PolarHBondContact NE-OG 3.12Å; R524-S527 WeakPolarHBondContact O-CB 3.28Å; R524-S527 PolarHBondContact O-N 2.82Å; S525-S527 VanDerWaalsContact C-N 3.31Å; S525-S527 PolarHBondContact O-N 3.33Å; S527-H531 WeakPolarHBondContact O-CB 3.17Å; S527-H531 PolarHBondContact O-N 3.42Å
528	L	82.2	Confident	77.8	Confident	37 Å²	37	69 Å²	69	19%	0.194	38%	0.379	C	S	.	.	H	α-helix	trans	-64.6	-45.6	169.5	171.4	60.9	0	0	0	111.6	F513 C515 F522 R524 S525 V530 H531 S532	F513-L528 HydrophobicContact CB-CB 3.92Å; F513-L528 HydrophobicContact CB-CD2 3.81Å; F513-L528 HydrophobicContact CB-CG 4.49Å; C515-L528 HydrophobicContact CB-CD1 3.55Å; F522-L528 HydrophobicContact CB-CB 4.36Å; F522-L528 HydrophobicContact CD2-CB 4.1Å; F522-L528 HydrophobicContact CD2-CD1 4Å; F522-L528 HydrophobicContact CE2-CD1 4.26Å; F522-L528 HydrophobicContact CG-CB 4.43Å; R524-L528 PolarHBondContact O-N 2.84Å; S525-L528 PolarHBondContact O-N 3.29Å; L528-V530 VanDerWaalsContact C-N 3.33Å; L528-V530 PolarHBondContact O-N 3.12Å; L528-H531 CarbonylContact O-C 3.25Å; L528-H531 PolarHBondContact O-N 2.86Å; L528-H531 VanDerWaalsContact O-N 3.08Å; L528-S532 PolarHBondContact O-N 3.22Å
529	K	79.1	Confident	77.7	Confident	144 Å²	144	71 Å²	71	63%	0.626	38%	0.382	S	S	*	.	H	α-helix	trans	-62.3	-41.1	178.8	-170.6	177.9	-178.4	-177.6	0	111.9	S525 M526 S532 L533	S525-K529 PolarHBondContact O-N 3.21Å; M526-K529 PolarHBondContact O-N 3.11Å; K529-S532 WeakPolarHBondContact CA-OG 3.44Å; K529-S532 PolarHBondContact O-N 3.37Å; K529-S532 PolarHBondContact O-OG 3.09Å; K529-L533 PolarHBondContact O-N 3.28Å
530	V	79.2	Confident	77.5	Confident	52 Å²	52	71.6 Å²	71.6	32%	0.315	38%	0.376	S	S	.	.	H	α-helix	trans	-56.3	-49.6	169.1	147.3	0	0	0	0	111	M526 L528 S532 L533 Y552	M526-V530 WeakPolarHBondContact O-CB 3.29Å; M526-V530 PolarHBondContact O-N 3.41Å; L528-V530 VanDerWaalsContact C-N 3.33Å; L528-V530 PolarHBondContact O-N 3.12Å; V530-S532 VanDerWaalsContact C-N 3.35Å; V530-S532 PolarHBondContact O-N 3.5Å; V530-L533 WeakPolarHBondContact O-CB 3.41Å; V530-L533 PolarHBondContact O-N 2.88Å; V530-Y552 HydrophobicContact CB-CE1 4.45Å; V530-Y552 HydrophobicContact CG1-CE1 3.58Å; V530-Y552 WeakPolarHBondContact CG1-OH 3.31Å; V530-Y552 HydrophobicContact CG2-CE1 4.18Å
531	H	81.6	Confident	77.4	Confident	16 Å²	16	70.8 Å²	70.8	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-66.8	-33.5	-179.7	-178.2	57.3	0	0	0	113	C518 F522 S527 L528 L533 Q534 H535	C518-H531 PolarHBondContact SG-NE2 3.02Å; F522-H531 HydrophobicContact CE1-CB 4.11Å; F522-H531 HydrophobicContact CE2-CB 3.88Å; F522-H531 AromaticContact CE2-CD2 3.39Å; F522-H531 WeakPolarHBondContact CE2-CD2 3.49Å; F522-H531 AromaticContact CE2-CG 3.74Å; F522-H531 HydrophobicContact CZ-CB 3.55Å; F522-H531 AromaticContact CZ-CD2 3.39Å; F522-H531 WeakPolarHBondContact CZ-CD2 3.32Å; F522-H531 AromaticContact CZ-CG 3.33Å; F522-H531 AromaticContact CZ-ND1 3.99Å; S527-H531 WeakPolarHBondContact O-CB 3.17Å; S527-H531 PolarHBondContact O-N 3.42Å; L528-H531 CarbonylContact O-C 3.25Å; L528-H531 PolarHBondContact O-N 2.86Å; L528-H531 VanDerWaalsContact O-N 3.08Å; H531-L533 PolarHBondContact O-N 3.2Å; H531-Q534 PolarHBondContact ND1-OE1 3.02Å; H531-Q534 WeakPolarHBondContact O-CB 3.31Å; H531-Q534 PolarHBondContact O-N 3.4Å; H531-H535 AromaticContact CD2-NE2 3.63Å; H531-H535 AromaticContact CE1-NE2 3.43Å; H531-H535 PolarHBondContact CE1-NE2 3.4Å; H531-H535 AromaticContact NE2-CD2 3.86Å; H531-H535 AromaticContact NE2-CE1 3.94Å; H531-H535 AromaticContact NE2-NE2 2.96Å; H531-H535 PolarHBondContact NE2-NE2 3.48Å
532	S	78.4	Confident	77.4	Confident	49 Å²	49	74.8 Å²	74.8	34%	0.343	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-24.1	176.2	59.2	0	0	0	0	113.3	L528 K529 V530 Q534 H535 S536	L528-S532 PolarHBondContact O-N 3.22Å; K529-S532 WeakPolarHBondContact CA-OG 3.44Å; K529-S532 PolarHBondContact O-N 3.37Å; K529-S532 PolarHBondContact O-OG 3.09Å; V530-S532 VanDerWaalsContact C-N 3.35Å; V530-S532 PolarHBondContact O-N 3.5Å; S532-Q534 PolarHBondContact O-N 3.49Å; S532-H535 PolarHBondContact O-N 2.94Å; S532-H535 VanDerWaalsContact O-N 3.14Å; S532-S536 PolarHBondContact O-N 3.34Å; S532-S536 VanDerWaalsContact O-N 3.07Å
533	L	79.7	Confident	77.4	Confident	35 Å²	35	72.9 Å²	72.9	18%	0.183	38%	0.376	C	S	.	.	H	α-helix	trans	-67.1	-20.2	172.7	-61.2	172.3	0	0	0	113.2	K529 V530 H531 G537 E538 Q551	K529-L533 PolarHBondContact O-N 3.28Å; V530-L533 WeakPolarHBondContact O-CB 3.41Å; V530-L533 PolarHBondContact O-N 2.88Å; H531-L533 PolarHBondContact O-N 3.2Å; L533-G537 PolarHBondContact O-N 3.49Å; L533-E538 HydrophobicContact CD2-CB 4.16Å; L533-Q551 HydrophobicContact CB-CG 3.86Å; L533-Q551 HydrophobicContact CD1-CG 4.36Å; L533-Q551 PolarHBondContact O-NE2 2.8Å
534	Q	74.8	Confident	77.6	Confident	74 Å²	74	77.1 Å²	77.1	35%	0.346	40%	0.397	S	S	.	.	H	α-helix	trans	-72.6	-35.3	172	-65.3	-179.8	-82.7	0	0	111	E301 H531 S532	E301-Q534 PolarHBondContact OE1-NE2 3.27Å; H531-Q534 PolarHBondContact ND1-OE1 3.02Å; H531-Q534 WeakPolarHBondContact O-CB 3.31Å; H531-Q534 PolarHBondContact O-N 3.4Å; S532-Q534 PolarHBondContact O-N 3.49Å
535	H	75.9	Confident	77.4	Confident	76 Å²	76	72.9 Å²	72.9	35%	0.352	39%	0.393	S	S	.	.	H	α-helix	trans	-79.7	-34.3	179.3	-61.7	-65.3	0	0	0	113.5	T517 C518 H531 S532 G537	T517-H535 HydrophobicContact CG2-CB 4.03Å; C518-H535 PolarHBondContact SG-NE2 3.14Å; C518-H535 VanDerWaalsContact SG-NE2 3.43Å; H531-H535 AromaticContact CD2-NE2 3.63Å; H531-H535 AromaticContact CE1-NE2 3.43Å; H531-H535 PolarHBondContact CE1-NE2 3.4Å; H531-H535 AromaticContact NE2-CD2 3.86Å; H531-H535 AromaticContact NE2-CE1 3.94Å; H531-H535 AromaticContact NE2-NE2 2.96Å; H531-H535 PolarHBondContact NE2-NE2 3.48Å; S532-H535 PolarHBondContact O-N 2.94Å; S532-H535 VanDerWaalsContact O-N 3.14Å; H535-G537 VanDerWaalsContact C-N 3.3Å
536	S	73.5	Confident	77.5	Confident	62 Å²	62	71.2 Å²	71.2	43%	0.434	38%	0.381	S	S	.	.	H	α-helix	trans	-77.8	-15.7	176	65.4	0	0	0	0	113.6	S532 E538	S532-S536 PolarHBondContact O-N 3.34Å; S532-S536 VanDerWaalsContact O-N 3.07Å; S536-E538 PolarHBondContact O-N 3.01Å; S536-E538 VanDerWaalsContact O-N 3.13Å; S536-E538 WeakPolarHBondContact OG-CB 3.45Å; S536-E538 WeakPolarHBondContact OG-CG 3.48Å; S536-E538 PolarHBondContact OG-N 3.36Å
537	G	71.4	Confident	77.6	Confident	53 Å²	53	72 Å²	72	55%	0.546	40%	0.396	S	S	.	.			trans	65.2	5.6	-170.5	0	0	0	0	0	113.7	L533 H535 K539	L533-G537 PolarHBondContact O-N 3.49Å; H535-G537 VanDerWaalsContact C-N 3.3Å; G537-K539 PolarHBondContact O-N 3.15Å
538	E	71.8	Confident	77.3	Confident	117 Å²	117	74.9 Å²	74.9	55%	0.547	41%	0.406	S	S	.	.			trans	-66.5	123.1	-178.4	-74	178.5	-156.8	0	0	110.4	L533 S536 P540	L533-E538 HydrophobicContact CD2-CB 4.16Å; S536-E538 PolarHBondContact O-N 3.01Å; S536-E538 VanDerWaalsContact O-N 3.13Å; S536-E538 WeakPolarHBondContact OG-CB 3.45Å; S536-E538 WeakPolarHBondContact OG-CG 3.48Å; S536-E538 PolarHBondContact OG-N 3.36Å; E538-P540 WeakPolarHBondContact O-CD 3.47Å
539	K	77.2	Confident	77.2	Confident	92 Å²	92	79.3 Å²	79.3	40%	0.4	42%	0.42	S	S	.	.			trans	-111.7	88.5	172.8	-70.7	165.3	147.8	-143.4	0	108	G537 F541 E548 R549 F550	G537-K539 PolarHBondContact O-N 3.15Å; K539-F541 VanDerWaalsContact C-N 3.33Å; K539-F541 PolarHBondContact O-N 2.88Å; K539-E548 IonicContact NZ-OE2 2.71Å; K539-R549 HydrophobicContact CB-CB 3.6Å; K539-R549 HydrophobicContact CD-CB 4.02Å; K539-R549 WeakPolarHBondContact CD-O 3.5Å; K539-R549 WeakPolarHBondContact CE-O 3.5Å; K539-R549 HydrophobicContact CG-CB 4.42Å; K539-R549 PolarHBondContact NZ-O 2.91Å; K539-R549 PolarHBondContact O-NE 2.89Å; K539-R549 PolarHBondContact O-NH2 3.31Å; K539-F550 CarbonylContact C-O 3.57Å; K539-F550 VanDerWaalsContact C-O 3.31Å; K539-F550 WeakPolarHBondContact CA-O 3.37Å
540	P	76.4	Confident	77.2	Confident	66 Å²	66	73.4 Å²	73.4	43%	0.429	39%	0.394	S	S	.	.			trans	-70.4	-31.5	-171.9	-18.6	33.2	0	0	0	112.5	E538 K542	E538-P540 WeakPolarHBondContact O-CD 3.47Å; P540-K542 PolarHBondContact O-N 3Å
541	F	77.9	Confident	77.1	Confident	74 Å²	74	72.1 Å²	72.1	33%	0.325	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	89.8	-172.4	-57.4	-80.8	0	0	0	110	K539 F550 Q551 Y552 K553 L556	K539-F541 VanDerWaalsContact C-N 3.33Å; K539-F541 PolarHBondContact O-N 2.88Å; F541-F550 HydrophobicContact CB-CB 4.24Å; F541-F550 PolarHBondContact N-O 3.3Å; F541-F550 VanDerWaalsContact N-O 3.11Å; F541-F550 PolarHBondContact O-N 3.19Å; F541-Q551 WeakPolarHBondContact CE2-O 3.28Å; F541-Y552 VanDerWaalsContact CD2-C 3.45Å; F541-K553 HydrophobicContact CD1-CB 4.22Å; F541-K553 HydrophobicContact CE1-CB 3.84Å; F541-K553 HydrophobicContact CE1-CG 4.22Å; F541-K553 HydrophobicContact CZ-CB 4.04Å; F541-L556 HydrophobicContact CB-CB 4.09Å; F541-L556 HydrophobicContact CB-CD2 3.92Å
542	K	79.8	Confident	76.9	Confident	132 Å²	132	73.7 Å²	73.7	57%	0.574	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	145	171.3	63.9	172	-174.3	168.4	0	111.3	P540 R549 L556	P540-K542 PolarHBondContact O-N 3Å; K542-R549 HydrophobicContact CB-CG 4.27Å; K542-L556 WeakPolarHBondContact O-CD2 3.1Å
543	C	81.3	Confident	76.7	Confident	6 Å²	6	77.6 Å²	77.6	4%	0.041	40%	0.402	C	S	.	.			trans	-64	149.6	157.3	-175.1	0	0	0	0	109.5	C546 E548 F550 M560 H563	C543-C546 CarbonylContact C-O 3.56Å; C543-C546 HydrophobicContact CB-CB 4.22Å; C543-C546 VanDerWaalsContact CB-O 3.28Å; C543-C546 WeakPolarHBondContact CB-O 3.38Å; C543-C546 WeakPolarHBondContact CB-SG 3.32Å; C543-C546 VanDerWaalsContact SG-CA 3.51Å; C543-C546 WeakPolarHBondContact SG-CB 3.42Å; C543-C546 PolarHBondContact SG-N 3.27Å; C543-C546 CovalentContact SG-SG 2.04Å; C543-C546 PolarHBondContact SG-SG 2.91Å; C543-E548 HydrophobicContact CB-CB 4.43Å; C543-E548 WeakPolarHBondContact CB-O 3.17Å; C543-E548 PolarHBondContact N-O 2.89Å; C543-F550 HydrophobicContact CB-CE2 4.47Å; C543-M560 HydrophobicContact CB-CE 4.17Å; C543-M560 WeakPolarHBondContact SG-CE 3.38Å; C543-H563 PolarHBondContact SG-NE2 3.47Å
544	E	76.3	Confident	76.5	Confident	166 Å²	166	82.2 Å²	82.2	78%	0.776	42%	0.418	S	S	*	.	S	Bend	trans	-101.1	-36.3	172.1	-61.3	-163.9	144.7	0	0	111.4	C546	E544-C546 PolarHBondContact O-N 3.18Å
545	S	73	Confident	76.7	Confident	76 Å²	76	79.7 Å²	79.7	53%	0.531	41%	0.405	S	S	.	.	S	Bend	trans	-75.1	-5.5	174.9	-47.5	0	0	0	0	114.3	H563	S545-H563 VanDerWaalsContact CB-ND1 3.29Å; S545-H563 WeakPolarHBondContact CB-ND1 3.46Å
546	C	79.8	Confident	76.9	Confident	36 Å²	36	77.6 Å²	77.6	24%	0.243	40%	0.397	C	S	.	.	S	Bend	trans	-163.4	171.1	-171	72.7	0	0	0	0	112.4	C543 E544 E548 H559 H563	C543-C546 CarbonylContact C-O 3.56Å; C543-C546 HydrophobicContact CB-CB 4.22Å; C543-C546 VanDerWaalsContact CB-O 3.28Å; C543-C546 WeakPolarHBondContact CB-O 3.38Å; C543-C546 WeakPolarHBondContact CB-SG 3.32Å; C543-C546 VanDerWaalsContact SG-CA 3.51Å; C543-C546 WeakPolarHBondContact SG-CB 3.42Å; C543-C546 PolarHBondContact SG-N 3.27Å; C543-C546 CovalentContact SG-SG 2.04Å; C543-C546 PolarHBondContact SG-SG 2.91Å; E544-C546 PolarHBondContact O-N 3.18Å; C546-E548 VanDerWaalsContact C-N 3.34Å; C546-H559 PolarHBondContact SG-NE2 3.4Å; C546-H563 WeakPolarHBondContact CB-CE1 3.4Å; C546-H563 PolarHBondContact SG-NE2 3.46Å
547	S	79	Confident	77	Confident	116 Å²	116	81 Å²	81	81%	0.811	40%	0.4	S	S	*	.	S	Bend	trans	-81.7	-5.1	179.8	48.1	0	0	0	0	114.9
548	E	75.1	Confident	77	Confident	94 Å²	94	79.3 Å²	79.3	44%	0.439	38%	0.38	S	S	.	.			trans	-67.7	149.4	-176.8	-91.7	-53.5	141.6	0	0	113.6	K539 C543 C546 F550	K539-E548 IonicContact NZ-OE2 2.71Å; C543-E548 HydrophobicContact CB-CB 4.43Å; C543-E548 WeakPolarHBondContact CB-O 3.17Å; C543-E548 PolarHBondContact N-O 2.89Å; C546-E548 VanDerWaalsContact C-N 3.34Å; E548-F550 HydrophobicContact CB-CE2 3.91Å; E548-F550 HydrophobicContact CB-CZ 3.86Å
549	R	80	Confident	77.4	Confident	129 Å²	129	75.2 Å²	75.2	49%	0.487	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.6	-175.8	-62	-177	63.7	161.6	-0	111	K539 K542	K539-R549 HydrophobicContact CB-CB 3.6Å; K539-R549 HydrophobicContact CD-CB 4.02Å; K539-R549 WeakPolarHBondContact CD-O 3.5Å; K539-R549 WeakPolarHBondContact CE-O 3.5Å; K539-R549 HydrophobicContact CG-CB 4.42Å; K539-R549 PolarHBondContact NZ-O 2.91Å; K539-R549 PolarHBondContact O-NE 2.89Å; K539-R549 PolarHBondContact O-NH2 3.31Å; K542-R549 HydrophobicContact CB-CG 4.27Å
550	F	79.5	Confident	77.1	Confident	20 Å²	20	72.7 Å²	72.7	9%	0.088	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.6	-173.8	-57.7	-81.3	0	0	0	111.4	K539 F541 C543 E548 Y552 Q555 L556 H559	K539-F550 CarbonylContact C-O 3.57Å; K539-F550 VanDerWaalsContact C-O 3.31Å; K539-F550 WeakPolarHBondContact CA-O 3.37Å; F541-F550 HydrophobicContact CB-CB 4.24Å; F541-F550 PolarHBondContact N-O 3.3Å; F541-F550 VanDerWaalsContact N-O 3.11Å; F541-F550 PolarHBondContact O-N 3.19Å; C543-F550 HydrophobicContact CB-CE2 4.47Å; E548-F550 HydrophobicContact CB-CE2 3.91Å; E548-F550 HydrophobicContact CB-CZ 3.86Å; F550-Y552 VanDerWaalsContact C-N 3.35Å; F550-Q555 HydrophobicContact CB-CB 4.1Å; F550-Q555 HydrophobicContact CD1-CB 3.91Å; F550-Q555 HydrophobicContact CG-CB 4.25Å; F550-L556 HydrophobicContact CB-CB 4.37Å; F550-L556 HydrophobicContact CD2-CB 4.08Å; F550-L556 HydrophobicContact CD2-CD1 3.92Å; F550-L556 HydrophobicContact CE2-CD1 4.22Å; F550-L556 HydrophobicContact CG-CB 4.4Å; F550-H559 HydrophobicContact CE1-CB 4.06Å; F550-H559 HydrophobicContact CE2-CB 3.87Å; F550-H559 AromaticContact CE2-CD2 3.49Å; F550-H559 VanDerWaalsContact CE2-CD2 3.49Å; F550-H559 WeakPolarHBondContact CE2-CD2 3.25Å; F550-H559 AromaticContact CE2-CG 3.63Å; F550-H559 HydrophobicContact CZ-CB 3.54Å; F550-H559 AromaticContact CZ-CD2 3.52Å; F550-H559 AromaticContact CZ-CE1 3.98Å; F550-H559 AromaticContact CZ-CG 3.23Å; F550-H559 AromaticContact CZ-ND1 3.56Å; F550-H559 AromaticContact CZ-NE2 3.97Å
551	Q	76.4	Confident	76.8	Confident	25 Å²	25	70.4 Å²	70.4	12%	0.117	34%	0.336	C	S	.	.	S	Bend	trans	-80.3	-19.8	176.8	-174.3	173.4	75.6	0	0	111.9	L533 F541	L533-Q551 HydrophobicContact CB-CG 3.86Å; L533-Q551 HydrophobicContact CD1-CG 4.36Å; L533-Q551 PolarHBondContact O-NE2 2.8Å; F541-Q551 WeakPolarHBondContact CE2-O 3.28Å
552	Y	77.4	Confident	76.5	Confident	49 Å²	49	71.3 Å²	71.3	19%	0.192	34%	0.344	C	S	.	.	S	Bend	trans	-136.4	147.3	-175.3	-55	-98	0	0	0	113.4	V530 F541 F550 Y554 Q555 L556	V530-Y552 HydrophobicContact CB-CE1 4.45Å; V530-Y552 HydrophobicContact CG1-CE1 3.58Å; V530-Y552 WeakPolarHBondContact CG1-OH 3.31Å; V530-Y552 HydrophobicContact CG2-CE1 4.18Å; F541-Y552 VanDerWaalsContact CD2-C 3.45Å; F550-Y552 VanDerWaalsContact C-N 3.35Å; Y552-Y554 VanDerWaalsContact CB-CD1 3.49Å; Y552-Y554 VanDerWaalsContact CB-CE1 3.46Å; Y552-Y554 HydrophobicContact CD1-CD1 4.41Å; Y552-Y554 AromaticContact CD1-CE1 3.92Å; Y552-Y554 HydrophobicContact CD1-CE1 3.92Å; Y552-Y554 HydrophobicContact CD2-CE1 4.1Å; Y552-Y554 HydrophobicContact CG-CD1 4.09Å; Y552-Y554 AromaticContact CG-CE1 3.58Å; Y552-Y554 HydrophobicContact CG-CE1 3.58Å; Y552-Y554 PolarHBondContact O-N 3.49Å; Y552-Q555 VanDerWaalsContact CD2-CD 3.46Å; Y552-Q555 HydrophobicContact CD2-CG 4.34Å; Y552-Q555 PolarHBondContact O-N 2.77Å; Y552-L556 PolarHBondContact O-N 3.37Å
553	K	75.3	Confident	75.9	Confident	132 Å²	132	69.3 Å²	69.3	57%	0.574	34%	0.336	S	S	*	.	H	α-helix	trans	-57.9	-40.4	176.3	-165.1	-177.4	-177.5	-175.3	0	113.2	F541 Q555 L556 R557	F541-K553 HydrophobicContact CD1-CB 4.22Å; F541-K553 HydrophobicContact CE1-CB 3.84Å; F541-K553 HydrophobicContact CE1-CG 4.22Å; F541-K553 HydrophobicContact CZ-CB 4.04Å; K553-Q555 VanDerWaalsContact C-N 3.34Å; K553-Q555 PolarHBondContact O-N 3.38Å; K553-L556 PolarHBondContact O-N 3.45Å; K553-R557 PolarHBondContact O-N 3.08Å
554	Y	74.4	Confident	75.2	Confident	132 Å²	132	74.9 Å²	74.9	52%	0.518	36%	0.364	S	S	.	.	H	α-helix	trans	-67.2	-34.1	179	81.5	-90.2	0	0	0	112.7	Y552 R557 S558	Y552-Y554 VanDerWaalsContact CB-CD1 3.49Å; Y552-Y554 VanDerWaalsContact CB-CE1 3.46Å; Y552-Y554 HydrophobicContact CD1-CD1 4.41Å; Y552-Y554 AromaticContact CD1-CE1 3.92Å; Y552-Y554 HydrophobicContact CD1-CE1 3.92Å; Y552-Y554 HydrophobicContact CD2-CE1 4.1Å; Y552-Y554 HydrophobicContact CG-CD1 4.09Å; Y552-Y554 AromaticContact CG-CE1 3.58Å; Y552-Y554 HydrophobicContact CG-CE1 3.58Å; Y552-Y554 PolarHBondContact O-N 3.49Å; Y554-R557 PolarHBondContact O-N 3.04Å; Y554-S558 PolarHBondContact O-N 3.24Å
555	Q	78.7	Confident	74.4	Confident	20 Å²	20	69.1 Å²	69.1	9%	0.093	35%	0.35	C	S	.	.	H	α-helix	trans	-69.7	-41.3	176.4	-63.5	177.2	0.7	0	0	110.9	R299 F550 Y552 K553 H559	R299-Q555 VanDerWaalsContact CZ-OE1 3.28Å; F550-Q555 HydrophobicContact CB-CB 4.1Å; F550-Q555 HydrophobicContact CD1-CB 3.91Å; F550-Q555 HydrophobicContact CG-CB 4.25Å; Y552-Q555 VanDerWaalsContact CD2-CD 3.46Å; Y552-Q555 HydrophobicContact CD2-CG 4.34Å; Y552-Q555 PolarHBondContact O-N 2.77Å; K553-Q555 VanDerWaalsContact C-N 3.34Å; K553-Q555 PolarHBondContact O-N 3.38Å; Q555-H559 VanDerWaalsContact O-CB 3.3Å; Q555-H559 WeakPolarHBondContact O-CB 3.47Å; Q555-H559 PolarHBondContact O-N 3.45Å
556	L	79.7	Confident	73.6	Confident	32 Å²	32	71.2 Å²	71.2	17%	0.168	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-44.6	170	176.5	62	0	0	0	111.2	F541 K542 F550 Y552 K553 S558 H559 M560	F541-L556 HydrophobicContact CB-CB 4.09Å; F541-L556 HydrophobicContact CB-CD2 3.92Å; K542-L556 WeakPolarHBondContact O-CD2 3.1Å; F550-L556 HydrophobicContact CB-CB 4.37Å; F550-L556 HydrophobicContact CD2-CB 4.08Å; F550-L556 HydrophobicContact CD2-CD1 3.92Å; F550-L556 HydrophobicContact CE2-CD1 4.22Å; F550-L556 HydrophobicContact CG-CB 4.4Å; Y552-L556 PolarHBondContact O-N 3.37Å; K553-L556 PolarHBondContact O-N 3.45Å; L556-S558 PolarHBondContact O-N 3.29Å; L556-H559 PolarHBondContact O-N 3.13Å; L556-M560 HydrophobicContact CD1-CE 4Å; L556-M560 HydrophobicContact CD1-CG 3.92Å; L556-M560 HydrophobicContact CD1-SD 4.38Å; L556-M560 HydrophobicContact CG-CG 4.21Å; L556-M560 WeakPolarHBondContact O-CB 3.49Å; L556-M560 VanDerWaalsContact O-CG 3.23Å; L556-M560 WeakPolarHBondContact O-CG 3.46Å; L556-M560 PolarHBondContact O-N 3.36Å
557	R	76.2	Confident	72.4	Confident	135 Å²	135	75 Å²	75	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-57.3	-47.5	177.9	-173.4	-169.6	-70.2	152.4	-0.1	111.9	E326 K553 Y554 M560 S561	E326-R557 IonicContact OE1-CZ 3.63Å; E326-R557 IonicContact OE1-NH1 2.8Å; E326-R557 PolarHBondContact OE1-NH1 3.38Å; E326-R557 IonicContact OE1-NH2 3.84Å; E326-R557 PolarHBondContact OE1-NH2 3.22Å; K553-R557 PolarHBondContact O-N 3.08Å; Y554-R557 PolarHBondContact O-N 3.04Å; R557-M560 PolarHBondContact O-N 3.11Å; R557-S561 PolarHBondContact O-N 3.36Å
558	S	71.5	Confident	71.6	Confident	17 Å²	17	75.3 Å²	75.3	12%	0.119	35%	0.352	C	S	.	.	H	α-helix	trans	-66.7	-41.7	176.7	-177.8	0	0	0	0	111.8	Y554 L556 M560 S561 N579 M580	Y554-S558 PolarHBondContact O-N 3.24Å; L556-S558 PolarHBondContact O-N 3.29Å; S558-M560 VanDerWaalsContact C-N 3.32Å; S558-M560 PolarHBondContact O-N 3.46Å; S558-S561 WeakPolarHBondContact O-CB 3.33Å; S558-S561 PolarHBondContact O-N 3.19Å; S558-S561 VanDerWaalsContact O-N 3.08Å; S558-S561 PolarHBondContact O-OG 2.94Å; S558-N579 PolarHBondContact OG-O 3.33Å; S558-M580 WeakPolarHBondContact OG-CE 3.37Å; S558-M580 WeakPolarHBondContact OG-CG 3.35Å
559	H	80.4	Confident	71.2	Confident	31 Å²	31	73.5 Å²	73.5	14%	0.144	34%	0.343	C	S	.	.	H	α-helix	trans	-63.2	-35.3	175.6	-177.7	77.1	0	0	0	113.1	C546 F550 Q555 L556 S561 I562 H563	C546-H559 PolarHBondContact SG-NE2 3.4Å; F550-H559 HydrophobicContact CE1-CB 4.06Å; F550-H559 HydrophobicContact CE2-CB 3.87Å; F550-H559 AromaticContact CE2-CD2 3.49Å; F550-H559 VanDerWaalsContact CE2-CD2 3.49Å; F550-H559 WeakPolarHBondContact CE2-CD2 3.25Å; F550-H559 AromaticContact CE2-CG 3.63Å; F550-H559 HydrophobicContact CZ-CB 3.54Å; F550-H559 AromaticContact CZ-CD2 3.52Å; F550-H559 AromaticContact CZ-CE1 3.98Å; F550-H559 AromaticContact CZ-CG 3.23Å; F550-H559 AromaticContact CZ-ND1 3.56Å; F550-H559 AromaticContact CZ-NE2 3.97Å; Q555-H559 VanDerWaalsContact O-CB 3.3Å; Q555-H559 WeakPolarHBondContact O-CB 3.47Å; Q555-H559 PolarHBondContact O-N 3.45Å; L556-H559 PolarHBondContact O-N 3.13Å; H559-S561 PolarHBondContact O-N 3.1Å; H559-I562 VanDerWaalsContact O-CB 3.27Å; H559-I562 WeakPolarHBondContact O-CB 3.36Å; H559-I562 WeakPolarHBondContact O-CG1 3.34Å; H559-I562 PolarHBondContact O-N 2.75Å; H559-H563 AromaticContact CD2-CD2 3.83Å; H559-H563 AromaticContact CD2-NE2 2.96Å; H559-H563 PolarHBondContact CD2-NE2 2.67Å; H559-H563 AromaticContact CE1-NE2 2.83Å; H559-H563 PolarHBondContact CE1-NE2 2.9Å; H559-H563 AromaticContact CG-NE2 3.92Å; H559-H563 AromaticContact ND1-NE2 3.84Å; H559-H563 AromaticContact NE2-CD2 3.62Å; H559-H563 AromaticContact NE2-NE2 2.05Å; H559-H563 PolarHBondContact NE2-NE2 3.35Å
560	M	70.3	Confident	70.9	Confident	38 Å²	38	72.9 Å²	72.9	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-26.7	173.6	-71.3	-72.5	97.6	0	0	112.9	C543 L556 R557 S558 I562 H563 I564	C543-M560 HydrophobicContact CB-CE 4.17Å; C543-M560 WeakPolarHBondContact SG-CE 3.38Å; L556-M560 HydrophobicContact CD1-CE 4Å; L556-M560 HydrophobicContact CD1-CG 3.92Å; L556-M560 HydrophobicContact CD1-SD 4.38Å; L556-M560 HydrophobicContact CG-CG 4.21Å; L556-M560 WeakPolarHBondContact O-CB 3.49Å; L556-M560 VanDerWaalsContact O-CG 3.23Å; L556-M560 WeakPolarHBondContact O-CG 3.46Å; L556-M560 PolarHBondContact O-N 3.36Å; R557-M560 PolarHBondContact O-N 3.11Å; S558-M560 VanDerWaalsContact C-N 3.32Å; S558-M560 PolarHBondContact O-N 3.46Å; M560-I562 PolarHBondContact O-N 2.9Å; M560-H563 PolarHBondContact O-N 3.02Å; M560-I564 HydrophobicContact CB-CD1 4.34Å; M560-I564 VanDerWaalsContact O-CG1 3.28Å; M560-I564 WeakPolarHBondContact O-CG1 3.37Å; M560-I564 PolarHBondContact O-N 3.23Å
561	S	69.8	Low	70.9	Confident	18 Å²	18	72 Å²	72	13%	0.126	34%	0.342	C	S	.	.	H	α-helix	trans	-63.4	-26	172.9	76.7	0	0	0	0	113	R557 S558 H559 G565 H566 N579	R557-S561 PolarHBondContact O-N 3.36Å; S558-S561 WeakPolarHBondContact O-CB 3.33Å; S558-S561 PolarHBondContact O-N 3.19Å; S558-S561 VanDerWaalsContact O-N 3.08Å; S558-S561 PolarHBondContact O-OG 2.94Å; H559-S561 PolarHBondContact O-N 3.1Å; S561-G565 WeakPolarHBondContact O-CA 3.43Å; S561-G565 PolarHBondContact O-N 3.44Å; S561-H566 PolarHBondContact O-N 2.97Å; S561-N579 WeakPolarHBondContact OG-CB 3.49Å
562	I	72.2	Confident	70.7	Confident	94 Å²	94	79.7 Å²	79.7	48%	0.482	38%	0.379	S	S	.	.	H	α-helix	trans	-69.5	-42.7	176.2	-51.3	176.9	0	0	0	110.2	H559 M560	H559-I562 VanDerWaalsContact O-CB 3.27Å; H559-I562 WeakPolarHBondContact O-CB 3.36Å; H559-I562 WeakPolarHBondContact O-CG1 3.34Å; H559-I562 PolarHBondContact O-N 2.75Å; M560-I562 PolarHBondContact O-N 2.9Å
563	H	68.3	Low	70.6	Confident	90 Å²	90	85 Å²	85	42%	0.417	40%	0.398	S	S	.	.	H	α-helix	trans	-74.2	-35	179.2	-68.1	-78.7	0	0	0	113.5	C543 S545 C546 H559 M560 G565	C543-H563 PolarHBondContact SG-NE2 3.47Å; S545-H563 VanDerWaalsContact CB-ND1 3.29Å; S545-H563 WeakPolarHBondContact CB-ND1 3.46Å; C546-H563 WeakPolarHBondContact CB-CE1 3.4Å; C546-H563 PolarHBondContact SG-NE2 3.46Å; H559-H563 AromaticContact CD2-CD2 3.83Å; H559-H563 AromaticContact CD2-NE2 2.96Å; H559-H563 PolarHBondContact CD2-NE2 2.67Å; H559-H563 AromaticContact CE1-NE2 2.83Å; H559-H563 PolarHBondContact CE1-NE2 2.9Å; H559-H563 AromaticContact CG-NE2 3.92Å; H559-H563 AromaticContact ND1-NE2 3.84Å; H559-H563 AromaticContact NE2-CD2 3.62Å; H559-H563 AromaticContact NE2-NE2 2.05Å; H559-H563 PolarHBondContact NE2-NE2 3.35Å; M560-H563 PolarHBondContact O-N 3.02Å; H563-G565 VanDerWaalsContact C-N 3.35Å
564	I	65.7	Low	70.7	Confident	122 Å²	122	81.7 Å²	81.7	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-85.2	-14.7	-179.8	-55.7	166.3	0	0	0	110.7	M560 H566	M560-I564 HydrophobicContact CB-CD1 4.34Å; M560-I564 VanDerWaalsContact O-CG1 3.28Å; M560-I564 WeakPolarHBondContact O-CG1 3.37Å; M560-I564 PolarHBondContact O-N 3.23Å; I564-H566 HydrophobicContact CB-CB 4.37Å; I564-H566 HydrophobicContact CG2-CB 3.98Å; I564-H566 PolarHBondContact O-N 2.98Å
565	G	60.8	Low	70.8	Confident	46 Å²	46	77.6 Å²	77.6	47%	0.474	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	14.2	-174.6	0	0	0	0	0	113.8	S561 H563 K567	S561-G565 WeakPolarHBondContact O-CA 3.43Å; S561-G565 PolarHBondContact O-N 3.44Å; H563-G565 VanDerWaalsContact C-N 3.35Å; G565-K567 VanDerWaalsContact C-N 3.31Å; G565-K567 PolarHBondContact O-N 3.27Å
566	H	55.7	Low	70.6	Confident	119 Å²	119	80.9 Å²	80.9	55%	0.551	40%	0.403	S	S	*	.			trans	-82.5	75	-170.1	-160.1	-67.8	0	0	0	111.6	S561 I564 Q568	S561-H566 PolarHBondContact O-N 2.97Å; I564-H566 HydrophobicContact CB-CB 4.37Å; I564-H566 HydrophobicContact CG2-CB 3.98Å; I564-H566 PolarHBondContact O-N 2.98Å; H566-Q568 PolarHBondContact O-N 3.3Å
567	K	54.3	Low	70.4	Confident	117 Å²	117	82.4 Å²	82.4	51%	0.509	41%	0.411	S	S	.	.			trans	-59.3	95.5	177.7	-66.2	168.4	177.8	-129.1	0	110.9	G565 D577	G565-K567 VanDerWaalsContact C-N 3.31Å; G565-K567 PolarHBondContact O-N 3.27Å; K567-D577 HydrophobicContact CB-CB 4.05Å; K567-D577 HydrophobicContact CD-CB 3.84Å; K567-D577 VanDerWaalsContact CD-CG 3.43Å; K567-D577 WeakPolarHBondContact CD-OD2 3.43Å; K567-D577 WeakPolarHBondContact CE-OD2 3.47Å; K567-D577 HydrophobicContact CG-CB 4.01Å; K567-D577 VanDerWaalsContact CG-OD2 3.27Å; K567-D577 WeakPolarHBondContact CG-OD2 3.46Å; K567-D577 IonicContact NZ-OD1 2.64Å; K567-D577 PolarHBondContact NZ-OD1 3.35Å; K567-D577 IonicContact NZ-OD2 3.81Å; K567-D577 PolarHBondContact NZ-OD2 2.98Å
568	Q	62	Low	70.3	Confident	121 Å²	121	77.7 Å²	77.7	57%	0.565	40%	0.395	S	S	*	.			trans	-76.6	-26.9	-173.1	-75.1	-177.8	-19.3	0	0	114	H566	H566-Q568 PolarHBondContact O-N 3.3Å
569	F	66.4	Low	70.3	Confident	57 Å²	57	79.7 Å²	79.7	25%	0.25	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	106	-173.3	-54	-81.1	0	0	0	110.6	D577 F578 K581 F584	F569-D577 CarbonylContact O-C 3.55Å; F569-D577 WeakPolarHBondContact O-CA 3.33Å; F569-F578 HydrophobicContact CB-CB 4.35Å; F569-F578 PolarHBondContact N-O 3.23Å; F569-F578 PolarHBondContact O-N 3.15Å; F569-K581 HydrophobicContact CD1-CB 4.42Å; F569-K581 HydrophobicContact CE1-CB 3.93Å; F569-K581 HydrophobicContact CE1-CG 4.37Å; F569-K581 HydrophobicContact CE2-CB 4.07Å; F569-K581 HydrophobicContact CZ-CB 3.75Å; F569-F584 HydrophobicContact CB-CB 3.69Å; F569-F584 HydrophobicContact CB-CD1 4.36Å; F569-F584 HydrophobicContact CB-CD2 3.78Å; F569-F584 HydrophobicContact CB-CE2 4.5Å; F569-F584 HydrophobicContact CB-CG 3.69Å; F569-F584 HydrophobicContact CG-CB 4.28Å; F569-F584 HydrophobicContact CG-CG 4.44Å
570	M	73.9	Confident	69.8	Low	116 Å²	116	81 Å²	81	57%	0.571	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.9	179.9	-178.6	-173.9	-72.3	0	0	110.6	Q572 F584	M570-Q572 PolarHBondContact O-N 3.35Å; M570-F584 WeakPolarHBondContact O-CE2 3.49Å
571	C	79.9	Confident	70	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	42%	0.418	C	S	.	.			trans	-76.5	112.6	174.7	-174	0	0	0	0	111	W573 C574 G575 K576 F584 M588 H591	C571-W573 PolarHBondContact O-N 3.06Å; C571-C574 PolarHBondContact O-N 3.5Å; C571-G575 WeakPolarHBondContact O-CA 3.45Å; C571-G575 PolarHBondContact O-N 3.2Å; C571-K576 WeakPolarHBondContact CB-O 3.41Å; C571-K576 PolarHBondContact N-O 2.96Å; C571-F584 HydrophobicContact CB-CE2 4.35Å; C571-M588 HydrophobicContact CB-SD 4.42Å; C571-H591 VanDerWaalsContact SG-CD2 3.55Å; C571-H591 PolarHBondContact SG-NE2 3.49Å
572	Q	72.6	Confident	70.4	Confident	188 Å²	188	88.3 Å²	88.3	88%	0.879	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.5	179.2	-61.8	-178.6	8.6	0	0	113.3	M570	M570-Q572 PolarHBondContact O-N 3.35Å
573	W	73.8	Confident	70.7	Confident	159 Å²	159	89.5 Å²	89.5	60%	0.602	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-19.9	-178.8	-66.6	-46.1	0	0	0	114.9	C571 M588 H591 T592	C571-W573 PolarHBondContact O-N 3.06Å; W573-M588 HydrophobicContact CE3-CE 3.65Å; W573-M588 HydrophobicContact CE3-SD 3.82Å; W573-M588 HydrophobicContact CH2-CE 3.9Å; W573-M588 HydrophobicContact CZ3-CE 3.27Å; W573-M588 HydrophobicContact CZ3-SD 3.86Å; W573-H591 HydrophobicContact CD2-CB 4.12Å; W573-H591 HydrophobicContact CE3-CB 3.3Å; W573-H591 AromaticContact CE3-CD2 3.79Å; W573-H591 AromaticContact CE3-CG 3.6Å; W573-H591 HydrophobicContact CZ3-CB 3.61Å; W573-T592 HydrophobicContact CH2-CG2 4.2Å; W573-T592 HydrophobicContact CZ3-CG2 4.3Å
574	C	78.8	Confident	71.3	Confident	64 Å²	64	87 Å²	87	43%	0.432	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.1	5.7	-180	69	0	0	0	0	115.7	C571 K576 H587 H591	C571-C574 PolarHBondContact O-N 3.5Å; C574-K576 PolarHBondContact O-N 2.8Å; C574-K576 VanDerWaalsContact O-N 3.08Å; C574-H587 PolarHBondContact SG-NE2 2.92Å; C574-H591 PolarHBondContact SG-NE2 3.13Å
575	G	74.9	Confident	72	Confident	45 Å²	45	84 Å²	84	46%	0.464	41%	0.414	S	S	.	.			trans	72.8	-9	179.2	0	0	0	0	0	115.9	C571 D577	C571-G575 WeakPolarHBondContact O-CA 3.45Å; C571-G575 PolarHBondContact O-N 3.2Å; G575-D577 PolarHBondContact O-N 3.36Å
576	K	76.1	Confident	72.9	Confident	90 Å²	90	84.9 Å²	84.9	39%	0.391	41%	0.406	S	S	.	.			trans	-59.6	135	177.2	-77	-168.4	172.7	-178	0	111.2	E294 C571 C574 F578	E294-K576 IonicContact OE2-NZ 2.6Å; E294-K576 PolarHBondContact OE2-NZ 3.43Å; C571-K576 WeakPolarHBondContact CB-O 3.41Å; C571-K576 PolarHBondContact N-O 2.96Å; C574-K576 PolarHBondContact O-N 2.8Å; C574-K576 VanDerWaalsContact O-N 3.08Å; K576-F578 HydrophobicContact CB-CE2 3.7Å; K576-F578 HydrophobicContact CB-CZ 3.92Å; K576-F578 HydrophobicContact CD-CZ 4.37Å; K576-F578 WeakPolarHBondContact O-CE2 3.35Å
577	D	74.1	Confident	74.2	Confident	64 Å²	64	80.3 Å²	80.3	34%	0.342	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	150.1	179.3	60.8	-90.2	0	0	0	113.3	K567 F569 G575	K567-D577 HydrophobicContact CB-CB 4.05Å; K567-D577 HydrophobicContact CD-CB 3.84Å; K567-D577 VanDerWaalsContact CD-CG 3.43Å; K567-D577 WeakPolarHBondContact CD-OD2 3.43Å; K567-D577 WeakPolarHBondContact CE-OD2 3.47Å; K567-D577 HydrophobicContact CG-CB 4.01Å; K567-D577 VanDerWaalsContact CG-OD2 3.27Å; K567-D577 WeakPolarHBondContact CG-OD2 3.46Å; K567-D577 IonicContact NZ-OD1 2.64Å; K567-D577 PolarHBondContact NZ-OD1 3.35Å; K567-D577 IonicContact NZ-OD2 3.81Å; K567-D577 PolarHBondContact NZ-OD2 2.98Å; F569-D577 CarbonylContact O-C 3.55Å; F569-D577 WeakPolarHBondContact O-CA 3.33Å; G575-D577 PolarHBondContact O-N 3.36Å
578	F	75.7	Confident	75.4	Confident	36 Å²	36	77 Å²	77	16%	0.158	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.3	-173.1	-60.1	-89.5	0	0	0	111.5	F569 K576 F584 H587	F569-F578 HydrophobicContact CB-CB 4.35Å; F569-F578 PolarHBondContact N-O 3.23Å; F569-F578 PolarHBondContact O-N 3.15Å; K576-F578 HydrophobicContact CB-CE2 3.7Å; K576-F578 HydrophobicContact CB-CZ 3.92Å; K576-F578 HydrophobicContact CD-CZ 4.37Å; K576-F578 WeakPolarHBondContact O-CE2 3.35Å; F578-F584 HydrophobicContact CB-CB 4.06Å; F578-F584 HydrophobicContact CD2-CB 4.31Å; F578-F584 HydrophobicContact CD2-CD2 4.06Å; F578-F584 HydrophobicContact CG-CB 4.26Å; F578-H587 HydrophobicContact CE1-CB 3.94Å; F578-H587 HydrophobicContact CE2-CB 3.96Å; F578-H587 AromaticContact CE2-CD2 3.28Å; F578-H587 WeakPolarHBondContact CE2-CD2 3.34Å; F578-H587 AromaticContact CE2-CG 3.62Å; F578-H587 AromaticContact CE2-NE2 3.97Å; F578-H587 HydrophobicContact CZ-CB 3.51Å; F578-H587 AromaticContact CZ-CD2 3.42Å; F578-H587 VanDerWaalsContact CZ-CD2 3.42Å; F578-H587 WeakPolarHBondContact CZ-CD2 3.33Å; F578-H587 AromaticContact CZ-CG 3.25Å; F578-H587 AromaticContact CZ-ND1 3.8Å
579	N	70	Confident	76.3	Confident	59 Å²	59	75.2 Å²	75.2	32%	0.316	36%	0.362	S	S	.	.	S	Bend	trans	-97.6	-0.1	-177	64.6	-3	0	0	0	114.3	S558 S561	S558-N579 PolarHBondContact OG-O 3.33Å; S561-N579 WeakPolarHBondContact OG-CB 3.49Å
580	M	71.6	Confident	76.9	Confident	59 Å²	59	76.2 Å²	76.2	29%	0.291	37%	0.372	S	S	.	.	S	Bend	trans	-145.7	140.7	172.8	-58.1	-170.8	-165.3	0	0	110	S558 Q582 Y583 F584	S558-M580 WeakPolarHBondContact OG-CE 3.37Å; S558-M580 WeakPolarHBondContact OG-CG 3.35Å; M580-Q582 VanDerWaalsContact C-N 3.3Å; M580-Q582 PolarHBondContact O-N 2.75Å; M580-Y583 HydrophobicContact CB-CD2 3.86Å; M580-Y583 HydrophobicContact CB-CE2 4.41Å; M580-Y583 HydrophobicContact CE-CE2 4.14Å; M580-Y583 HydrophobicContact CG-CD2 4.09Å; M580-Y583 HydrophobicContact CG-CE2 4.22Å; M580-Y583 PolarHBondContact O-N 3.37Å; M580-Y583 HydrophobicContact SD-CD2 4.1Å; M580-Y583 HydrophobicContact SD-CE2 3.68Å; M580-F584 PolarHBondContact O-N 3.37Å
581	K	73.8	Confident	77.1	Confident	76 Å²	76	74 Å²	74	33%	0.33	36%	0.361	S	S	.	.	H	α-helix	trans	-54.1	-43.5	174.8	177.5	166.9	175.2	175.1	0	112.5	E322 F569 Y583 F584 D585	E322-K581 IonicContact OE1-NZ 2.77Å; E322-K581 PolarHBondContact OE1-NZ 3.44Å; E322-K581 IonicContact OE2-NZ 3.81Å; E322-K581 PolarHBondContact OE2-NZ 3.04Å; F569-K581 HydrophobicContact CD1-CB 4.42Å; F569-K581 HydrophobicContact CE1-CB 3.93Å; F569-K581 HydrophobicContact CE1-CG 4.37Å; F569-K581 HydrophobicContact CE2-CB 4.07Å; F569-K581 HydrophobicContact CZ-CB 3.75Å; K581-Y583 VanDerWaalsContact C-N 3.32Å; K581-Y583 PolarHBondContact O-N 3.12Å; K581-F584 CarbonylContact O-C 3.59Å; K581-F584 WeakPolarHBondContact O-CA 3.42Å; K581-F584 WeakPolarHBondContact O-CB 3.29Å; K581-F584 PolarHBondContact O-N 3.19Å; K581-F584 VanDerWaalsContact O-N 3.08Å; K581-D585 VanDerWaalsContact CG-OD2 3.26Å; K581-D585 WeakPolarHBondContact CG-OD2 3.28Å; K581-D585 VanDerWaalsContact O-CG 3.24Å; K581-D585 PolarHBondContact O-N 3.14Å
582	Q	77.6	Confident	77	Confident	133 Å²	133	77.3 Å²	77.3	62%	0.621	38%	0.381	S	S	*	.	H	α-helix	trans	-56.1	-40.7	179.5	-175.3	-177.2	-12.1	0	0	113.7	M580 E586	M580-Q582 VanDerWaalsContact C-N 3.3Å; M580-Q582 PolarHBondContact O-N 2.75Å; Q582-E586 PolarHBondContact O-N 2.78Å
583	Y	78.6	Confident	77.1	Confident	118 Å²	118	70.4 Å²	70.4	46%	0.463	36%	0.36	S	S	.	.	H	α-helix	trans	-74.9	-34.8	178.2	-64.8	-50.8	0	0	0	112	M580 K581 H587	M580-Y583 HydrophobicContact CB-CD2 3.86Å; M580-Y583 HydrophobicContact CB-CE2 4.41Å; M580-Y583 HydrophobicContact CE-CE2 4.14Å; M580-Y583 HydrophobicContact CG-CD2 4.09Å; M580-Y583 HydrophobicContact CG-CE2 4.22Å; M580-Y583 PolarHBondContact O-N 3.37Å; M580-Y583 HydrophobicContact SD-CD2 4.1Å; M580-Y583 HydrophobicContact SD-CE2 3.68Å; K581-Y583 VanDerWaalsContact C-N 3.32Å; K581-Y583 PolarHBondContact O-N 3.12Å; Y583-H587 VanDerWaalsContact O-CB 3.26Å; Y583-H587 WeakPolarHBondContact O-CB 3.4Å; Y583-H587 PolarHBondContact O-N 3.17Å
584	F	81	Confident	77.1	Confident	39 Å²	39	68.3 Å²	68.3	17%	0.171	36%	0.357	C	S	.	.	H	α-helix	trans	-60.7	-45.7	169.6	174.3	-99.5	0	0	0	111.4	F569 M570 C571 F578 M580 K581 E586 H587 M588	F569-F584 HydrophobicContact CB-CB 3.69Å; F569-F584 HydrophobicContact CB-CD1 4.36Å; F569-F584 HydrophobicContact CB-CD2 3.78Å; F569-F584 HydrophobicContact CB-CE2 4.5Å; F569-F584 HydrophobicContact CB-CG 3.69Å; F569-F584 HydrophobicContact CG-CB 4.28Å; F569-F584 HydrophobicContact CG-CG 4.44Å; M570-F584 WeakPolarHBondContact O-CE2 3.49Å; C571-F584 HydrophobicContact CB-CE2 4.35Å; F578-F584 HydrophobicContact CB-CB 4.06Å; F578-F584 HydrophobicContact CD2-CB 4.31Å; F578-F584 HydrophobicContact CD2-CD2 4.06Å; F578-F584 HydrophobicContact CG-CB 4.26Å; M580-F584 PolarHBondContact O-N 3.37Å; K581-F584 CarbonylContact O-C 3.59Å; K581-F584 WeakPolarHBondContact O-CA 3.42Å; K581-F584 WeakPolarHBondContact O-CB 3.29Å; K581-F584 PolarHBondContact O-N 3.19Å; K581-F584 VanDerWaalsContact O-N 3.08Å; F584-E586 PolarHBondContact O-N 3.11Å; F584-H587 CarbonylContact O-C 3.31Å; F584-H587 WeakPolarHBondContact O-CA 3.28Å; F584-H587 WeakPolarHBondContact O-CB 3.47Å; F584-H587 PolarHBondContact O-N 3.34Å; F584-H587 VanDerWaalsContact O-N 3.13Å; F584-M588 HydrophobicContact CD1-CG 4.09Å; F584-M588 HydrophobicContact CD2-CG 4.29Å; F584-M588 HydrophobicContact CE1-CG 3.73Å; F584-M588 HydrophobicContact CE1-SD 4.43Å; F584-M588 HydrophobicContact CE2-CG 3.95Å; F584-M588 HydrophobicContact CE2-SD 3.91Å; F584-M588 HydrophobicContact CG-CG 4.36Å; F584-M588 HydrophobicContact CZ-CE 4.1Å; F584-M588 HydrophobicContact CZ-CG 3.66Å; F584-M588 HydrophobicContact CZ-SD 3.77Å; F584-M588 VanDerWaalsContact O-CG 3.29Å; F584-M588 WeakPolarHBondContact O-CG 3.37Å; F584-M588 PolarHBondContact O-N 2.86Å
585	D	79.8	Confident	77.1	Confident	57 Å²	57	70.2 Å²	70.2	31%	0.305	36%	0.358	S	S	.	.	H	α-helix	trans	-68.8	-35	-179.4	-61.8	-24.1	0	0	0	112.7	K581 K589	K581-D585 VanDerWaalsContact CG-OD2 3.26Å; K581-D585 WeakPolarHBondContact CG-OD2 3.28Å; K581-D585 VanDerWaalsContact O-CG 3.24Å; K581-D585 PolarHBondContact O-N 3.14Å; D585-K589 WeakPolarHBondContact O-CD 3.28Å; D585-K589 WeakPolarHBondContact O-CG 3.31Å; D585-K589 PolarHBondContact O-N 3.18Å
586	E	80.2	Confident	77.3	Confident	66 Å²	66	72.2 Å²	72.2	31%	0.308	36%	0.362	S	S	.	.	H	α-helix	trans	-68.2	-35.6	170.1	-175.6	166.5	173.5	0	0	111.6	Q582 F584 S608	Q582-E586 PolarHBondContact O-N 2.78Å; F584-E586 PolarHBondContact O-N 3.11Å; E586-S608 WeakPolarHBondContact OE1-CB 3.44Å; E586-S608 PolarHBondContact OE1-OG 2.76Å
587	H	83.1	Confident	77.5	Confident	23 Å²	23	71.6 Å²	71.6	11%	0.106	36%	0.358	C	S	.	.	H	α-helix	trans	-70.4	-40.9	175.5	176.5	62.1	0	0	0	113	C574 F578 Y583 F584 K589 T590 H591	C574-H587 PolarHBondContact SG-NE2 2.92Å; F578-H587 HydrophobicContact CE1-CB 3.94Å; F578-H587 HydrophobicContact CE2-CB 3.96Å; F578-H587 AromaticContact CE2-CD2 3.28Å; F578-H587 WeakPolarHBondContact CE2-CD2 3.34Å; F578-H587 AromaticContact CE2-CG 3.62Å; F578-H587 AromaticContact CE2-NE2 3.97Å; F578-H587 HydrophobicContact CZ-CB 3.51Å; F578-H587 AromaticContact CZ-CD2 3.42Å; F578-H587 VanDerWaalsContact CZ-CD2 3.42Å; F578-H587 WeakPolarHBondContact CZ-CD2 3.33Å; F578-H587 AromaticContact CZ-CG 3.25Å; F578-H587 AromaticContact CZ-ND1 3.8Å; Y583-H587 VanDerWaalsContact O-CB 3.26Å; Y583-H587 WeakPolarHBondContact O-CB 3.4Å; Y583-H587 PolarHBondContact O-N 3.17Å; F584-H587 CarbonylContact O-C 3.31Å; F584-H587 WeakPolarHBondContact O-CA 3.28Å; F584-H587 WeakPolarHBondContact O-CB 3.47Å; F584-H587 PolarHBondContact O-N 3.34Å; F584-H587 VanDerWaalsContact O-N 3.13Å; H587-K589 PolarHBondContact O-N 2.97Å; H587-T590 VanDerWaalsContact O-CB 3.31Å; H587-T590 WeakPolarHBondContact O-CB 3.48Å; H587-T590 PolarHBondContact O-N 2.95Å; H587-T590 PolarHBondContact O-OG1 3.4Å; H587-H591 AromaticContact CD2-NE2 3.84Å; H587-H591 AromaticContact CE1-NE2 3.3Å; H587-H591 PolarHBondContact CE1-NE2 2.87Å; H587-H591 VanDerWaalsContact CE1-NE2 3.3Å; H587-H591 AromaticContact NE2-CD2 3.71Å; H587-H591 AromaticContact NE2-NE2 2.96Å; H587-H591 PolarHBondContact NE2-NE2 3.46Å
588	M	79.4	Confident	78	Confident	47 Å²	47	73.3 Å²	73.3	23%	0.232	37%	0.366	C	S	.	.	H	α-helix	trans	-60.1	-32	177.4	-70.7	-65	-82.3	0	0	111.7	C571 W573 F584 T590 H591 T592	C571-M588 HydrophobicContact CB-SD 4.42Å; W573-M588 HydrophobicContact CE3-CE 3.65Å; W573-M588 HydrophobicContact CE3-SD 3.82Å; W573-M588 HydrophobicContact CH2-CE 3.9Å; W573-M588 HydrophobicContact CZ3-CE 3.27Å; W573-M588 HydrophobicContact CZ3-SD 3.86Å; F584-M588 HydrophobicContact CD1-CG 4.09Å; F584-M588 HydrophobicContact CD2-CG 4.29Å; F584-M588 HydrophobicContact CE1-CG 3.73Å; F584-M588 HydrophobicContact CE1-SD 4.43Å; F584-M588 HydrophobicContact CE2-CG 3.95Å; F584-M588 HydrophobicContact CE2-SD 3.91Å; F584-M588 HydrophobicContact CG-CG 4.36Å; F584-M588 HydrophobicContact CZ-CE 4.1Å; F584-M588 HydrophobicContact CZ-CG 3.66Å; F584-M588 HydrophobicContact CZ-SD 3.77Å; F584-M588 VanDerWaalsContact O-CG 3.29Å; F584-M588 WeakPolarHBondContact O-CG 3.37Å; F584-M588 PolarHBondContact O-N 2.86Å; M588-T590 PolarHBondContact O-N 3.21Å; M588-H591 PolarHBondContact O-N 3.13Å; M588-T592 PolarHBondContact O-N 3.08Å; M588-T592 VanDerWaalsContact O-N 3.1Å
589	K	81.4	Confident	78.6	Confident	84 Å²	84	71.7 Å²	71.7	37%	0.365	36%	0.36	S	S	.	.	H	α-helix	trans	-65.9	-16.8	172.4	-68.7	163.9	-169.4	171.1	0	114.2	D585 H587 T592 G593 E594 T607	D585-K589 WeakPolarHBondContact O-CD 3.28Å; D585-K589 WeakPolarHBondContact O-CG 3.31Å; D585-K589 PolarHBondContact O-N 3.18Å; H587-K589 PolarHBondContact O-N 2.97Å; K589-T592 WeakPolarHBondContact CA-OG1 3.17Å; K589-G593 PolarHBondContact O-N 2.94Å; K589-E594 PolarHBondContact O-N 3.43Å; K589-T607 HydrophobicContact CB-CG2 4.33Å
590	T	79.4	Confident	79.3	Confident	77 Å²	77	77.2 Å²	77.2	47%	0.472	38%	0.384	S	S	.	.	H	α-helix	trans	-74.4	-29.1	170.1	71.5	0	0	0	0	112.4	H587 M588 T607	H587-T590 VanDerWaalsContact O-CB 3.31Å; H587-T590 WeakPolarHBondContact O-CB 3.48Å; H587-T590 PolarHBondContact O-N 2.95Å; H587-T590 PolarHBondContact O-OG1 3.4Å; M588-T590 PolarHBondContact O-N 3.21Å; T590-T607 HydrophobicContact CG2-CG2 4.44Å
591	H	78.6	Confident	79.9	Confident	70 Å²	70	79.1 Å²	79.1	32%	0.324	39%	0.394	S	S	.	.	H	α-helix	trans	-86.5	-40.8	179	-63.5	-71.1	0	0	0	112.7	C571 W573 C574 H587 M588 G593	C571-H591 VanDerWaalsContact SG-CD2 3.55Å; C571-H591 PolarHBondContact SG-NE2 3.49Å; W573-H591 HydrophobicContact CD2-CB 4.12Å; W573-H591 HydrophobicContact CE3-CB 3.3Å; W573-H591 AromaticContact CE3-CD2 3.79Å; W573-H591 AromaticContact CE3-CG 3.6Å; W573-H591 HydrophobicContact CZ3-CB 3.61Å; C574-H591 PolarHBondContact SG-NE2 3.13Å; H587-H591 AromaticContact CD2-NE2 3.84Å; H587-H591 AromaticContact CE1-NE2 3.3Å; H587-H591 PolarHBondContact CE1-NE2 2.87Å; H587-H591 VanDerWaalsContact CE1-NE2 3.3Å; H587-H591 AromaticContact NE2-CD2 3.71Å; H587-H591 AromaticContact NE2-NE2 2.96Å; H587-H591 PolarHBondContact NE2-NE2 3.46Å; M588-H591 PolarHBondContact O-N 3.13Å; H591-G593 PolarHBondContact O-N 2.74Å
592	T	75.9	Confident	80.4	Confident	70 Å²	70	77.8 Å²	77.8	43%	0.429	39%	0.394	S	S	.	.	S	Bend	trans	-69.6	-15.2	173.8	62.3	0	0	0	0	112.7	W573 M588 K589 E594	W573-T592 HydrophobicContact CH2-CG2 4.2Å; W573-T592 HydrophobicContact CZ3-CG2 4.3Å; M588-T592 PolarHBondContact O-N 3.08Å; M588-T592 VanDerWaalsContact O-N 3.1Å; K589-T592 WeakPolarHBondContact CA-OG1 3.17Å; T592-E594 PolarHBondContact O-N 3.33Å; T592-E594 WeakPolarHBondContact OG1-CB 3.36Å; T592-E594 WeakPolarHBondContact OG1-CG 3.36Å; T592-E594 PolarHBondContact OG1-N 2.84Å
593	G	75.1	Confident	80.7	Confident	42 Å²	42	74 Å²	74	43%	0.433	39%	0.39	S	S	.	.			trans	72.1	6	-175.9	0	0	0	0	0	113.8	K589 H591 K595	K589-G593 PolarHBondContact O-N 2.94Å; H591-G593 PolarHBondContact O-N 2.74Å; G593-K595 WeakPolarHBondContact O-CG 3.32Å; G593-K595 PolarHBondContact O-N 3.44Å; G593-K595 VanDerWaalsContact O-N 3.12Å
594	E	73.6	Confident	81	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	40%	0.395	S	S	.	.			trans	-66.3	108.7	-177.8	-74.2	177.4	174.2	0	0	111.4	K589 T592 P596	K589-E594 PolarHBondContact O-N 3.43Å; T592-E594 PolarHBondContact O-N 3.33Å; T592-E594 WeakPolarHBondContact OG1-CB 3.36Å; T592-E594 WeakPolarHBondContact OG1-CG 3.36Å; T592-E594 PolarHBondContact OG1-N 2.84Å; E594-P596 VanDerWaalsContact O-CD 3.24Å; E594-P596 WeakPolarHBondContact O-CD 3.4Å
595	K	78.7	Confident	81.1	Confident	105 Å²	105	75.2 Å²	75.2	46%	0.457	40%	0.404	S	S	.	.			trans	-120.5	68.2	-176.7	-70.9	169.1	-178.7	178.5	0	110.7	G593 Y597 S605 F606 T607	G593-K595 WeakPolarHBondContact O-CG 3.32Å; G593-K595 PolarHBondContact O-N 3.44Å; G593-K595 VanDerWaalsContact O-N 3.12Å; K595-Y597 PolarHBondContact O-N 3.15Å; K595-Y597 VanDerWaalsContact O-N 3.14Å; K595-S605 WeakPolarHBondContact CB-OG 3.33Å; K595-S605 WeakPolarHBondContact CD-OG 3.5Å; K595-F606 CarbonylContact C-O 3.19Å; K595-F606 VanDerWaalsContact C-O 3.25Å; K595-F606 VanDerWaalsContact CA-O 3.28Å; K595-F606 WeakPolarHBondContact CA-O 3.47Å; K595-T607 HydrophobicContact CG-CG2 3.97Å
596	P	79.3	Confident	81.3	Confident	86 Å²	86	74.7 Å²	74.7	56%	0.558	40%	0.399	S	S	*	.			trans	-66.5	-15.1	-172.2	27.1	-35.4	0	0	0	114	E594 I598	E594-P596 VanDerWaalsContact O-CD 3.24Å; E594-P596 WeakPolarHBondContact O-CD 3.4Å; P596-I598 PolarHBondContact O-N 3.49Å
597	Y	81.3	Confident	81.4	Confident	78 Å²	78	72.9 Å²	72.9	31%	0.306	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	88.8	-179	-54	-70.2	0	0	0	111.2	K595 F606 T607 S608 R609	K595-Y597 PolarHBondContact O-N 3.15Å; K595-Y597 VanDerWaalsContact O-N 3.14Å; Y597-F606 PolarHBondContact N-O 2.81Å; Y597-F606 VanDerWaalsContact N-O 3.15Å; Y597-F606 WeakPolarHBondContact O-CD2 3.41Å; Y597-F606 PolarHBondContact O-N 3.05Å; Y597-T607 WeakPolarHBondContact CD2-O 3.43Å; Y597-T607 WeakPolarHBondContact CE2-O 3.32Å; Y597-S608 VanDerWaalsContact CD2-CA 3.43Å; Y597-R609 HydrophobicContact CD1-CB 3.92Å; Y597-R609 HydrophobicContact CD1-CG 4.12Å; Y597-R609 HydrophobicContact CD2-CB 4.31Å; Y597-R609 HydrophobicContact CE1-CB 3.77Å; Y597-R609 HydrophobicContact CE1-CG 4.09Å; Y597-R609 HydrophobicContact CE2-CB 4.14Å; Y597-R609 HydrophobicContact CG-CB 4.19Å
598	I	84.6	Confident	81.3	Confident	100 Å²	100	72.1 Å²	72.1	51%	0.513	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	138.3	176.4	-57.5	172.8	0	0	0	110.2	P596	P596-I598 PolarHBondContact O-N 3.49Å
599	C	88.3	Confident	81.5	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.014	41%	0.408	C	S	.	.			trans	-87.6	104.5	169.7	-177.9	0	0	0	0	110.4	I601 C602 G603 K604 F606	C599-I601 PolarHBondContact O-N 3.21Å; C599-C602 PolarHBondContact O-N 2.98Å; C599-C602 VanDerWaalsContact SG-SG 3.68Å; C599-G603 PolarHBondContact O-N 2.74Å; C599-K604 WeakPolarHBondContact CB-O 3.3Å; C599-K604 PolarHBondContact N-O 2.91Å; C599-F606 HydrophobicContact CB-CE2 4.09Å
600	E	84.7	Confident	81.5	Confident	175 Å²	175	78 Å²	78	82%	0.818	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	-35.4	179.9	-66.2	148.1	-151.6	0	0	114.4
601	I	84.1	Confident	81.8	Confident	98 Å²	98	76.5 Å²	76.5	50%	0.503	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-22.2	-174.7	-53.5	171.1	0	0	0	113.3	C599 R616 H619	C599-I601 PolarHBondContact O-N 3.21Å; I601-R616 HydrophobicContact CD1-CG 4.03Å; I601-H619 HydrophobicContact CB-CB 4.36Å; I601-H619 HydrophobicContact CD1-CB 3.69Å; I601-H619 HydrophobicContact CG2-CB 3.8Å
602	C	84.9	Confident	82.3	Confident	49 Å²	49	74 Å²	74	33%	0.331	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.1	6.3	-171.7	68.1	0	0	0	0	115.3	C599 K604 H615 H619	C599-C602 PolarHBondContact O-N 2.98Å; C599-C602 VanDerWaalsContact SG-SG 3.68Å; C602-K604 PolarHBondContact O-N 3.5Å; C602-H615 PolarHBondContact SG-NE2 3.33Å; C602-H619 PolarHBondContact SG-NE2 3.29Å
603	G	82	Confident	82.7	Confident	52 Å²	52	76.5 Å²	76.5	54%	0.536	40%	0.402	S	S	.	.			trans	67.9	-8.5	-178.7	0	0	0	0	0	115.9	C599 S605	C599-G603 PolarHBondContact O-N 2.74Å; G603-S605 PolarHBondContact O-N 3.37Å
604	K	85.2	Confident	83.1	Confident	132 Å²	132	80.7 Å²	80.7	57%	0.574	41%	0.405	S	S	*	.			trans	-65.4	127.6	-177.5	-65.3	-170.1	177.6	-166.6	0	110.8	C599 C602 F606	C599-K604 WeakPolarHBondContact CB-O 3.3Å; C599-K604 PolarHBondContact N-O 2.91Å; C602-K604 PolarHBondContact O-N 3.5Å; K604-F606 HydrophobicContact CB-CE2 3.91Å; K604-F606 HydrophobicContact CB-CZ 4.04Å; K604-F606 WeakPolarHBondContact O-CD2 3.26Å; K604-F606 VanDerWaalsContact O-CE2 3.23Å; K604-F606 WeakPolarHBondContact O-CE2 3.32Å
605	S	84.4	Confident	83.7	Confident	52 Å²	52	76.8 Å²	76.8	36%	0.364	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	144.5	-177.2	62.4	0	0	0	0	112	K595 G603	K595-S605 WeakPolarHBondContact CB-OG 3.33Å; K595-S605 WeakPolarHBondContact CD-OG 3.5Å; G603-S605 PolarHBondContact O-N 3.37Å
606	F	83.1	Confident	84.1	Confident	45 Å²	45	76 Å²	76	20%	0.197	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.4	-175.5	-60.4	-87.9	0	0	0	111.3	K595 Y597 C599 K604 N611 M612 H615	K595-F606 CarbonylContact C-O 3.19Å; K595-F606 VanDerWaalsContact C-O 3.25Å; K595-F606 VanDerWaalsContact CA-O 3.28Å; K595-F606 WeakPolarHBondContact CA-O 3.47Å; Y597-F606 PolarHBondContact N-O 2.81Å; Y597-F606 VanDerWaalsContact N-O 3.15Å; Y597-F606 WeakPolarHBondContact O-CD2 3.41Å; Y597-F606 PolarHBondContact O-N 3.05Å; C599-F606 HydrophobicContact CB-CE2 4.09Å; K604-F606 HydrophobicContact CB-CE2 3.91Å; K604-F606 HydrophobicContact CB-CZ 4.04Å; K604-F606 WeakPolarHBondContact O-CD2 3.26Å; K604-F606 VanDerWaalsContact O-CE2 3.23Å; K604-F606 WeakPolarHBondContact O-CE2 3.32Å; F606-N611 HydrophobicContact CD1-CB 4.41Å; F606-M612 HydrophobicContact CB-CB 4.13Å; F606-M612 HydrophobicContact CD2-CB 3.9Å; F606-M612 HydrophobicContact CD2-CG 4.15Å; F606-M612 HydrophobicContact CG-CB 4.18Å; F606-H615 HydrophobicContact CE1-CB 3.9Å; F606-H615 HydrophobicContact CE2-CB 3.84Å; F606-H615 AromaticContact CE2-CD2 3.56Å; F606-H615 AromaticContact CE2-CG 3.69Å; F606-H615 HydrophobicContact CZ-CB 3.44Å; F606-H615 VanDerWaalsContact CZ-CB 3.44Å; F606-H615 AromaticContact CZ-CD2 3.5Å; F606-H615 AromaticContact CZ-CG 3.21Å; F606-H615 AromaticContact CZ-ND1 3.7Å
607	T	81.8	Confident	84.4	Confident	28 Å²	28	74.2 Å²	74.2	17%	0.172	36%	0.362	C	S	.	.	S	Bend	trans	-68.1	-31.9	177	47.7	0	0	0	0	112.6	K589 T590 K595 Y597	K589-T607 HydrophobicContact CB-CG2 4.33Å; T590-T607 HydrophobicContact CG2-CG2 4.44Å; K595-T607 HydrophobicContact CG-CG2 3.97Å; Y597-T607 WeakPolarHBondContact CD2-O 3.43Å; Y597-T607 WeakPolarHBondContact CE2-O 3.32Å
608	S	81.4	Confident	84.5	Confident	8 Å²	8	73.2 Å²	73.2	6%	0.056	37%	0.365	C	S	.	.	S	Bend	trans	-134.5	146.4	-178.2	61.8	0	0	0	0	115.8	E586 Y597 N611 M612	E586-S608 WeakPolarHBondContact OE1-CB 3.44Å; E586-S608 PolarHBondContact OE1-OG 2.76Å; Y597-S608 VanDerWaalsContact CD2-CA 3.43Å; S608-N611 WeakPolarHBondContact O-CB 3.41Å; S608-N611 PolarHBondContact O-N 3.11Å; S608-N611 VanDerWaalsContact O-N 3.16Å; S608-N611 PolarHBondContact OG-ND2 2.87Å; S608-M612 PolarHBondContact O-N 2.98Å; S608-M612 VanDerWaalsContact O-N 3.08Å
609	R	83.3	Confident	84.4	Confident	163 Å²	163	72.1 Å²	72.1	62%	0.615	36%	0.357	S	S	*	.	H	α-helix	trans	-60.2	-38.9	-175.6	-164.8	177.5	178.9	89	-6	114.1	Y597 N611 M612 K613	Y597-R609 HydrophobicContact CD1-CB 3.92Å; Y597-R609 HydrophobicContact CD1-CG 4.12Å; Y597-R609 HydrophobicContact CD2-CB 4.31Å; Y597-R609 HydrophobicContact CE1-CB 3.77Å; Y597-R609 HydrophobicContact CE1-CG 4.09Å; Y597-R609 HydrophobicContact CE2-CB 4.14Å; Y597-R609 HydrophobicContact CG-CB 4.19Å; R609-N611 VanDerWaalsContact C-N 3.32Å; R609-N611 PolarHBondContact O-N 3.29Å; R609-M612 HydrophobicContact CG-CE 4.43Å; R609-M612 PolarHBondContact O-N 2.91Å; R609-K613 PolarHBondContact O-N 3.26Å
610	P	83.1	Confident	84.1	Confident	92 Å²	92	75.5 Å²	75.5	60%	0.597	38%	0.378	S	S	*	.	H	α-helix	trans	-63.8	-38.4	174.6	-21.5	34.6	0	0	0	111.9	K613 R614	P610-K613 PolarHBondContact O-N 3.17Å; P610-R614 VanDerWaalsContact O-CB 3.24Å; P610-R614 WeakPolarHBondContact O-CB 3.48Å; P610-R614 PolarHBondContact O-N 3.18Å
611	N	84.2	Confident	83.9	Confident	45 Å²	45	69.4 Å²	69.4	24%	0.241	36%	0.362	C	S	.	.	H	α-helix	trans	-66.2	-41.9	176.9	-79.9	-44.1	0	0	0	112.1	F606 S608 R609 R614 H615	F606-N611 HydrophobicContact CD1-CB 4.41Å; S608-N611 WeakPolarHBondContact O-CB 3.41Å; S608-N611 PolarHBondContact O-N 3.11Å; S608-N611 VanDerWaalsContact O-N 3.16Å; S608-N611 PolarHBondContact OG-ND2 2.87Å; R609-N611 VanDerWaalsContact C-N 3.32Å; R609-N611 PolarHBondContact O-N 3.29Å; N611-R614 PolarHBondContact O-N 3.17Å; N611-R614 PolarHBondContact OD1-NE 3.34Å; N611-R614 PolarHBondContact OD1-NH2 2.94Å; N611-H615 WeakPolarHBondContact O-CB 3.43Å; N611-H615 PolarHBondContact O-N 2.94Å
612	M	88.6	Confident	83.9	Confident	18 Å²	18	68.8 Å²	68.8	9%	0.089	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-44.3	171.1	-179.9	-83.9	-71.7	0	0	112.3	F606 S608 R609 R614 H615 R616	F606-M612 HydrophobicContact CB-CB 4.13Å; F606-M612 HydrophobicContact CD2-CB 3.9Å; F606-M612 HydrophobicContact CD2-CG 4.15Å; F606-M612 HydrophobicContact CG-CB 4.18Å; S608-M612 PolarHBondContact O-N 2.98Å; S608-M612 VanDerWaalsContact O-N 3.08Å; R609-M612 HydrophobicContact CG-CE 4.43Å; R609-M612 PolarHBondContact O-N 2.91Å; M612-R614 PolarHBondContact O-N 3.07Å; M612-H615 PolarHBondContact O-N 3.48Å; M612-R616 PolarHBondContact O-N 2.64Å
613	K	84.6	Confident	83.8	Confident	122 Å²	122	72 Å²	72	53%	0.53	37%	0.365	S	S	.	.	H	α-helix	trans	-63.2	-42.1	176.7	-170.6	-179.7	179.8	-177	0	111.7	R609 P610 R616	R609-K613 PolarHBondContact O-N 3.26Å; P610-K613 PolarHBondContact O-N 3.17Å; K613-R616 PolarHBondContact O-N 3.38Å
614	R	84.6	Confident	83.9	Confident	130 Å²	130	71.9 Å²	71.9	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-41.7	174.4	-178.7	166	66.6	150.2	-4.5	111.3	P610 N611 M612 R635 F636	P610-R614 VanDerWaalsContact O-CB 3.24Å; P610-R614 WeakPolarHBondContact O-CB 3.48Å; P610-R614 PolarHBondContact O-N 3.18Å; N611-R614 PolarHBondContact O-N 3.17Å; N611-R614 PolarHBondContact OD1-NE 3.34Å; N611-R614 PolarHBondContact OD1-NH2 2.94Å; M612-R614 PolarHBondContact O-N 3.07Å; R614-R635 PolarHBondContact O-NH2 2.97Å; R614-F636 HydrophobicContact CG-CD1 3.81Å; R614-F636 HydrophobicContact CG-CE1 3.48Å; R614-F636 VanDerWaalsContact CG-CE1 3.48Å; R614-F636 HydrophobicContact CG-CZ 4.38Å
615	H	86.4	Confident	83.9	Confident	32 Å²	32	69.2 Å²	69.2	15%	0.148	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-54.7	173.3	178	69.1	0	0	0	111.1	C602 F606 N611 M612 R617 T618 H619 R635	C602-H615 PolarHBondContact SG-NE2 3.33Å; F606-H615 HydrophobicContact CE1-CB 3.9Å; F606-H615 HydrophobicContact CE2-CB 3.84Å; F606-H615 AromaticContact CE2-CD2 3.56Å; F606-H615 AromaticContact CE2-CG 3.69Å; F606-H615 HydrophobicContact CZ-CB 3.44Å; F606-H615 VanDerWaalsContact CZ-CB 3.44Å; F606-H615 AromaticContact CZ-CD2 3.5Å; F606-H615 AromaticContact CZ-CG 3.21Å; F606-H615 AromaticContact CZ-ND1 3.7Å; N611-H615 WeakPolarHBondContact O-CB 3.43Å; N611-H615 PolarHBondContact O-N 2.94Å; M612-H615 PolarHBondContact O-N 3.48Å; H615-R617 PolarHBondContact O-N 2.9Å; H615-T618 WeakPolarHBondContact O-CB 3.44Å; H615-T618 WeakPolarHBondContact O-CG2 3.41Å; H615-T618 PolarHBondContact O-N 3.26Å; H615-T618 PolarHBondContact O-OG1 3.17Å; H615-H619 AromaticContact CD2-NE2 3.79Å; H615-H619 AromaticContact CE1-NE2 3.9Å; H615-H619 AromaticContact NE2-CE1 3.76Å; H615-H619 AromaticContact NE2-NE2 3.1Å; H615-H619 PolarHBondContact NE2-NE2 3.28Å; H615-R635 PolarHBondContact O-NH2 3.36Å; H615-R635 VanDerWaalsContact O-NH2 3.09Å
616	R	85.6	Confident	84	Confident	89 Å²	89	69.3 Å²	69.3	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-50.4	-31.6	-173.4	-169.3	174.3	70.2	-143.8	9.8	114.4	I601 M612 K613 T618 H619	I601-R616 HydrophobicContact CD1-CG 4.03Å; M612-R616 PolarHBondContact O-N 2.64Å; K613-R616 PolarHBondContact O-N 3.38Å; R616-T618 PolarHBondContact O-N 3.42Å; R616-H619 PolarHBondContact O-N 2.97Å
617	R	85.8	Confident	84.2	Confident	48 Å²	48	67.2 Å²	67.2	18%	0.181	33%	0.333	C	S	.	.	H	α-helix	trans	-53.8	-16.3	170	-66.4	-177	173	161.5	-0.6	114.4	H615 H619 T620 G621 E622 R635	H615-R617 PolarHBondContact O-N 2.9Å; R617-H619 VanDerWaalsContact C-N 3.27Å; R617-T620 WeakPolarHBondContact CA-OG1 3.38Å; R617-G621 PolarHBondContact O-N 3.36Å; R617-E622 HydrophobicContact CB-CB 4.22Å; R617-E622 HydrophobicContact CG-CB 4Å; R617-E622 IonicContact NE-OE2 2.86Å; R617-R635 HydrophobicContact CB-CG 4.09Å; R617-R635 WeakPolarHBondContact O-CD 3.45Å; R617-R635 PolarHBondContact O-NE 3.47Å; R617-R635 VanDerWaalsContact O-NE 3.07Å
618	T	83.4	Confident	84.3	Confident	58 Å²	58	73.2 Å²	73.2	36%	0.356	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-42.3	173.2	42.6	0	0	0	0	110.3	H615 R616 R635	H615-T618 WeakPolarHBondContact O-CB 3.44Å; H615-T618 WeakPolarHBondContact O-CG2 3.41Å; H615-T618 PolarHBondContact O-N 3.26Å; H615-T618 PolarHBondContact O-OG1 3.17Å; R616-T618 PolarHBondContact O-N 3.42Å; T618-R635 VanDerWaalsContact CA-CZ 3.47Å; T618-R635 VanDerWaalsContact N-NH2 3.15Å
619	H	84.1	Confident	84.3	Confident	77 Å²	77	76 Å²	76	36%	0.356	38%	0.375	S	S	.	.	H	α-helix	trans	-89.8	-34.1	-166.7	-49.9	-53.1	0	0	0	111.2	I601 C602 H615 R616 R617 G621	I601-H619 HydrophobicContact CB-CB 4.36Å; I601-H619 HydrophobicContact CD1-CB 3.69Å; I601-H619 HydrophobicContact CG2-CB 3.8Å; C602-H619 PolarHBondContact SG-NE2 3.29Å; H615-H619 AromaticContact CD2-NE2 3.79Å; H615-H619 AromaticContact CE1-NE2 3.9Å; H615-H619 AromaticContact NE2-CE1 3.76Å; H615-H619 AromaticContact NE2-NE2 3.1Å; H615-H619 PolarHBondContact NE2-NE2 3.28Å; R616-H619 PolarHBondContact O-N 2.97Å; R617-H619 VanDerWaalsContact C-N 3.27Å; H619-G621 VanDerWaalsContact C-N 3.32Å
620	T	81.4	Confident	84.4	Confident	73 Å²	73	70.5 Å²	70.5	45%	0.448	36%	0.361	S	S	.	.	H	α-helix	trans	-80.9	-11.1	173.9	58.1	0	0	0	0	113.3	R617 E622	R617-T620 WeakPolarHBondContact CA-OG1 3.38Å; T620-E622 VanDerWaalsContact CB-OE1 3.31Å; T620-E622 WeakPolarHBondContact CB-OE1 3.31Å; T620-E622 PolarHBondContact O-N 3.16Å; T620-E622 VanDerWaalsContact O-N 3.14Å; T620-E622 VanDerWaalsContact OG1-CD 3.27Å; T620-E622 WeakPolarHBondContact OG1-CG 3.04Å; T620-E622 PolarHBondContact OG1-OE1 3.16Å
621	G	80.8	Confident	84.3	Confident	47 Å²	47	68.7 Å²	68.7	49%	0.485	36%	0.359	S	S	.	.			trans	67.6	6.8	-178	0	0	0	0	0	114.9	R617 H619 K623	R617-G621 PolarHBondContact O-N 3.36Å; H619-G621 VanDerWaalsContact C-N 3.32Å; G621-K623 PolarHBondContact O-N 2.93Å
622	E	82.5	Confident	84.3	Confident	84 Å²	84	71.8 Å²	71.8	39%	0.393	37%	0.372	S	S	.	.			trans	-51.8	117.6	-176.9	-81	164.9	-118.3	0	0	112.3	R617 T620 P624 R635	R617-E622 HydrophobicContact CB-CB 4.22Å; R617-E622 HydrophobicContact CG-CB 4Å; R617-E622 IonicContact NE-OE2 2.86Å; T620-E622 VanDerWaalsContact CB-OE1 3.31Å; T620-E622 WeakPolarHBondContact CB-OE1 3.31Å; T620-E622 PolarHBondContact O-N 3.16Å; T620-E622 VanDerWaalsContact O-N 3.14Å; T620-E622 VanDerWaalsContact OG1-CD 3.27Å; T620-E622 WeakPolarHBondContact OG1-CG 3.04Å; T620-E622 PolarHBondContact OG1-OE1 3.16Å; E622-P624 VanDerWaalsContact C-CD 3.42Å; E622-P624 VanDerWaalsContact O-CD 3.28Å; E622-P624 WeakPolarHBondContact O-CD 3.42Å; E622-R635 VanDerWaalsContact O-CG 3.25Å; E622-R635 WeakPolarHBondContact O-CG 3.32Å
623	K	83.9	Confident	84.2	Confident	116 Å²	116	77.1 Å²	77.1	50%	0.504	39%	0.391	S	S	.	.			trans	-117.5	74.7	174.7	-72.9	164.7	161.7	-161.5	0	110.6	G621 Y625 R633 F634 R635	G621-K623 PolarHBondContact O-N 2.93Å; K623-Y625 VanDerWaalsContact C-N 3.3Å; K623-Y625 PolarHBondContact O-N 2.95Å; K623-R633 HydrophobicContact CB-CB 3.67Å; K623-R633 HydrophobicContact CD-CB 4.38Å; K623-R633 VanDerWaalsContact CD-O 3.23Å; K623-R633 WeakPolarHBondContact CD-O 3.31Å; K623-R633 WeakPolarHBondContact CG-O 3.43Å; K623-R633 PolarHBondContact O-NE 3.25Å; K623-R633 PolarHBondContact O-NH2 2.94Å; K623-R633 VanDerWaalsContact O-NH2 3.16Å; K623-F634 CarbonylContact C-O 3.57Å; K623-F634 VanDerWaalsContact CA-O 3.22Å; K623-F634 WeakPolarHBondContact CA-O 3.19Å; K623-R635 HydrophobicContact CG-CB 4.24Å
624	P	84.9	Confident	84.2	Confident	51 Å²	51	72.8 Å²	72.8	33%	0.331	37%	0.372	S	S	.	.			trans	-73.4	-15.5	-174	27.9	-33.7	0	0	0	114.2	E622 P626	E622-P624 VanDerWaalsContact C-CD 3.42Å; E622-P624 VanDerWaalsContact O-CD 3.28Å; E622-P624 WeakPolarHBondContact O-CD 3.42Å; P624-P626 WeakPolarHBondContact O-CD 3.36Å
625	Y	84.1	Confident	84.2	Confident	76 Å²	76	69 Å²	69	30%	0.298	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	91.6	-173.1	-56.3	-79.5	0	0	0	112.2	K623 F634 R635	K623-Y625 VanDerWaalsContact C-N 3.3Å; K623-Y625 PolarHBondContact O-N 2.95Å; Y625-F634 PolarHBondContact N-O 3.39Å; Y625-F634 PolarHBondContact O-N 2.86Å; Y625-R635 WeakPolarHBondContact CE2-O 3.27Å
626	P	86.4	Confident	84.1	Confident	54 Å²	54	70.1 Å²	70.1	35%	0.351	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	146.7	173.7	31.9	-36.3	0	0	0	112.2	P624 R633 L640 R644	P624-P626 WeakPolarHBondContact O-CD 3.36Å; P626-R633 HydrophobicContact CB-CG 4.4Å; P626-L640 WeakPolarHBondContact O-CD2 3.35Å; P626-R644 PolarHBondContact O-NH2 3.28Å
627	C	88.1	Confident	84.1	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.007	36%	0.357	C	S	.	.			trans	-85.7	116.6	160.4	-173.3	0	0	0	0	109.4	V629 C630 G631 Q632 F634 L640 H643	C627-V629 PolarHBondContact O-N 3.24Å; C627-C630 PolarHBondContact O-N 2.86Å; C627-G631 WeakPolarHBondContact O-CA 3.43Å; C627-G631 PolarHBondContact O-N 2.89Å; C627-Q632 HydrophobicContact CB-CB 4.49Å; C627-Q632 PolarHBondContact N-O 3.12Å; C627-F634 HydrophobicContact CB-CE2 4.07Å; C627-L640 HydrophobicContact CB-CD1 3.69Å; C627-H643 VanDerWaalsContact SG-CD2 3.57Å
628	E	84.1	Confident	84.1	Confident	154 Å²	154	70 Å²	70	72%	0.72	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-26.7	178.6	-66.3	153.5	-119.4	0	0	112.6	R644	E628-R644 IonicContact OE1-CZ 3.26Å; E628-R644 VanDerWaalsContact OE1-CZ 3.26Å; E628-R644 IonicContact OE1-NH1 3.01Å; E628-R644 PolarHBondContact OE1-NH1 3.28Å; E628-R644 IonicContact OE1-NH2 2.64Å; E628-R644 PolarHBondContact OE1-NH2 3.06Å
629	V	80.6	Confident	84.2	Confident	65 Å²	65	72.5 Å²	72.5	39%	0.394	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-25.9	-175.5	-173.5	0	0	0	0	113.2	C627	C627-V629 PolarHBondContact O-N 3.24Å
630	C	85.2	Confident	84.4	Confident	48 Å²	48	69.5 Å²	69.5	32%	0.324	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.3	2.3	-172.4	72.3	0	0	0	0	115.6	C627 Q632 H643	C627-C630 PolarHBondContact O-N 2.86Å; C630-Q632 PolarHBondContact O-N 3.35Å; C630-Q632 VanDerWaalsContact O-N 3.08Å; C630-Q632 VanDerWaalsContact SG-CB 3.56Å; C630-Q632 VanDerWaalsContact SG-CG 3.6Å; C630-H643 PolarHBondContact SG-NE2 3.09Å
631	G	81.4	Confident	84.6	Confident	54 Å²	54	72.1 Å²	72.1	56%	0.557	38%	0.375	S	S	*	.			trans	72.5	-9.4	-179.6	0	0	0	0	0	116.1	C627 R633	C627-G631 WeakPolarHBondContact O-CA 3.43Å; C627-G631 PolarHBondContact O-N 2.89Å; G631-R633 PolarHBondContact O-N 3.29Å
632	Q	84.2	Confident	84.7	Confident	110 Å²	110	72 Å²	72	51%	0.514	37%	0.37	S	S	.	.			trans	-55.3	125.3	177	-77.1	-77.8	-8.8	0	0	110.7	C627 C630 F634	C627-Q632 HydrophobicContact CB-CB 4.49Å; C627-Q632 PolarHBondContact N-O 3.12Å; C630-Q632 PolarHBondContact O-N 3.35Å; C630-Q632 VanDerWaalsContact O-N 3.08Å; C630-Q632 VanDerWaalsContact SG-CB 3.56Å; C630-Q632 VanDerWaalsContact SG-CG 3.6Å; Q632-F634 HydrophobicContact CB-CD2 4.45Å; Q632-F634 HydrophobicContact CB-CE2 3.47Å; Q632-F634 VanDerWaalsContact CB-CE2 3.47Å; Q632-F634 HydrophobicContact CB-CZ 3.68Å; Q632-F634 HydrophobicContact CG-CZ 4.48Å; Q632-F634 WeakPolarHBondContact O-CD2 3.49Å; Q632-F634 WeakPolarHBondContact O-CE2 3.45Å
633	R	86.3	Confident	84.9	Confident	130 Å²	130	70.2 Å²	70.2	49%	0.491	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.3	180	-57.4	-167.8	67.7	116.8	5.1	111.2	K623 P626 G631	K623-R633 HydrophobicContact CB-CB 3.67Å; K623-R633 HydrophobicContact CD-CB 4.38Å; K623-R633 VanDerWaalsContact CD-O 3.23Å; K623-R633 WeakPolarHBondContact CD-O 3.31Å; K623-R633 WeakPolarHBondContact CG-O 3.43Å; K623-R633 PolarHBondContact O-NE 3.25Å; K623-R633 PolarHBondContact O-NH2 2.94Å; K623-R633 VanDerWaalsContact O-NH2 3.16Å; P626-R633 HydrophobicContact CB-CG 4.4Å; G631-R633 PolarHBondContact O-N 3.29Å
634	F	84.6	Confident	84.8	Confident	31 Å²	31	69.9 Å²	69.9	14%	0.136	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	160	179.5	-61.1	-84.2	0	0	0	111.5	K623 Y625 C627 Q632 M639 L640 H643	K623-F634 CarbonylContact C-O 3.57Å; K623-F634 VanDerWaalsContact CA-O 3.22Å; K623-F634 WeakPolarHBondContact CA-O 3.19Å; Y625-F634 PolarHBondContact N-O 3.39Å; Y625-F634 PolarHBondContact O-N 2.86Å; C627-F634 HydrophobicContact CB-CE2 4.07Å; Q632-F634 HydrophobicContact CB-CD2 4.45Å; Q632-F634 HydrophobicContact CB-CE2 3.47Å; Q632-F634 VanDerWaalsContact CB-CE2 3.47Å; Q632-F634 HydrophobicContact CB-CZ 3.68Å; Q632-F634 HydrophobicContact CG-CZ 4.48Å; Q632-F634 WeakPolarHBondContact O-CD2 3.49Å; Q632-F634 WeakPolarHBondContact O-CE2 3.45Å; F634-M639 HydrophobicContact CB-CB 4.41Å; F634-M639 HydrophobicContact CD1-CB 4.28Å; F634-M639 HydrophobicContact CD1-CG 3.65Å; F634-M639 HydrophobicContact CE1-CG 4.39Å; F634-M639 HydrophobicContact CG-CG 4.47Å; F634-L640 HydrophobicContact CB-CB 4.09Å; F634-L640 HydrophobicContact CD2-CB 4.17Å; F634-L640 HydrophobicContact CD2-CD1 3.76Å; F634-L640 HydrophobicContact CE2-CD1 4.23Å; F634-L640 HydrophobicContact CG-CB 4.29Å; F634-H643 HydrophobicContact CE1-CB 3.99Å; F634-H643 HydrophobicContact CE2-CB 3.94Å; F634-H643 AromaticContact CE2-CD2 3.27Å; F634-H643 WeakPolarHBondContact CE2-CD2 3.28Å; F634-H643 AromaticContact CE2-CG 3.54Å; F634-H643 AromaticContact CE2-NE2 3.85Å; F634-H643 HydrophobicContact CZ-CB 3.58Å; F634-H643 AromaticContact CZ-CD2 3.42Å; F634-H643 VanDerWaalsContact CZ-CD2 3.42Å; F634-H643 WeakPolarHBondContact CZ-CD2 3.33Å; F634-H643 AromaticContact CZ-CE1 3.94Å; F634-H643 AromaticContact CZ-CG 3.2Å; F634-H643 AromaticContact CZ-ND1 3.56Å; F634-H643 AromaticContact CZ-NE2 3.87Å
635	R	83.7	Confident	84.6	Confident	52 Å²	52	73.1 Å²	73.1	20%	0.196	37%	0.368	C	S	.	.	S	Bend	trans	-101.1	-16	-173.2	176	165.9	153.3	-111.3	-13.2	114	R614 H615 R617 T618 E622 K623 Y625	R614-R635 PolarHBondContact O-NH2 2.97Å; H615-R635 PolarHBondContact O-NH2 3.36Å; H615-R635 VanDerWaalsContact O-NH2 3.09Å; R617-R635 HydrophobicContact CB-CG 4.09Å; R617-R635 WeakPolarHBondContact O-CD 3.45Å; R617-R635 PolarHBondContact O-NE 3.47Å; R617-R635 VanDerWaalsContact O-NE 3.07Å; T618-R635 VanDerWaalsContact CA-CZ 3.47Å; T618-R635 VanDerWaalsContact N-NH2 3.15Å; E622-R635 VanDerWaalsContact O-CG 3.25Å; E622-R635 WeakPolarHBondContact O-CG 3.32Å; K623-R635 HydrophobicContact CG-CB 4.24Å; Y625-R635 WeakPolarHBondContact CE2-O 3.27Å
636	F	85.2	Confident	84.3	Confident	54 Å²	54	77.1 Å²	77.1	24%	0.237	39%	0.387	C	S	.	.	S	Bend	trans	-137.5	148	178.8	-46.7	-54.3	0	0	0	110.4	R614 N638 M639 L640	R614-F636 HydrophobicContact CG-CD1 3.81Å; R614-F636 HydrophobicContact CG-CE1 3.48Å; R614-F636 VanDerWaalsContact CG-CE1 3.48Å; R614-F636 HydrophobicContact CG-CZ 4.38Å; F636-N638 WeakPolarHBondContact CB-OD1 3.38Å; F636-M639 HydrophobicContact CB-CB 4.3Å; F636-M639 WeakPolarHBondContact O-CB 3.42Å; F636-M639 PolarHBondContact O-N 3.22Å; F636-L640 PolarHBondContact O-N 3.49Å
637	S	85.6	Confident	83.9	Confident	31 Å²	31	75.4 Å²	75.4	22%	0.217	38%	0.376	C	S	.	.	H	α-helix	trans	-58.9	-47.3	179.4	-177.7	0	0	0	0	112	E300 M639 L640 K641	E300-S637 WeakPolarHBondContact OE2-CB 3.45Å; E300-S637 PolarHBondContact OE2-OG 3.45Å; S637-M639 VanDerWaalsContact C-N 3.3Å; S637-M639 PolarHBondContact O-N 2.83Å; S637-L640 CarbonylContact O-C 3.58Å; S637-L640 WeakPolarHBondContact O-CA 3.48Å; S637-L640 WeakPolarHBondContact O-CB 3.48Å; S637-L640 PolarHBondContact O-N 3.17Å; S637-K641 PolarHBondContact O-N 3.49Å
638	N	86.3	Confident	82.9	Confident	103 Å²	103	83.4 Å²	83.4	55%	0.551	41%	0.411	S	S	*	.	H	α-helix	trans	-58.6	-36.8	177.3	67.9	-32.4	0	0	0	113.6	F636 K641 A642	F636-N638 WeakPolarHBondContact CB-OD1 3.38Å; N638-K641 PolarHBondContact O-N 3.37Å; N638-A642 WeakPolarHBondContact O-CB 3.47Å; N638-A642 PolarHBondContact O-N 3.28Å
639	M	84.4	Confident	81.7	Confident	112 Å²	112	83.2 Å²	83.2	55%	0.552	41%	0.409	S	S	*	.	H	α-helix	trans	-68.5	-36.8	175.9	-161.5	77.1	162.2	0	0	111.8	F634 F636 S637 H643	F634-M639 HydrophobicContact CB-CB 4.41Å; F634-M639 HydrophobicContact CD1-CB 4.28Å; F634-M639 HydrophobicContact CD1-CG 3.65Å; F634-M639 HydrophobicContact CE1-CG 4.39Å; F634-M639 HydrophobicContact CG-CG 4.47Å; F636-M639 HydrophobicContact CB-CB 4.3Å; F636-M639 WeakPolarHBondContact O-CB 3.42Å; F636-M639 PolarHBondContact O-N 3.22Å; S637-M639 VanDerWaalsContact C-N 3.3Å; S637-M639 PolarHBondContact O-N 2.83Å; M639-H643 VanDerWaalsContact O-CB 3.29Å; M639-H643 WeakPolarHBondContact O-CB 3.43Å; M639-H643 PolarHBondContact O-N 3.19Å
640	L	88.4	Confident	80.3	Confident	13 Å²	13	85.6 Å²	85.6	7%	0.068	42%	0.424	C	S	.	.	H	α-helix	trans	-68.1	-40.7	171.1	171.9	62.1	0	0	0	111.2	P626 C627 F634 F636 S637 H643 R644	P626-L640 WeakPolarHBondContact O-CD2 3.35Å; C627-L640 HydrophobicContact CB-CD1 3.69Å; F634-L640 HydrophobicContact CB-CB 4.09Å; F634-L640 HydrophobicContact CD2-CB 4.17Å; F634-L640 HydrophobicContact CD2-CD1 3.76Å; F634-L640 HydrophobicContact CE2-CD1 4.23Å; F634-L640 HydrophobicContact CG-CB 4.29Å; F636-L640 PolarHBondContact O-N 3.49Å; S637-L640 CarbonylContact O-C 3.58Å; S637-L640 WeakPolarHBondContact O-CA 3.48Å; S637-L640 WeakPolarHBondContact O-CB 3.48Å; S637-L640 PolarHBondContact O-N 3.17Å; L640-H643 CarbonylContact O-C 3.34Å; L640-H643 PolarHBondContact O-N 3.36Å; L640-R644 HydrophobicContact CD1-CG 3.92Å; L640-R644 HydrophobicContact CG-CG 4.26Å; L640-R644 WeakPolarHBondContact O-CG 3.27Å; L640-R644 PolarHBondContact O-N 3Å
641	K	85.1	Confident	78.3	Confident	128 Å²	128	88.6 Å²	88.6	56%	0.557	44%	0.441	S	S	*	.	H	α-helix	trans	-62.1	-54.5	178.7	-178.4	176.4	176.6	-179.1	0	111.8	S637 N638 H643 R644 E645	S637-K641 PolarHBondContact O-N 3.49Å; N638-K641 PolarHBondContact O-N 3.37Å; K641-H643 PolarHBondContact O-N 2.89Å; K641-H643 VanDerWaalsContact O-N 3.12Å; K641-R644 PolarHBondContact O-N 3.31Å; K641-E645 VanDerWaalsContact CE-OE1 3.24Å; K641-E645 WeakPolarHBondContact CE-OE1 3.35Å; K641-E645 WeakPolarHBondContact CG-OE1 3.34Å; K641-E645 WeakPolarHBondContact O-CG 3.29Å; K641-E645 PolarHBondContact O-N 3.17Å
642	A	84.8	Confident	76.1	Confident	45 Å²	45	91.7 Å²	91.7	37%	0.372	45%	0.445	S	S	.	.	H	α-helix	trans	-62	-20.3	176.2	0	0	0	0	0	113.5	N638	N638-A642 WeakPolarHBondContact O-CB 3.47Å; N638-A642 PolarHBondContact O-N 3.28Å
643	H	85.2	Confident	74.2	Confident	47 Å²	47	91.4 Å²	91.4	22%	0.218	45%	0.453	C	S	.	.	H	α-helix	trans	-82.6	-45.2	168.9	174.8	73.8	0	0	0	112.8	C627 C630 F634 M639 L640 K641 E645 K646 C647	C627-H643 VanDerWaalsContact SG-CD2 3.57Å; C630-H643 PolarHBondContact SG-NE2 3.09Å; F634-H643 HydrophobicContact CE1-CB 3.99Å; F634-H643 HydrophobicContact CE2-CB 3.94Å; F634-H643 AromaticContact CE2-CD2 3.27Å; F634-H643 WeakPolarHBondContact CE2-CD2 3.28Å; F634-H643 AromaticContact CE2-CG 3.54Å; F634-H643 AromaticContact CE2-NE2 3.85Å; F634-H643 HydrophobicContact CZ-CB 3.58Å; F634-H643 AromaticContact CZ-CD2 3.42Å; F634-H643 VanDerWaalsContact CZ-CD2 3.42Å; F634-H643 WeakPolarHBondContact CZ-CD2 3.33Å; F634-H643 AromaticContact CZ-CE1 3.94Å; F634-H643 AromaticContact CZ-CG 3.2Å; F634-H643 AromaticContact CZ-ND1 3.56Å; F634-H643 AromaticContact CZ-NE2 3.87Å; M639-H643 VanDerWaalsContact O-CB 3.29Å; M639-H643 WeakPolarHBondContact O-CB 3.43Å; M639-H643 PolarHBondContact O-N 3.19Å; L640-H643 CarbonylContact O-C 3.34Å; L640-H643 PolarHBondContact O-N 3.36Å; K641-H643 PolarHBondContact O-N 2.89Å; K641-H643 VanDerWaalsContact O-N 3.12Å; H643-E645 VanDerWaalsContact C-N 3.27Å; H643-E645 PolarHBondContact O-N 3.16Å; H643-K646 CarbonylContact O-C 3.4Å; H643-K646 WeakPolarHBondContact O-CA 3.36Å; H643-K646 PolarHBondContact O-N 2.97Å; H643-C647 PolarHBondContact NE2-SG 3.45Å; H643-C647 VanDerWaalsContact O-CB 3.26Å; H643-C647 WeakPolarHBondContact O-CB 3.43Å; H643-C647 PolarHBondContact O-N 3.19Å
644	R	81.4	Confident	71.7	Confident	109 Å²	109	93.5 Å²	93.5	41%	0.411	47%	0.47	S	S	.	.	H	α-helix	trans	-56.1	-42.4	176.6	-78	-179.6	-172.8	-136.9	-6.4	111	P626 E628 L640 K641 K646 C647	P626-R644 PolarHBondContact O-NH2 3.28Å; E628-R644 IonicContact OE1-CZ 3.26Å; E628-R644 VanDerWaalsContact OE1-CZ 3.26Å; E628-R644 IonicContact OE1-NH1 3.01Å; E628-R644 PolarHBondContact OE1-NH1 3.28Å; E628-R644 IonicContact OE1-NH2 2.64Å; E628-R644 PolarHBondContact OE1-NH2 3.06Å; L640-R644 HydrophobicContact CD1-CG 3.92Å; L640-R644 HydrophobicContact CG-CG 4.26Å; L640-R644 WeakPolarHBondContact O-CG 3.27Å; L640-R644 PolarHBondContact O-N 3Å; K641-R644 PolarHBondContact O-N 3.31Å; R644-K646 PolarHBondContact O-N 3.36Å; R644-C647 PolarHBondContact O-N 3.49Å; R644-C647 VanDerWaalsContact O-N 3.16Å
645	E	81.3	Confident	69.4	Low	119 Å²	119	97.8 Å²	97.8	56%	0.556	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-16.6	173.5	-70.9	164.2	-174.3	0	0	114.1	K641 H643	K641-E645 VanDerWaalsContact CE-OE1 3.24Å; K641-E645 WeakPolarHBondContact CE-OE1 3.35Å; K641-E645 WeakPolarHBondContact CG-OE1 3.34Å; K641-E645 WeakPolarHBondContact O-CG 3.29Å; K641-E645 PolarHBondContact O-N 3.17Å; H643-E645 VanDerWaalsContact C-N 3.27Å; H643-E645 PolarHBondContact O-N 3.16Å
646	K	78.6	Confident	67.3	Low	159 Å²	159	100.8 Å²	100.8	69%	0.691	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	2.2	-178.5	-59	178	-174	177.5	0	112.9	H643 R644 F648	H643-K646 CarbonylContact O-C 3.4Å; H643-K646 WeakPolarHBondContact O-CA 3.36Å; H643-K646 PolarHBondContact O-N 2.97Å; R644-K646 PolarHBondContact O-N 3.36Å; K646-F648 PolarHBondContact O-N 3.19Å
647	C	77.5	Confident	65.2	Low	18 Å²	18	104 Å²	104	12%	0.122	55%	0.548	C	S	.	.			trans	-95.9	78.7	-172.9	-167.2	0	0	0	0	110.8	H643 R644	H643-C647 PolarHBondContact NE2-SG 3.45Å; H643-C647 VanDerWaalsContact O-CB 3.26Å; H643-C647 WeakPolarHBondContact O-CB 3.43Å; H643-C647 PolarHBondContact O-N 3.19Å; R644-C647 PolarHBondContact O-N 3.49Å; R644-C647 VanDerWaalsContact O-N 3.16Å
648	F	67.3	Low	62.8	Low	170 Å²	170	110.3 Å²	110.3	75%	0.746	58%	0.58	S	S	*	*			trans	-75	148.3	170	-60.5	-80.4	0	0	0	110.6	K646 V650	K646-F648 PolarHBondContact O-N 3.19Å; F648-V650 PolarHBondContact O-N 2.85Å; F648-V650 VanDerWaalsContact O-N 3.13Å
649	H	58	Low	60.1	Low	149 Å²	149	109.2 Å²	109.2	69%	0.69	59%	0.593	S	S	*	*			trans	-50.9	113.4	-170	-81.3	-81.8	0	0	0	114.3	T651	H649-T651 HydrophobicContact CB-CG2 4.1Å; H649-T651 PolarHBondContact O-N 2.97Å; H649-T651 VanDerWaalsContact O-N 3.17Å
650	V	52.2	Low	57.4	Low	115 Å²	115	107.6 Å²	107.6	70%	0.697	61%	0.605	S	S	*	*			trans	-86.8	64.1	160.8	-171.2	0	0	0	0	108.6	F648 N652	F648-V650 PolarHBondContact O-N 2.85Å; F648-V650 VanDerWaalsContact O-N 3.13Å; V650-N652 VanDerWaalsContact C-N 3.28Å; V650-N652 PolarHBondContact O-N 3.11Å
651	T	43.6	Very low	54.7	Low	111 Å²	111	114.3 Å²	114.3	68%	0.681	64%	0.641	S	S	*	*			trans	-75.9	81	170.4	44.8	0	0	0	0	109.8	H649	H649-T651 HydrophobicContact CB-CG2 4.1Å; H649-T651 PolarHBondContact O-N 2.97Å; H649-T651 VanDerWaalsContact O-N 3.17Å
652	N	34.5	Very low	52.8	Low	120 Å²	120	113.3 Å²	113.3	64%	0.642	65%	0.648	S	S	*	*			trans	-146.7	90	163.4	-149.9	-2.9	0	0	0	111.2	V650 M654	V650-N652 VanDerWaalsContact C-N 3.28Å; V650-N652 PolarHBondContact O-N 3.11Å; N652-M654 PolarHBondContact O-N 3.38Å
653	P	44.3	Very low	50.4	Low	104 Å²	104	119.4 Å²	119.4	68%	0.675	67%	0.673	S	S	*	*			trans	-74.8	109.7	178.8	30.7	-32.6	0	0	0	110.1	V655	P653-V655 HydrophobicContact CB-CG2 4.41Å; P653-V655 PolarHBondContact O-N 2.98Å
654	M	33.2	Very low	47.7	Very low	173 Å²	173	120.9 Å²	120.9	85%	0.852	70%	0.701	S	S	*	*			trans	-70.8	75.7	171.6	-82.9	-76.9	162.9	0	0	111	N652	N652-M654 PolarHBondContact O-N 3.38Å
655	V	36.7	Very low	45.3	Very low	121 Å²	121	123.3 Å²	123.3	73%	0.733	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-85.1	126.2	168.8	176.1	0	0	0	0	108.9	P653	P653-V655 HydrophobicContact CB-CG2 4.41Å; P653-V655 PolarHBondContact O-N 2.98Å
656	V	40.6	Very low	42.9	Very low	115 Å²	115	124.8 Å²	124.8	70%	0.697	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-80.2	129.7	-178.8	-179	0	0	0	0	111
657	P	39.5	Very low	40.6	Very low	121 Å²	121	123.9 Å²	123.9	79%	0.786	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-92.1	118.4	159.7	4	16.2	0	0	0	110.1
658	N	35.1	Very low	38.9	Very low	164 Å²	164	128.4 Å²	128.4	88%	0.877	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-90.8	149.2	169.1	-98.5	-18	0	0	0	111
659	G	31.6	Very low	37	Very low	81 Å²	81	126.9 Å²	126.9	84%	0.835	76%	0.763	S	S	*	*			trans	138.2	98.4	161.5	0	0	0	0	0	114.6
660	G	27.3	Very low	35.6	Very low	77 Å²	77	125.7 Å²	125.7	79%	0.794	77%	0.766	S	S	*	*			trans	162.1	60.9	178.5	0	0	0	0	0	115.5
661	D	32	Very low	34.7	Very low	155 Å²	155	125.6 Å²	125.6	83%	0.829	77%	0.77	S	S	*	*			trans	-62.2	168.9	170.8	-66.4	-79.9	0	0	0	113.1
662	P	45.2	Very low	34.4	Very low	107 Å²	107	126.3 Å²	126.3	70%	0.695	78%	0.777	S	S	*	*			cis	-142.8	-176	16.5	35	-11.3	0	0	0	118
663	L	32.8	Very low	34.1	Very low	172 Å²	172	125.5 Å²	125.5	90%	0.901	79%	0.787	S	S	*	*			trans	81.3	113.8	159.6	-49.4	-176.9	0	0	0	119.1
664	G	28.9	Very low	33.4	Very low	78 Å²	78	124.8 Å²	124.8	80%	0.804	79%	0.789	S	S	*	*			trans	175.4	65.6	173.1	0	0	0	0	0	113.7	N666	G664-N666 PolarHBondContact O-N 3.34Å
665	L	32.3	Very low	33.1	Very low	160 Å²	160	123.5 Å²	123.5	84%	0.838	79%	0.786	S	S	*	*			trans	-59.2	126.4	-173	-64	166.3	0	0	0	113.6
666	N	31	Very low	32.7	Very low	151 Å²	151	122.1 Å²	122.1	81%	0.807	78%	0.782	S	S	*	*				179.8	140.6	103	-92.8	-65.2	0	0	0	113.7	G664	G664-N666 PolarHBondContact O-N 3.34Å
667	L	29.9	Very low	32.2	Very low	139 Å²	139	122.6 Å²	122.6	73%	0.728	79%	0.79	S	S	*	*			trans	-104.4	-174.5	159.8	-116.2	76.7	0	0	0	107.7	L669	L667-L669 HydrophobicContact CD2-CB 4.09Å; L667-L669 HydrophobicContact CD2-CD2 4.18Å; L667-L669 HydrophobicContact CG-CB 4.45Å
668	P	40.8	Very low	31.5	Very low	113 Å²	113	120.1 Å²	120.1	73%	0.734	79%	0.787	S	S	*	*			cis	-117.9	164.5	3.6	46.7	-34.2	0	0	0	111.5
669	L	27.6	Very low	31.9	Very low	138 Å²	138	118.3 Å²	118.3	72%	0.723	78%	0.784	S	S	*	*			cis	64.2	123.6	44.2	-168.1	72.2	0	0	0	114.4	L667	L667-L669 HydrophobicContact CD2-CB 4.09Å; L667-L669 HydrophobicContact CD2-CD2 4.18Å; L667-L669 HydrophobicContact CG-CB 4.45Å
670	V	27.9	Very low	31.7	Very low	124 Å²	124	118.6 Å²	118.6	75%	0.752	78%	0.779	S	S	*	*			trans	167.3	129	137	151.1	0	0	0	0	109.1
671	S	33.8	Very low	31.7	Very low	113 Å²	113	122.7 Å²	122.7	79%	0.79	78%	0.777	S	S	*	*			trans	-111.5	143.7	161.4	-51.7	0	0	0	0	108.4
672	P	38.2	Very low	31.5	Very low	126 Å²	126	122.9 Å²	122.9	82%	0.818	78%	0.777	S	S	*	*			trans	-92	162.9	160.7	-4.1	24.1	0	0	0	111.5
673	A	28	Very low	30.7	Very low	103 Å²	103	121.5 Å²	121.5	85%	0.851	78%	0.782	S	S	*	*			trans	-118.6	-151	-175.5	0	0	0	0	0	112.3
674	A	29.1	Very low	30.6	Very low	89 Å²	89	119.9 Å²	119.9	74%	0.736	78%	0.78	S	S	*	*			trans	-53.8	171.5	179.2	0	0	0	0	0	113.6
675	D	26.3	Very low	31.4	Very low	146 Å²	146	122.1 Å²	122.1	78%	0.781	78%	0.78	S	S	*	*				-170	158.8	55.6	-148	-13.6	0	0	0	116.8
676	S	28.3	Very low	31	Very low	93 Å²	93	118.9 Å²	118.9	65%	0.65	78%	0.776	S	S	*	*			trans	69.2	143.9	144.6	77.9	0	0	0	0	124.5
677	S	30.1	Very low	30.8	Very low	124 Å²	124	117.1 Å²	117.1	87%	0.867	78%	0.776	S	S	*	*			trans	81.4	147.9	150	76.4	0	0	0	0	121.5
678	G	24.6	Very low	30.6	Very low	69 Å²	69	115.4 Å²	115.4	71%	0.711	78%	0.782	S	S	*	*			trans	-134.8	-150.2	171.1	0	0	0	0	0	109.4
679	P	44.2	Very low	30	Very low	126 Å²	126	114.9 Å²	114.9	82%	0.818	79%	0.787	S	S	*	*			cis	-135.2	-166.4	6.2	44.2	-27	0	0	0	114.4
680	A	26.6	Very low	30.1	Very low	88 Å²	88	114.9 Å²	114.9	73%	0.727	79%	0.793	S	S	*	*			trans	69.2	155	162	0	0	0	0	0	117.5
681	Q	28.5	Very low	30.5	Very low	163 Å²	163	114.5 Å²	114.5	76%	0.762	79%	0.793	S	S	*	*			cis	-157.3	167.1	-17.2	-119.5	-163.5	117	0	0	110
682	L	27.3	Very low	30.1	Very low	158 Å²	158	114.4 Å²	114.4	83%	0.827	79%	0.793	S	S	*	*			trans	37.7	127.2	152	-71.2	164.9	0	0	0	121
683	G	27.8	Very low	29.4	Very low	78 Å²	78	112.8 Å²	112.8	80%	0.804	79%	0.79	S	S	*	*			trans	166.1	73.2	161.5	0	0	0	0	0	118
684	T	31	Very low	29.3	Very low	138 Å²	138	113.8 Å²	113.8	85%	0.847	79%	0.786	S	S	*	*			trans	-124	170.9	164.7	57.9	0	0	0	0	109.6
685	P	45.6	Very low	29.2	Very low	125 Å²	125	114.5 Å²	114.5	81%	0.812	79%	0.785	S	S	*	*				-129.2	173.8	-58.1	38.5	-25.6	0	0	0	111.7
686	A	25.2	Very low	29.2	Very low	92 Å²	92	113 Å²	113	76%	0.76	79%	0.786	S	S	*	*			trans	-148.9	120.1	164.5	0	0	0	0	0	113.7
687	S	26.9	Very low	29.6	Very low	115 Å²	115	113.8 Å²	113.8	80%	0.804	79%	0.789	S	S	*	*			trans	36.9	111.1	131.4	-49.8	0	0	0	0	119.3
688	A	25.2	Very low	29.5	Very low	102 Å²	102	116 Å²	116	84%	0.843	79%	0.785	S	S	*	*				75.9	103.2	60.2	0	0	0	0	0	114.7
689	A	28.5	Very low	29.5	Very low	103 Å²	103	118.9 Å²	118.9	85%	0.851	78%	0.784	S	S	*	*			trans	-156.2	108.5	161.8	0	0	0	0	0	110.7
690	T	28.4	Very low	28.6	Very low	138 Å²	138	119.1 Å²	119.1	85%	0.847	78%	0.777	S	S	*	*			trans	-88.7	153.4	158.8	51.4	0	0	0	0	108.9
691	P	37.2	Very low	28.7	Very low	116 Å²	116	122.9 Å²	122.9	75%	0.753	78%	0.78	S	S	*	*				-146.2	146.5	99.6	35.9	-20.1	0	0	0	116.6
692	S	24.6	Very low	28.5	Very low	111 Å²	111	119.4 Å²	119.4	78%	0.776	77%	0.773	S	S	*	*			trans	25.9	128.8	135.3	-47.9	0	0	0	0	122.3
693	A	25.2	Very low	28.6	Very low	91 Å²	91	118 Å²	118	75%	0.752	77%	0.771	S	S	*	*			trans	44.8	140.3	135.6	0	0	0	0	0	120
694	T	25.3	Very low	28.7	Very low	125 Å²	125	122.4 Å²	122.4	77%	0.767	77%	0.771	S	S	*	*				-172	167.6	57.9	-47.6	0	0	0	0	110.4
695	S	26.1	Very low	28.7	Very low	103 Å²	103	122.8 Å²	122.8	72%	0.72	77%	0.767	S	S	*	*			trans	56.2	107.8	154	54.9	0	0	0	0	120.3
696	S	25.9	Very low	28.1	Very low	115 Å²	115	121.5 Å²	121.5	80%	0.804	76%	0.761	S	S	*	*			trans	-57.3	159	141.6	-33.6	0	0	0	0	110.4
697	P	38.3	Very low	28.4	Very low	109 Å²	109	123.7 Å²	123.7	71%	0.708	76%	0.76	S	S	*	*				-155.9	147.7	88.6	38.6	-19.9	0	0	0	117.5
698	Q	26.3	Very low	28.5	Very low	171 Å²	171	122.9 Å²	122.9	80%	0.799	75%	0.754	S	S	*	*			trans	64.5	159.5	147.9	-52.3	-100.3	-59	0	0	116
699	L	25.2	Very low	28.8	Very low	129 Å²	129	125 Å²	125	68%	0.675	75%	0.75	S	S	*	*			cis	-158.6	166.2	-13.6	-125.7	179.5	0	0	0	108.5
700	L	24.8	Very low	28.9	Very low	131 Å²	131	126.7 Å²	126.7	69%	0.686	74%	0.744	S	S	*	*			trans	135.8	132.3	132.8	-71	-172.2	0	0	0	115.4
701	H	28.8	Very low	28.8	Very low	168 Å²	168	128.1 Å²	128.1	78%	0.778	74%	0.741	S	S	*	*			trans	69.6	142.1	150.6	-77.2	-130.3	0	0	0	120.3
702	S	25.8	Very low	29.3	Very low	89 Å²	89	127.5 Å²	127.5	62%	0.622	74%	0.737	S	S	*	*			cis	-164.3	130.5	-22.1	42.2	0	0	0	0	112.3
703	T	27.8	Very low	29.5	Very low	129 Å²	129	130.8 Å²	130.8	79%	0.791	74%	0.742	S	S	*	*			trans	1.6	141	146.8	56.2	0	0	0	0	120.9
704	Q	30.2	Very low	29.5	Very low	170 Å²	170	130.1 Å²	130.1	79%	0.794	74%	0.744	S	S	*	*				-154.3	126.2	121.8	-83.4	-127.3	-2.2	0	0	109
705	L	30.7	Very low	29.6	Very low	146 Å²	146	127.8 Å²	127.8	76%	0.764	75%	0.745	S	S	*	*				69	142.9	91.7	-62.5	-166.3	0	0	0	114.4
706	S	33	Very low	29.7	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	75%	0.754	S	S	*	*			cis	-163	-169.9	-9.1	54.7	0	0	0	0	107.9
707	L	31.1	Very low	29.8	Very low	138 Å²	138	130.1 Å²	130.1	72%	0.723	75%	0.752	S	S	*	*			cis	-159	115.8	2.7	-163.2	66.7	0	0	0	106.2
708	S	29.7	Very low	29.4	Very low	98 Å²	98	129.9 Å²	129.9	69%	0.685	76%	0.759	S	S	*	*				78.9	160.1	81	-46.9	0	0	0	0	118.1
709	L	31.6	Very low	29.6	Very low	146 Å²	146	126.3 Å²	126.3	76%	0.764	76%	0.759	S	S	*	*			trans	84.5	146.1	173.7	-66.4	67.9	0	0	0	118.6
710	L	30.3	Very low	29.9	Very low	138 Å²	138	124.9 Å²	124.9	72%	0.723	76%	0.76	S	S	*	*			cis	-162	133.7	-28	-95.9	173	0	0	0	105.5
711	H	27	Very low	30.4	Very low	169 Å²	169	127.5 Å²	127.5	78%	0.782	77%	0.768	S	S	*	*				59.7	155.3	84.4	-82.7	86.6	0	0	0	115.9
712	P	46.6	Very low	30.6	Very low	103 Å²	103	127.1 Å²	127.1	67%	0.669	77%	0.771	S	S	*	*			cis	-147.3	178.5	25.2	46.9	-28.3	0	0	0	119.7
713	M	29.5	Very low	31.2	Very low	180 Å²	180	128.7 Å²	128.7	89%	0.887	78%	0.779	S	S	*	*			trans	63	148	158.8	-46	-41.9	-108.3	0	0	121.6
714	G	26.3	Very low	31.9	Very low	76 Å²	76	127.9 Å²	127.9	78%	0.784	78%	0.776	S	S	*	*			cis	153.2	124	-16.1	0	0	0	0	0	117
715	G	25.6	Very low	32.5	Very low	76 Å²	76	125.4 Å²	125.4	78%	0.784	78%	0.775	S	S	*	*			trans	89.3	154.6	167.1	0	0	0	0	0	116.6
716	L	28.8	Very low	32.8	Very low	175 Å²	175	124.4 Å²	124.4	92%	0.916	78%	0.777	S	S	*	*			cis	-158.1	154.3	-0.6	-102.9	173.6	0	0	0	112.4
717	A	27.9	Very low	33	Very low	92 Å²	92	125.1 Å²	125.1	76%	0.76	78%	0.779	S	S	*	*			trans	70.7	127.6	146	0	0	0	0	0	124.8
718	A	29.6	Very low	33	Very low	104 Å²	104	126.7 Å²	126.7	86%	0.86	79%	0.787	S	S	*	*			trans	75.7	117.6	133	0	0	0	0	0	122.5
719	A	30.6	Very low	33.3	Very low	96 Å²	96	131.2 Å²	131.2	79%	0.793	80%	0.795	S	S	*	*			trans	-72.7	163.7	178.6	0	0	0	0	0	116.4
720	S	32.7	Very low	33.1	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	80%	0.797	S	S	*	*				-172.2	160.8	118	47.2	0	0	0	0	114
721	H	34.2	Very low	33.1	Very low	186 Å²	186	128.3 Å²	128.3	86%	0.861	81%	0.805	S	S	*	*			trans	77.7	121.1	169.1	-61.6	-73.8	0	0	0	121.2
722	L	33.6	Very low	33.1	Very low	160 Å²	160	123.6 Å²	123.6	84%	0.838	80%	0.802	S	S	*	*			trans	-99.9	163.2	176.9	-86.5	161.5	0	0	0	109.7
723	P	38.8	Very low	32.3	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	81%	0.814	S	S	*	*				-146.8	179.6	63.6	34.2	-10.1	0	0	0	117.6
724	P	42.2	Very low	32.2	Very low	113 Å²	113	131 Å²	131	73%	0.734	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.4	173.2	-169.5	-4.3	24.8	0	0	0	116.2
725	P	42.9	Very low	32.3	Very low	118 Å²	118	134.9 Å²	134.9	77%	0.766	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-87.6	154.9	-177.5	35.5	-36.2	0	0	0	114.9
726	P	36.3	Very low	32.4	Very low	124 Å²	124	136.9 Å²	136.9	81%	0.805	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-92.2	142.8	171.1	35.4	-32.4	0	0	0	113.2
727	P	38.5	Very low	32.4	Very low	114 Å²	114	135.8 Å²	135.8	74%	0.74	82%	0.817	S	S	*	*			trans	-119.6	165.7	175	41.7	-32.9	0	0	0	115
728	L	30.7	Very low	32.6	Very low	171 Å²	171	142.8 Å²	142.8	90%	0.895	84%	0.842	S	S	*	*			trans	71.7	156.4	162	-64.4	172	0	0	0	120
729	F	35	Very low	32.7	Very low	193 Å²	193	144.8 Å²	144.8	85%	0.846	84%	0.841	S	S	*	*			trans	-71.8	157.6	178.6	-71.8	-105	0	0	0	113.2
730	S	28.6	Very low	32.8	Very low	115 Å²	115	147.3 Å²	147.3	80%	0.804	84%	0.844	S	S	*	*				167.4	171.3	112.2	53.1	0	0	0	0	114.1
731	A	29.8	Very low	32.8	Very low	108 Å²	108	149.9 Å²	149.9	89%	0.893	85%	0.852	S	S	*	*			trans	68.6	168.9	166.6	0	0	0	0	0	118
732	G	27.4	Very low	32.8	Very low	70 Å²	70	147.8 Å²	147.8	72%	0.722	85%	0.851	S	S	*	*			trans	-167.9	-170.1	-176.5	0	0	0	0	0	113.1
733	R	29	Very low	32.7	Very low	244 Å²	244	147.1 Å²	147.1	92%	0.921	85%	0.852	S	S	*	*			trans	67.1	119.1	-168.3	-67.9	-172.6	171.3	-157.4	-1.8	116.1
734	M	28.8	Very low	32.3	Very low	196 Å²	196	148.8 Å²	148.8	97%	0.966	86%	0.857	S	S	*	*				-149.4	162.8	124.4	-102.2	-155	169.4	0	0	110.3
735	N	26.7	Very low	31.6	Very low	156 Å²	156	151.4 Å²	151.4	83%	0.834	87%	0.865	S	S	*	*			trans	-84.3	152	-175.5	-64.1	-7.1	0	0	0	112.7
736	S	28.4	Very low	30.7	Very low	118 Å²	118	153.9 Å²	153.9	83%	0.825	87%	0.873	S	S	*	*			trans	-153.5	149.6	135.2	52.5	0	0	0	0	110.3
737	N	28.5	Very low	30.3	Very low	153 Å²	153	156.4 Å²	156.4	82%	0.818	88%	0.879	S	S	*	*			trans	-81.8	143.2	-171.9	-56.3	-16.3	0	0	0	112.4
738	N	32.1	Very low	29.5	Very low	239 Å²	239	160.3 Å²	160.3	100%	1.278	89%	0.891	S	S	*	*				-162	0	120.3	-113	1.7	0	0	0	110.5

Retrieved 738 of 738 residues in 325 ms (Link to these results)

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