A0A087XAA0_POEFO Loading...

ASPSCR1 tether for SLC2A4, UBX domain containing

AlphaFold DB , UniProt , Accession A0A087XAA0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 628 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	46.4	Very low	41.5	Very low	193 Å²	193	131.2 Å²	131.2	95%	0.951	65%	0.652	S	S	*	*				0	-58.7	0	-144.8	139.9	77.9	0	0	111.4	I3 R4 L5	M1-I3 PolarHBondContact O-N 3.24Å; M1-I3 VanDerWaalsContact O-N 3.11Å; M1-R4 PolarHBondContact O-N 3.27Å; M1-R4 VanDerWaalsContact O-N 3.08Å; M1-L5 HydrophobicContact CG-CD1 4.39Å
2	N	38.1	Very low	41.6	Very low	136 Å²	136	126.3 Å²	126.3	73%	0.727	64%	0.64	S	S	*	*	H	α-helix	trans	-52	-38.8	-166	-54.3	10.3	0	0	0	116.1	R4 L5 A6	N2-R4 VanDerWaalsContact C-N 3.27Å; N2-R4 PolarHBondContact O-N 3.42Å; N2-L5 PolarHBondContact O-N 3Å; N2-A6 PolarHBondContact O-N 3.2Å; N2-A6 VanDerWaalsContact O-N 3.1Å
3	I	40	Very low	41.6	Very low	142 Å²	142	127.2 Å²	127.2	73%	0.728	64%	0.64	S	S	*	*	H	α-helix	trans	-60.9	-32.2	-179.1	-59.2	175.1	0	0	0	112.5	M1	M1-I3 PolarHBondContact O-N 3.24Å; M1-I3 VanDerWaalsContact O-N 3.11Å
4	R	42.6	Very low	41.7	Very low	213 Å²	213	130.9 Å²	130.9	80%	0.804	65%	0.65	S	S	*	*	H	α-helix	trans	-79.1	-21.5	176.1	-91.9	-172.1	174.2	177.3	-1.4	114	M1 N2	M1-R4 PolarHBondContact O-N 3.27Å; M1-R4 VanDerWaalsContact O-N 3.08Å; N2-R4 VanDerWaalsContact C-N 3.27Å; N2-R4 PolarHBondContact O-N 3.42Å
5	L	40.9	Very low	41.9	Very low	96 Å²	96	132.1 Å²	132.1	50%	0.503	65%	0.653	S	S	.	*	H	α-helix	trans	-78.2	-35.4	170.7	-88.6	98.3	0	0	0	111.8	M1 N2 L7 L8 F9	M1-L5 HydrophobicContact CG-CD1 4.39Å; N2-L5 PolarHBondContact O-N 3Å; L5-L7 PolarHBondContact O-N 2.99Å; L5-L8 PolarHBondContact O-N 3.42Å; L5-F9 PolarHBondContact O-N 2.83Å
6	A	37.6	Very low	41.8	Very low	59 Å²	59	133.9 Å²	133.9	49%	0.488	66%	0.656	S	S	.	*	H	α-helix	trans	-58.2	-46.2	178.9	0	0	0	0	0	112.3	N2 L8 F9 Q10	N2-A6 PolarHBondContact O-N 3.2Å; N2-A6 VanDerWaalsContact O-N 3.1Å; A6-L8 PolarHBondContact O-N 2.65Å; A6-F9 PolarHBondContact O-N 3.44Å; A6-Q10 PolarHBondContact O-N 2.92Å
7	L	43.2	Very low	42	Very low	98 Å²	98	135.6 Å²	135.6	51%	0.513	67%	0.669	S	S	.	*	H	α-helix	trans	-62.3	-41.4	177.6	-68.5	170.2	0	0	0	112.6	L5 F9 Q10 D11	L5-L7 PolarHBondContact O-N 2.99Å; L7-F9 VanDerWaalsContact C-N 3.26Å; L7-F9 PolarHBondContact O-N 3.24Å; L7-Q10 PolarHBondContact O-N 3.17Å; L7-Q10 VanDerWaalsContact O-N 3.09Å; L7-D11 PolarHBondContact O-N 3.17Å
8	L	43.6	Very low	42.2	Very low	116 Å²	116	132.2 Å²	132.2	61%	0.607	66%	0.66	S	S	*	*	H	α-helix	trans	-64.2	-27.4	177.2	-75	169.5	0	0	0	113.5	L5 A6 S12	L5-L8 PolarHBondContact O-N 3.42Å; A6-L8 PolarHBondContact O-N 2.65Å; L8-S12 WeakPolarHBondContact O-CB 3.13Å
9	F	43.2	Very low	42.5	Very low	150 Å²	150	135.3 Å²	135.3	66%	0.658	67%	0.673	S	S	*	*	H	α-helix	trans	-77.6	-38.3	170.6	-95.1	-93	0	0	0	112.2	L5 A6 L7 D11 S12 E13	L5-F9 PolarHBondContact O-N 2.83Å; A6-F9 PolarHBondContact O-N 3.44Å; L7-F9 VanDerWaalsContact C-N 3.26Å; L7-F9 PolarHBondContact O-N 3.24Å; F9-D11 PolarHBondContact O-N 3.23Å; F9-S12 WeakPolarHBondContact O-CB 3.45Å; F9-S12 PolarHBondContact O-N 3.4Å; F9-E13 PolarHBondContact O-N 2.8Å
10	Q	40.9	Very low	42.9	Very low	129 Å²	129	132.7 Å²	132.7	60%	0.603	66%	0.661	S	S	*	*	H	α-helix	trans	-72.7	-28.7	-175.4	-159.7	164.5	21	0	0	113.6	A6 L7	A6-Q10 PolarHBondContact O-N 2.92Å; L7-Q10 PolarHBondContact O-N 3.17Å; L7-Q10 VanDerWaalsContact O-N 3.09Å
11	D	39.9	Very low	43.2	Very low	111 Å²	111	131.1 Å²	131.1	59%	0.594	66%	0.661	S	S	*	*	H	α-helix	trans	-73.1	-36.8	168.6	-67.1	-31.2	0	0	0	111.5	L7 F9 E13 K14	L7-D11 PolarHBondContact O-N 3.17Å; F9-D11 PolarHBondContact O-N 3.23Å; D11-E13 VanDerWaalsContact C-N 3.29Å; D11-E13 PolarHBondContact O-N 3.19Å; D11-K14 PolarHBondContact O-N 2.84Å; D11-K14 VanDerWaalsContact O-N 3.14Å
12	S	42.3	Very low	43.2	Very low	72 Å²	72	129.9 Å²	129.9	50%	0.503	65%	0.65	S	S	.	*	H	α-helix	trans	-63.1	-28.3	-179	-172.3	0	0	0	0	114	L8 F9	L8-S12 WeakPolarHBondContact O-CB 3.13Å; F9-S12 WeakPolarHBondContact O-CB 3.45Å; F9-S12 PolarHBondContact O-N 3.4Å
13	E	42.6	Very low	43.7	Very low	138 Å²	138	128.8 Å²	128.8	65%	0.645	64%	0.643	S	S	*	*	H	α-helix	trans	-80.3	-22.8	175.9	-64.2	-156.7	120	0	0	113.9	F9 D11	F9-E13 PolarHBondContact O-N 2.8Å; D11-E13 VanDerWaalsContact C-N 3.29Å; D11-E13 PolarHBondContact O-N 3.19Å
14	K	42.9	Very low	44.1	Very low	180 Å²	180	126.6 Å²	126.6	78%	0.783	63%	0.633	S	S	*	*	H	α-helix	trans	-81	-22.4	-176.9	-82	-174.8	172.4	179.7	0	114.9	D11	D11-K14 PolarHBondContact O-N 2.84Å; D11-K14 VanDerWaalsContact O-N 3.14Å
15	E	43.7	Very low	44.5	Very low	148 Å²	148	120.5 Å²	120.5	69%	0.692	62%	0.62	S	S	*	*	S	Bend	trans	-102.9	6.8	-177	-97.1	-168.5	149.4	0	0	115.3	N17	E15-N17 PolarHBondContact O-N 2.81Å
16	K	40.8	Very low	44.9	Very low	161 Å²	161	122.1 Å²	122.1	70%	0.7	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-11.5	178.4	-82	178.3	-179.6	168	0	115.2
17	N	45.5	Very low	45.4	Very low	163 Å²	163	124 Å²	124	87%	0.872	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	32.3	-174.5	-149.3	82.9	0	0	0	113.6	E15	E15-N17 PolarHBondContact O-N 2.81Å
18	S	45.6	Very low	46	Very low	74 Å²	74	125.6 Å²	125.6	52%	0.517	63%	0.629	S	S	.	*			trans	-111.2	110.6	-178.4	-173.7	0	0	0	0	111.7	N20	S18-N20 PolarHBondContact O-N 2.92Å
19	E	48.2	Very low	46.3	Very low	191 Å²	191	125.4 Å²	125.4	89%	0.893	63%	0.626	S	S	*	*			trans	-75.6	61	-178.3	-62.1	-171.8	122.2	0	0	112.8
20	N	49.5	Very low	46.7	Very low	83 Å²	83	120.5 Å²	120.5	44%	0.444	61%	0.61	S	S	.	*			trans	-142.8	97.9	175.6	-132.6	-78.7	0	0	0	114.2	S18 K22 L23 L24	S18-N20 PolarHBondContact O-N 2.92Å; N20-K22 PolarHBondContact O-N 2.69Å; N20-K22 VanDerWaalsContact O-N 3.08Å; N20-L23 HydrophobicContact CB-CD1 4.46Å; N20-L23 PolarHBondContact O-N 3.33Å; N20-L23 VanDerWaalsContact O-N 3.17Å; N20-L24 PolarHBondContact O-N 3.05Å
21	P	49	Very low	47.2	Very low	100 Å²	100	119.2 Å²	119.2	65%	0.649	61%	0.606	S	S	*	*	H	α-helix	trans	-65.6	-18.8	-173.7	25.7	-34.5	0	0	0	113.7	T25	P21-T25 PolarHBondContact O-N 2.83Å; P21-T25 PolarHBondContact O-OG1 2.9Å; P21-T25 VanDerWaalsContact O-OG1 3.05Å
22	K	47.6	Very low	47.9	Very low	167 Å²	167	116.6 Å²	116.6	73%	0.726	60%	0.6	S	S	*	*	H	α-helix	trans	-70.9	-38.6	176.7	-65.9	-179.6	-179.4	174.9	0	112.4	N20 Q26	N20-K22 PolarHBondContact O-N 2.69Å; N20-K22 VanDerWaalsContact O-N 3.08Å; K22-Q26 PolarHBondContact O-N 2.82Å
23	L	48.3	Very low	48.5	Very low	113 Å²	113	119.2 Å²	119.2	59%	0.592	60%	0.604	S	S	*	*	H	α-helix	trans	-71	-42	177.6	-84.8	167.5	0	0	0	111.7	N20 T25 Q26 L27	N20-L23 HydrophobicContact CB-CD1 4.46Å; N20-L23 PolarHBondContact O-N 3.33Å; N20-L23 VanDerWaalsContact O-N 3.17Å; L23-T25 VanDerWaalsContact C-N 3.26Å; L23-T25 PolarHBondContact O-N 3.39Å; L23-Q26 PolarHBondContact O-N 3.04Å; L23-L27 WeakPolarHBondContact O-CB 3.44Å; L23-L27 PolarHBondContact O-N 2.91Å
24	L	47.6	Very low	49	Very low	96 Å²	96	120.5 Å²	120.5	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-60.6	-35.9	177.3	-173.7	62.3	0	0	0	112.3	N20 K28	N20-L24 PolarHBondContact O-N 3.05Å; L24-K28 HydrophobicContact CG-CD 4.42Å; L24-K28 WeakPolarHBondContact O-CB 3.38Å; L24-K28 VanDerWaalsContact O-CG 3.26Å; L24-K28 WeakPolarHBondContact O-CG 3.47Å; L24-K28 PolarHBondContact O-N 3.23Å; L24-K28 VanDerWaalsContact O-N 3.09Å
25	T	51.1	Low	49.6	Very low	86 Å²	86	115.5 Å²	115.5	53%	0.528	59%	0.588	S	S	.	*	H	α-helix	trans	-69.7	-44.5	174.9	-59.9	0	0	0	0	112.1	P21 L23 L27 K28 M29	P21-T25 PolarHBondContact O-N 2.83Å; P21-T25 PolarHBondContact O-OG1 2.9Å; P21-T25 VanDerWaalsContact O-OG1 3.05Å; L23-T25 VanDerWaalsContact C-N 3.26Å; L23-T25 PolarHBondContact O-N 3.39Å; T25-L27 PolarHBondContact O-N 3.44Å; T25-K28 PolarHBondContact O-N 3.4Å; T25-M29 PolarHBondContact O-N 3.22Å
26	Q	49.4	Very low	50.1	Low	130 Å²	130	112.1 Å²	112.1	61%	0.607	58%	0.577	S	S	*	*	H	α-helix	trans	-59.2	-44.7	174	-78.1	-74	6.6	0	0	112.1	K22 L23 K28 M29 C30	K22-Q26 PolarHBondContact O-N 2.82Å; L23-Q26 PolarHBondContact O-N 3.04Å; Q26-K28 PolarHBondContact O-N 3.4Å; Q26-M29 PolarHBondContact O-N 3.14Å; Q26-C30 PolarHBondContact O-N 3.17Å
27	L	49.1	Very low	50.6	Low	97 Å²	97	110.4 Å²	110.4	51%	0.508	57%	0.572	S	S	.	*	H	α-helix	trans	-64.7	-40.9	-180	-162.1	72.5	0	0	0	111.6	L23 T25 C30 L31	L23-L27 WeakPolarHBondContact O-CB 3.44Å; L23-L27 PolarHBondContact O-N 2.91Å; T25-L27 PolarHBondContact O-N 3.44Å; L27-C30 PolarHBondContact O-N 3.45Å; L27-L31 HydrophobicContact CG-CD1 4.47Å; L27-L31 WeakPolarHBondContact O-CB 3.47Å; L27-L31 PolarHBondContact O-N 2.81Å
28	K	54.6	Low	51	Low	133 Å²	133	108 Å²	108	58%	0.578	56%	0.558	S	S	*	*	H	α-helix	trans	-62.6	-40.8	173.4	-76.4	172.9	179.8	179	0	112.5	L24 T25 Q26 A32	L24-K28 HydrophobicContact CG-CD 4.42Å; L24-K28 WeakPolarHBondContact O-CB 3.38Å; L24-K28 VanDerWaalsContact O-CG 3.26Å; L24-K28 WeakPolarHBondContact O-CG 3.47Å; L24-K28 PolarHBondContact O-N 3.23Å; L24-K28 VanDerWaalsContact O-N 3.09Å; T25-K28 PolarHBondContact O-N 3.4Å; Q26-K28 PolarHBondContact O-N 3.4Å; K28-A32 WeakPolarHBondContact O-CB 3.26Å; K28-A32 PolarHBondContact O-N 3.31Å
29	M	49.8	Very low	51.4	Low	112 Å²	112	109.8 Å²	109.8	55%	0.552	56%	0.56	S	S	*	*	H	α-helix	trans	-64.1	-47.2	174.4	-75	-174.5	64.4	0	0	112	T25 Q26 L31 A32 E33	T25-M29 PolarHBondContact O-N 3.22Å; Q26-M29 PolarHBondContact O-N 3.14Å; M29-L31 VanDerWaalsContact C-N 3.31Å; M29-L31 PolarHBondContact O-N 2.85Å; M29-A32 WeakPolarHBondContact O-CB 3.15Å; M29-A32 PolarHBondContact O-N 2.89Å; M29-A32 VanDerWaalsContact O-N 3.11Å; M29-E33 PolarHBondContact O-N 2.9Å
30	C	51.4	Low	51.7	Low	47 Å²	47	105.2 Å²	105.2	32%	0.318	54%	0.541	S	S	.	.	H	α-helix	trans	-65.6	-33.5	-180	-166.9	0	0	0	0	112.7	Q26 L27 R34	Q26-C30 PolarHBondContact O-N 3.17Å; L27-C30 PolarHBondContact O-N 3.45Å; C30-R34 WeakPolarHBondContact O-CB 3.35Å; C30-R34 VanDerWaalsContact O-CG 3.32Å; C30-R34 WeakPolarHBondContact O-CG 3.15Å; C30-R34 PolarHBondContact O-N 2.86Å
31	L	52.3	Low	51.7	Low	101 Å²	101	105.8 Å²	105.8	53%	0.529	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-43.9	169.8	-90.8	157.3	0	0	0	112	L27 M29 R34 T35	L27-L31 HydrophobicContact CG-CD1 4.47Å; L27-L31 WeakPolarHBondContact O-CB 3.47Å; L27-L31 PolarHBondContact O-N 2.81Å; M29-L31 VanDerWaalsContact C-N 3.31Å; M29-L31 PolarHBondContact O-N 2.85Å; L31-R34 PolarHBondContact O-N 2.85Å; L31-T35 WeakPolarHBondContact O-CB 3.26Å; L31-T35 PolarHBondContact O-N 2.8Å; L31-T35 PolarHBondContact O-OG1 2.86Å; L31-T35 VanDerWaalsContact O-OG1 3.13Å
32	A	54.3	Low	51.7	Low	56 Å²	56	108.3 Å²	108.3	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-61.9	-46.7	176.3	0	0	0	0	0	112.1	K28 M29 R34 T35 V36	K28-A32 WeakPolarHBondContact O-CB 3.26Å; K28-A32 PolarHBondContact O-N 3.31Å; M29-A32 WeakPolarHBondContact O-CB 3.15Å; M29-A32 PolarHBondContact O-N 2.89Å; M29-A32 VanDerWaalsContact O-N 3.11Å; A32-R34 PolarHBondContact O-N 2.75Å; A32-T35 PolarHBondContact O-N 2.63Å; A32-V36 WeakPolarHBondContact O-CG2 3.18Å; A32-V36 PolarHBondContact O-N 3Å
33	E	55.3	Low	51.6	Low	128 Å²	128	102.9 Å²	102.9	60%	0.598	54%	0.54	S	S	*	.	H	α-helix	trans	-58.9	-46.6	175.5	-71.9	-175.9	144.3	0	0	111.9	M29 T35 V36 Q37	M29-E33 PolarHBondContact O-N 2.9Å; E33-T35 VanDerWaalsContact C-N 3.34Å; E33-T35 PolarHBondContact O-N 3.49Å; E33-V36 PolarHBondContact O-N 2.8Å; E33-Q37 WeakPolarHBondContact O-CB 3.41Å; E33-Q37 PolarHBondContact O-N 3.04Å
34	R	53.8	Low	51.6	Low	164 Å²	164	103.2 Å²	103.2	62%	0.619	55%	0.546	S	S	*	.	H	α-helix	trans	-63.6	-37.8	177.5	-75.6	176.6	173.8	-176.9	0	112.5	C30 L31 A32 Q37 I38	C30-R34 WeakPolarHBondContact O-CB 3.35Å; C30-R34 VanDerWaalsContact O-CG 3.32Å; C30-R34 WeakPolarHBondContact O-CG 3.15Å; C30-R34 PolarHBondContact O-N 2.86Å; L31-R34 PolarHBondContact O-N 2.85Å; A32-R34 PolarHBondContact O-N 2.75Å; R34-Q37 PolarHBondContact O-N 2.95Å; R34-I38 WeakPolarHBondContact O-CD1 3.5Å; R34-I38 VanDerWaalsContact O-CG1 3.27Å; R34-I38 WeakPolarHBondContact O-CG1 3.36Å; R34-I38 PolarHBondContact O-N 3.01Å
35	T	55	Low	51.4	Low	76 Å²	76	108.5 Å²	108.5	47%	0.466	56%	0.561	S	S	.	*	H	α-helix	trans	-64.9	-43.7	174.4	-67.2	0	0	0	0	111.5	L31 A32 E33 Q37 I38 I39	L31-T35 WeakPolarHBondContact O-CB 3.26Å; L31-T35 PolarHBondContact O-N 2.8Å; L31-T35 PolarHBondContact O-OG1 2.86Å; L31-T35 VanDerWaalsContact O-OG1 3.13Å; A32-T35 PolarHBondContact O-N 2.63Å; E33-T35 VanDerWaalsContact C-N 3.34Å; E33-T35 PolarHBondContact O-N 3.49Å; T35-Q37 PolarHBondContact O-N 3.39Å; T35-I38 PolarHBondContact O-N 2.86Å; T35-I39 HydrophobicContact CG2-CD1 3.95Å; T35-I39 WeakPolarHBondContact O-CG1 3.37Å; T35-I39 PolarHBondContact O-N 3.05Å
36	V	54.3	Low	51.2	Low	76 Å²	76	111 Å²	111	46%	0.461	57%	0.567	S	S	.	*	H	α-helix	trans	-61.6	-43.3	174.2	170	0	0	0	0	111.2	A32 E33 I38 I39 I40	A32-V36 WeakPolarHBondContact O-CG2 3.18Å; A32-V36 PolarHBondContact O-N 3Å; E33-V36 PolarHBondContact O-N 2.8Å; V36-I38 VanDerWaalsContact C-N 3.31Å; V36-I38 PolarHBondContact O-N 2.82Å; V36-I39 PolarHBondContact O-N 2.95Å; V36-I40 HydrophobicContact CG1-CD1 3.7Å; V36-I40 HydrophobicContact CG1-CG1 4.37Å; V36-I40 WeakPolarHBondContact O-CG1 3.43Å; V36-I40 PolarHBondContact O-N 3.18Å
37	Q	50.1	Low	50.7	Low	126 Å²	126	111.3 Å²	111.3	59%	0.589	57%	0.573	S	S	*	*	H	α-helix	trans	-61.6	-39.2	177.9	-148	72.4	0.9	0	0	112	E33 R34 T35 T41	E33-Q37 WeakPolarHBondContact O-CB 3.41Å; E33-Q37 PolarHBondContact O-N 3.04Å; R34-Q37 PolarHBondContact O-N 2.95Å; T35-Q37 PolarHBondContact O-N 3.39Å; Q37-T41 WeakPolarHBondContact O-CB 3.46Å; Q37-T41 PolarHBondContact O-N 2.91Å; Q37-T41 PolarHBondContact O-OG1 3.34Å
38	I	53.8	Low	50.8	Low	113 Å²	113	116.2 Å²	116.2	58%	0.579	59%	0.59	S	S	*	*	H	α-helix	trans	-65.7	-45.3	175.5	-70.9	163.9	0	0	0	110.7	R34 T35 V36 T41 F42	R34-I38 WeakPolarHBondContact O-CD1 3.5Å; R34-I38 VanDerWaalsContact O-CG1 3.27Å; R34-I38 WeakPolarHBondContact O-CG1 3.36Å; R34-I38 PolarHBondContact O-N 3.01Å; T35-I38 PolarHBondContact O-N 2.86Å; V36-I38 VanDerWaalsContact C-N 3.31Å; V36-I38 PolarHBondContact O-N 2.82Å; I38-T41 PolarHBondContact O-N 2.8Å; I38-F42 WeakPolarHBondContact O-CB 3.41Å; I38-F42 PolarHBondContact O-N 3.49Å
39	I	54	Low	50	Low	111 Å²	111	118.8 Å²	118.8	57%	0.569	60%	0.603	S	S	*	*	H	α-helix	trans	-61.7	-45.7	178.6	-69	165.2	0	0	0	111.1	T35 V36 T41 F42 G43	T35-I39 HydrophobicContact CG2-CD1 3.95Å; T35-I39 WeakPolarHBondContact O-CG1 3.37Å; T35-I39 PolarHBondContact O-N 3.05Å; V36-I39 PolarHBondContact O-N 2.95Å; I39-T41 PolarHBondContact O-N 2.88Å; I39-F42 PolarHBondContact O-N 3.24Å; I39-G43 PolarHBondContact O-N 3.44Å
40	I	54.8	Low	49.9	Very low	95 Å²	95	121.9 Å²	121.9	49%	0.487	62%	0.616	S	S	.	*	H	α-helix	trans	-59.9	-46.9	175.8	-67.8	167.2	0	0	0	110.5	V36 F42 G43 V44	V36-I40 HydrophobicContact CG1-CD1 3.7Å; V36-I40 HydrophobicContact CG1-CG1 4.37Å; V36-I40 WeakPolarHBondContact O-CG1 3.43Å; V36-I40 PolarHBondContact O-N 3.18Å; I40-F42 VanDerWaalsContact C-N 3.32Å; I40-F42 PolarHBondContact O-N 3.13Å; I40-G43 PolarHBondContact O-N 2.99Å; I40-V44 WeakPolarHBondContact O-CG2 3.42Å; I40-V44 PolarHBondContact O-N 3.23Å; I40-V44 VanDerWaalsContact O-N 3.12Å
41	T	50.9	Low	49.6	Very low	95 Å²	95	125.2 Å²	125.2	58%	0.583	64%	0.635	S	S	*	*	H	α-helix	trans	-62.2	-38.9	179.6	-52.6	0	0	0	0	112	Q37 I38 I39	Q37-T41 WeakPolarHBondContact O-CB 3.46Å; Q37-T41 PolarHBondContact O-N 2.91Å; Q37-T41 PolarHBondContact O-OG1 3.34Å; I38-T41 PolarHBondContact O-N 2.8Å; I39-T41 PolarHBondContact O-N 2.88Å
42	F	47.6	Very low	49.1	Very low	153 Å²	153	128.6 Å²	128.6	67%	0.671	65%	0.646	S	S	*	*	H	α-helix	trans	-71.1	-38.9	178.3	-147	-94.4	0	0	0	112.1	I38 I39 I40 V44 Y45	I38-F42 WeakPolarHBondContact O-CB 3.41Å; I38-F42 PolarHBondContact O-N 3.49Å; I39-F42 PolarHBondContact O-N 3.24Å; I40-F42 VanDerWaalsContact C-N 3.32Å; I40-F42 PolarHBondContact O-N 3.13Å; F42-V44 PolarHBondContact O-N 3.48Å; F42-Y45 PolarHBondContact O-N 3.34Å
43	G	45.6	Very low	48.5	Very low	52 Å²	52	133 Å²	133	54%	0.536	66%	0.661	S	S	.	*	H	α-helix	trans	-63.3	-37.3	176.5	0	0	0	0	0	113.7	I39 I40 Y45	I39-G43 PolarHBondContact O-N 3.44Å; I40-G43 PolarHBondContact O-N 2.99Å; G43-Y45 VanDerWaalsContact C-N 3.26Å; G43-Y45 PolarHBondContact O-N 3.45Å
44	V	49.3	Very low	47.9	Very low	120 Å²	120	131.7 Å²	131.7	73%	0.727	67%	0.666	S	S	*	*	H	α-helix	trans	-66.9	-25.8	176.8	171	0	0	0	0	112.6	I40 F42 Q46	I40-V44 WeakPolarHBondContact O-CG2 3.42Å; I40-V44 PolarHBondContact O-N 3.23Å; I40-V44 VanDerWaalsContact O-N 3.12Å; F42-V44 PolarHBondContact O-N 3.48Å; V44-Q46 VanDerWaalsContact C-N 3.35Å; V44-Q46 PolarHBondContact O-N 3.33Å
45	Y	42.5	Very low	47.3	Very low	207 Å²	207	128.7 Å²	128.7	81%	0.812	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-10.1	-175.5	-152.4	-94.7	0	0	0	114.5	F42 G43	F42-Y45 PolarHBondContact O-N 3.34Å; G43-Y45 VanDerWaalsContact C-N 3.26Å; G43-Y45 PolarHBondContact O-N 3.45Å
46	Q	47.3	Very low	46.9	Very low	139 Å²	139	130.4 Å²	130.4	65%	0.65	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.6	15.1	-166.7	-86.6	-70.5	13.3	0	0	116.3	V44	V44-Q46 VanDerWaalsContact C-N 3.35Å; V44-Q46 PolarHBondContact O-N 3.33Å
47	N	39.8	Very low	46.4	Very low	137 Å²	137	131.3 Å²	131.3	73%	0.733	67%	0.674	S	S	*	*			trans	-148.8	99.4	169.8	-116.9	-80.2	0	0	0	114.8	H49	N47-H49 PolarHBondContact O-N 2.86Å
48	K	49.6	Very low	46	Very low	200 Å²	200	135.1 Å²	135.1	87%	0.87	68%	0.683	S	S	*	*			trans	-82.8	92.3	152.8	-75.8	-178.8	177.4	177.4	0	108.7
49	H	39.8	Very low	45.5	Very low	186 Å²	186	133 Å²	133	86%	0.861	68%	0.675	S	S	*	*			trans	-160.7	152.4	147	-99.8	-69.1	0	0	0	110.2	N47	N47-H49 PolarHBondContact O-N 2.86Å
50	H	45.6	Very low	45.2	Very low	177 Å²	177	132.5 Å²	132.5	82%	0.819	67%	0.673	S	S	*	*			trans	-94.4	163.1	-168.1	-168.7	-117.9	0	0	0	111.9
51	V	46.3	Very low	44.4	Very low	118 Å²	118	135.3 Å²	135.3	72%	0.715	68%	0.682	S	S	*	*	S	Bend	trans	72.8	69.5	173	-158	0	0	0	0	117.3
52	F	41.3	Very low	44	Very low	172 Å²	172	136.6 Å²	136.6	75%	0.754	68%	0.684	S	S	*	*			trans	-152.9	-0.2	148.4	-140.8	-101.2	0	0	0	117.5
53	L	42.8	Very low	43.9	Very low	149 Å²	149	134.2 Å²	134.2	78%	0.78	68%	0.677	S	S	*	*	S	Bend	trans	-85.4	-7.4	-169.2	-90.7	78.2	0	0	0	117.1
54	S	41.2	Very low	43.6	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	68%	0.68	S	S	*	*	H	α-helix	trans	-69.6	-38.2	-173.9	-167.1	0	0	0	0	113.7
55	T	42.9	Very low	43.1	Very low	101 Å²	101	136.1 Å²	136.1	62%	0.62	67%	0.67	S	S	*	*	H	α-helix	trans	-78.1	-44.5	-169.6	-45.8	0	0	0	0	112.9	V57 R58	T55-V57 VanDerWaalsContact C-N 3.34Å; T55-V57 PolarHBondContact O-N 2.83Å; T55-R58 PolarHBondContact O-N 2.88Å
56	Q	45.3	Very low	42.9	Very low	112 Å²	112	131.7 Å²	131.7	52%	0.523	66%	0.66	S	S	.	*	H	α-helix	trans	-66.5	-30.6	-174.2	-78.4	-68.5	5.7	0	0	114.1	R58 T59 I60	Q56-R58 PolarHBondContact O-N 3Å; Q56-T59 PolarHBondContact O-N 2.92Å; Q56-I60 PolarHBondContact O-N 2.88Å
57	V	44.7	Very low	42.7	Very low	95 Å²	95	128.7 Å²	128.7	58%	0.576	65%	0.652	S	S	*	*	H	α-helix	trans	-65.4	-27.3	178.8	-179.9	0	0	0	0	111.8	T55 K61	T55-V57 VanDerWaalsContact C-N 3.34Å; T55-V57 PolarHBondContact O-N 2.83Å; V57-K61 PolarHBondContact O-N 2.93Å
58	R	41.9	Very low	42.6	Very low	205 Å²	205	127.9 Å²	127.9	77%	0.774	65%	0.652	S	S	*	*	H	α-helix	trans	-74.3	-41.3	174.1	-72	-176	171.7	-179.2	-2.6	112.1	T55 Q56 I60 K61 L62	T55-R58 PolarHBondContact O-N 2.88Å; Q56-R58 PolarHBondContact O-N 3Å; R58-I60 PolarHBondContact O-N 2.84Å; R58-K61 PolarHBondContact O-N 2.58Å; R58-L62 PolarHBondContact O-N 3.2Å
59	T	42.4	Very low	42	Very low	68 Å²	68	123.8 Å²	123.8	42%	0.417	64%	0.643	S	S	.	*	H	α-helix	trans	-59.4	-48.3	178.4	-44.9	0	0	0	0	111.6	Q56 K61 L62 I63	Q56-T59 PolarHBondContact O-N 2.92Å; T59-K61 PolarHBondContact O-N 3.17Å; T59-L62 PolarHBondContact O-N 3.26Å; T59-I63 HydrophobicContact CG2-CD1 4.39Å; T59-I63 WeakPolarHBondContact O-CG1 3.4Å; T59-I63 PolarHBondContact O-N 3.07Å
60	I	47.5	Very low	41.8	Very low	102 Å²	102	119.4 Å²	119.4	52%	0.523	63%	0.634	S	S	.	*	H	α-helix	trans	-64.7	-39.1	-177.8	-63.5	170.7	0	0	0	111.4	Q56 R58 L62 I63 Q64	Q56-I60 PolarHBondContact O-N 2.88Å; R58-I60 PolarHBondContact O-N 2.84Å; I60-L62 VanDerWaalsContact C-N 3.31Å; I60-L62 PolarHBondContact O-N 2.89Å; I60-I63 PolarHBondContact O-N 2.92Å; I60-Q64 PolarHBondContact O-N 2.85Å
61	K	39	Very low	41.4	Very low	154 Å²	154	118.3 Å²	118.3	67%	0.67	63%	0.633	S	S	*	*	H	α-helix	trans	-65.8	-30.1	177.4	-109	-178.1	176.1	-179.3	0	113.8	V57 R58 T59 I63 T65	V57-K61 PolarHBondContact O-N 2.93Å; R58-K61 PolarHBondContact O-N 2.58Å; T59-K61 PolarHBondContact O-N 3.17Å; K61-I63 VanDerWaalsContact C-N 3.34Å; K61-T65 PolarHBondContact O-OG1 3.27Å
62	L	41.5	Very low	41	Very low	121 Å²	121	121.3 Å²	121.3	63%	0.634	64%	0.639	S	S	*	*	H	α-helix	trans	-75.3	-23.2	178.2	-158.6	71.2	0	0	0	113.1	R58 T59 I60 T65 N66	R58-L62 PolarHBondContact O-N 3.2Å; T59-L62 PolarHBondContact O-N 3.26Å; I60-L62 VanDerWaalsContact C-N 3.31Å; I60-L62 PolarHBondContact O-N 2.89Å; L62-T65 PolarHBondContact O-OG1 2.96Å; L62-N66 PolarHBondContact O-ND2 3.28Å
63	I	46.8	Very low	40.6	Very low	104 Å²	104	118.2 Å²	118.2	53%	0.533	64%	0.635	S	S	.	*	H	α-helix	trans	-80.6	-36	177.8	-64.7	166.9	0	0	0	111	T59 I60 K61 T67	T59-I63 HydrophobicContact CG2-CD1 4.39Å; T59-I63 WeakPolarHBondContact O-CG1 3.4Å; T59-I63 PolarHBondContact O-N 3.07Å; I60-I63 PolarHBondContact O-N 2.92Å; K61-I63 VanDerWaalsContact C-N 3.34Å; I63-T67 WeakPolarHBondContact O-CG2 3.18Å; I63-T67 PolarHBondContact O-N 3.31Å; I63-T67 PolarHBondContact O-OG1 3.31Å
64	Q	37.8	Very low	40	Very low	128 Å²	128	120.9 Å²	120.9	60%	0.598	65%	0.646	S	S	*	*	H	α-helix	trans	-72.7	-32.1	178.8	-73.8	-167.9	-52.4	0	0	114	I60 T67 V68	I60-Q64 PolarHBondContact O-N 2.85Å; Q64-T67 WeakPolarHBondContact CA-OG1 3.33Å; Q64-T67 PolarHBondContact O-OG1 2.65Å; Q64-V68 PolarHBondContact O-N 3.06Å
65	T	39.9	Very low	39.5	Very low	83 Å²	83	119.8 Å²	119.8	51%	0.509	64%	0.643	S	S	.	*	H	α-helix	trans	-73.7	-33	179.5	50.7	0	0	0	0	113.4	K61 L62 T69	K61-T65 PolarHBondContact O-OG1 3.27Å; L62-T65 PolarHBondContact O-OG1 2.96Å; T65-T69 PolarHBondContact O-OG1 3.09Å
66	N	38.3	Very low	39.3	Very low	114 Å²	114	119.4 Å²	119.4	61%	0.61	65%	0.65	S	S	*	*	H	α-helix	trans	-75.9	-30.7	176	-85.4	-55.1	0	0	0	113.3	L62	L62-N66 PolarHBondContact O-ND2 3.28Å
67	T	41.5	Very low	39.3	Very low	77 Å²	77	120 Å²	120	47%	0.472	67%	0.666	S	S	.	*	H	α-helix	trans	-77.5	-38	-177.1	42.1	0	0	0	0	113.2	I63 Q64 S70	I63-T67 WeakPolarHBondContact O-CG2 3.18Å; I63-T67 PolarHBondContact O-N 3.31Å; I63-T67 PolarHBondContact O-OG1 3.31Å; Q64-T67 WeakPolarHBondContact CA-OG1 3.33Å; Q64-T67 PolarHBondContact O-OG1 2.65Å; T67-S70 PolarHBondContact O-N 2.9Å
68	V	38	Very low	39.9	Very low	120 Å²	120	117.2 Å²	117.2	73%	0.727	66%	0.656	S	S	*	*	H	α-helix	trans	-74.7	-27.6	179.5	-178.9	0	0	0	0	112.7	Q64 S70	Q64-V68 PolarHBondContact O-N 3.06Å; V68-S70 PolarHBondContact O-N 2.91Å
69	T	37	Very low	41.5	Very low	113 Å²	113	108.3 Å²	108.3	69%	0.693	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-9.2	176.7	-41.8	0	0	0	0	112.8	T65	T65-T69 PolarHBondContact O-OG1 3.09Å
70	S	36.8	Very low	43.5	Very low	94 Å²	94	106 Å²	106	66%	0.657	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-3.4	-173	-153.3	0	0	0	0	114.9	T67 V68	T67-S70 PolarHBondContact O-N 2.9Å; V68-S70 PolarHBondContact O-N 2.91Å
71	L	36.9	Very low	45.5	Very low	154 Å²	154	101.1 Å²	101.1	81%	0.806	59%	0.589	S	S	*	*	S	Bend	trans	-109.2	1.9	-172.5	-90.8	165.1	0	0	0	116.3
72	Q	37	Very low	47.9	Very low	181 Å²	181	95.3 Å²	95.3	85%	0.846	57%	0.566	S	S	*	*	S	Bend	trans	-120.5	17.7	177.2	-158.9	63.5	32.8	0	0	113.6
73	T	33.8	Very low	50.3	Low	108 Å²	108	89.5 Å²	89.5	66%	0.663	54%	0.536	S	S	*	.			trans	-142.1	80	174	-51.9	0	0	0	0	112.4	A75	T73-A75 HydrophobicContact CG2-CB 3.57Å; T73-A75 PolarHBondContact O-N 3.46Å
74	M	29.1	Very low	52.4	Low	205 Å²	205	87.4 Å²	87.4	100%	1.01	53%	0.525	S	S	*	.			trans	-74.7	64	157.4	-78.4	-160.9	176	0	0	110.4	A76	M74-A76 PolarHBondContact O-N 3.09Å; M74-A76 VanDerWaalsContact O-N 3.16Å
75	A	31.4	Very low	54.7	Low	77 Å²	77	81.4 Å²	81.4	64%	0.636	50%	0.497	S	S	*	.			trans	-77.8	94.3	166.2	0	0	0	0	0	108.5	T73 S77	T73-A75 HydrophobicContact CG2-CB 3.57Å; T73-A75 PolarHBondContact O-N 3.46Å; A75-S77 PolarHBondContact O-N 3.31Å
76	A	38.6	Very low	56.8	Low	93 Å²	93	80.9 Å²	80.9	77%	0.769	50%	0.495	S	S	*	.			trans	-52.2	135.5	160.8	0	0	0	0	0	108.9	M74 G78	M74-A76 PolarHBondContact O-N 3.09Å; M74-A76 VanDerWaalsContact O-N 3.16Å; A76-G78 PolarHBondContact O-N 3.04Å
77	S	45.1	Very low	58.9	Low	124 Å²	124	78.7 Å²	78.7	87%	0.867	48%	0.483	S	S	*	.			trans	-73	66.8	174	-165.7	0	0	0	0	109.9	A75 S79	A75-S77 PolarHBondContact O-N 3.31Å; S77-S79 PolarHBondContact O-N 3.16Å
78	G	57.5	Low	60.7	Low	36 Å²	36	77.7 Å²	77.7	37%	0.371	49%	0.489	S	S	.	.			trans	-79.7	115.5	178.1	0	0	0	0	0	109.4	A76 A80	A76-G78 PolarHBondContact O-N 3.04Å; G78-A80 PolarHBondContact O-N 3.47Å
79	S	75.9	Confident	63	Low	18 Å²	18	79.5 Å²	79.5	13%	0.126	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.1	129.9	165.6	-56.1	0	0	0	0	108.7	S77 V95 W134 N141	S77-S79 PolarHBondContact O-N 3.16Å; S79-V95 PolarHBondContact N-O 3.2Å; S79-V95 WeakPolarHBondContact O-CG2 3.49Å; S79-V95 PolarHBondContact O-N 2.96Å; S79-W134 PolarHBondContact OG-NE1 2.98Å; S79-N141 WeakPolarHBondContact CB-OD1 3.3Å; S79-N141 PolarHBondContact OG-OD1 2.68Å
80	A	84.8	Confident	65.6	Low	20 Å²	20	82.8 Å²	82.8	17%	0.165	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	151.9	163.7	0	0	0	0	0	109.3	G78 T92 I93 N142	G78-A80 PolarHBondContact O-N 3.47Å; A80-T92 HydrophobicContact CB-CG2 4.03Å; A80-I93 WeakPolarHBondContact CA-O 3.37Å; A80-N142 WeakPolarHBondContact O-CA 3.35Å; A80-N142 PolarHBondContact O-N 2.65Å; A80-N142 VanDerWaalsContact O-N 3.16Å
81	V	89.7	Confident	68	Low	0 Å²	0	80.3 Å²	80.3	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	142.4	169.6	62.6	0	0	0	0	108.1	V83 T92 I93 V95 V104 W134 L145	V81-V83 HydrophobicContact CG2-CG2 4.34Å; V81-T92 CarbonylContact O-C 3.52Å; V81-T92 VanDerWaalsContact O-CA 3.26Å; V81-T92 WeakPolarHBondContact O-CA 3.45Å; V81-I93 HydrophobicContact CG1-CB 4.07Å; V81-I93 PolarHBondContact N-O 3.06Å; V81-I93 PolarHBondContact O-N 3.5Å; V81-V95 HydrophobicContact CB-CG2 4.47Å; V81-V95 HydrophobicContact CG1-CG1 3.8Å; V81-V95 HydrophobicContact CG1-CG2 4.26Å; V81-V104 HydrophobicContact CG1-CG1 3.77Å; V81-W134 HydrophobicContact CB-CH2 3.54Å; V81-W134 HydrophobicContact CB-CZ2 4.41Å; V81-W134 HydrophobicContact CB-CZ3 3.77Å; V81-W134 HydrophobicContact CG1-CZ3 4.31Å; V81-W134 HydrophobicContact CG2-CH2 3.57Å; V81-W134 HydrophobicContact CG2-CZ3 3.69Å; V81-L145 HydrophobicContact CG2-CD1 3.65Å; V81-L145 HydrophobicContact CG2-CG 3.7Å
82	T	89.4	Confident	70.6	Confident	31 Å²	31	76.6 Å²	76.6	19%	0.19	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.8	173.8	-61.5	0	0	0	0	109.4	R90 Q91 T92 A143 K144 L145	T82-R90 HydrophobicContact CG2-CB 3.85Å; T82-R90 HydrophobicContact CG2-CG 4.41Å; T82-Q91 WeakPolarHBondContact CA-O 3.45Å; T82-T92 PolarHBondContact OG1-OG1 3.38Å; T82-A143 PolarHBondContact N-O 3.24Å; T82-K144 CarbonylContact O-C 3.55Å; T82-K144 VanDerWaalsContact O-CA 3.3Å; T82-K144 WeakPolarHBondContact O-CA 3.49Å; T82-L145 PolarHBondContact O-N 3.29Å
83	V	91.1	Very high	73	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.9	-179.8	-170.3	0	0	0	0	109.4	V81 R90 Q91 V104 V108 L121 L145 M147	V81-V83 HydrophobicContact CG2-CG2 4.34Å; V83-R90 CarbonylContact O-C 3.56Å; V83-R90 WeakPolarHBondContact O-CA 3.41Å; V83-Q91 PolarHBondContact N-O 2.59Å; V83-Q91 PolarHBondContact O-N 3.03Å; V83-V104 HydrophobicContact CG2-CG1 4.49Å; V83-V108 HydrophobicContact CB-CG1 4.46Å; V83-V108 HydrophobicContact CB-CG2 3.75Å; V83-V108 HydrophobicContact CG1-CG1 4.35Å; V83-V108 HydrophobicContact CG1-CG2 4.17Å; V83-V108 HydrophobicContact CG2-CG2 3.68Å; V83-L121 HydrophobicContact CG1-CD2 3.8Å; V83-L121 HydrophobicContact CG2-CD2 4.46Å; V83-L145 CarbonylContact C-O 3.58Å; V83-L145 WeakPolarHBondContact CA-O 3.35Å; V83-L145 HydrophobicContact CG1-CB 4.34Å; V83-L145 HydrophobicContact CG2-CB 4.18Å; V83-L145 HydrophobicContact CG2-CD1 4.38Å; V83-M147 HydrophobicContact CG1-CB 3.96Å
84	L	90.6	Very high	75.7	Confident	59 Å²	59	72.7 Å²	72.7	31%	0.309	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	117.8	168.6	-180	67.3	0	0	0	108.4	R90 L145 M147	L84-R90 HydrophobicContact CD1-CG 3.76Å; L84-L145 PolarHBondContact N-O 3.26Å; L84-M147 PolarHBondContact O-N 2.89Å
85	T	87.1	Confident	78.5	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.018	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-90	157.3	178.1	45.5	0	0	0	0	111.7	N87 G88 R89 V108 F114 M147	T85-N87 PolarHBondContact O-N 2.94Å; T85-N87 PolarHBondContact OG1-OD1 3.47Å; T85-G88 PolarHBondContact O-N 3.16Å; T85-R89 PolarHBondContact N-O 3.18Å; T85-R89 PolarHBondContact OG1-O 3.22Å; T85-V108 HydrophobicContact CG2-CG1 3.19Å; T85-F114 HydrophobicContact CG2-CE2 4.28Å; T85-M147 HydrophobicContact CG2-CE 4.22Å; T85-M147 HydrophobicContact CG2-SD 4.3Å
86	P	83.6	Confident	81.1	Confident	71 Å²	71	61.9 Å²	61.9	46%	0.461	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.8	-176.2	-26.2	35.7	0	0	0	114.7	G88 F114 M147	P86-G88 PolarHBondContact O-N 2.93Å; P86-F114 HydrophobicContact CB-CZ 4.42Å; P86-F114 HydrophobicContact CG-CZ 4.43Å; P86-M147 VanDerWaalsContact CD-CE 3.45Å; P86-M147 HydrophobicContact CG-CE 4.06Å
87	N	81.9	Confident	83.2	Confident	68 Å²	68	60.2 Å²	60.2	36%	0.364	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	9.5	173.1	65.3	30.2	0	0	0	113.9	T85 R89 H112 F114	T85-N87 PolarHBondContact O-N 2.94Å; T85-N87 PolarHBondContact OG1-OD1 3.47Å; N87-R89 PolarHBondContact O-N 2.89Å; N87-R89 WeakPolarHBondContact OD1-CB 3.28Å; N87-R89 VanDerWaalsContact OD1-CG 3.26Å; N87-R89 WeakPolarHBondContact OD1-CG 2.93Å; N87-R89 PolarHBondContact OD1-N 3.07Å; N87-H112 PolarHBondContact ND2-CE1 3.23Å; N87-H112 PolarHBondContact ND2-ND1 2.86Å; N87-F114 HydrophobicContact CB-CZ 4.2Å; N87-F114 WeakPolarHBondContact ND2-CE2 3.45Å
88	G	79.8	Confident	84.9	Confident	57 Å²	57	56.1 Å²	56.1	59%	0.588	31%	0.308	S	S	*	.	S	Bend	trans	78.2	-6.7	-179.4	0	0	0	0	0	115.6	T85 P86	T85-G88 PolarHBondContact O-N 3.16Å; P86-G88 PolarHBondContact O-N 2.93Å
89	R	86.6	Confident	86.3	Confident	158 Å²	158	55.5 Å²	55.5	60%	0.596	30%	0.298	S	S	*	.			trans	-81.4	152.5	-179.6	-57.8	177.7	177.9	-172.1	-0.8	111.3	T85 N87 H112	T85-R89 PolarHBondContact N-O 3.18Å; T85-R89 PolarHBondContact OG1-O 3.22Å; N87-R89 PolarHBondContact O-N 2.89Å; N87-R89 WeakPolarHBondContact OD1-CB 3.28Å; N87-R89 VanDerWaalsContact OD1-CG 3.26Å; N87-R89 WeakPolarHBondContact OD1-CG 2.93Å; N87-R89 PolarHBondContact OD1-N 3.07Å; R89-H112 WeakPolarHBondContact CB-NE2 3.42Å; R89-H112 VanDerWaalsContact CD-NE2 3.26Å; R89-H112 WeakPolarHBondContact CD-NE2 3.26Å
90	R	90.4	Very high	86.7	Confident	181 Å²	181	55.5 Å²	55.5	68%	0.683	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.8	177.1	-68.5	179.3	-177.8	161.6	3.4	110.2	T82 V83 L84	T82-R90 HydrophobicContact CG2-CB 3.85Å; T82-R90 HydrophobicContact CG2-CG 4.41Å; V83-R90 CarbonylContact O-C 3.56Å; V83-R90 WeakPolarHBondContact O-CA 3.41Å; L84-R90 HydrophobicContact CD1-CG 3.76Å
91	Q	88.9	Confident	86.8	Confident	42 Å²	42	54.6 Å²	54.6	20%	0.196	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	116.5	176.9	-177.5	56.5	69.6	0	0	109.9	T82 V83 I93 V108 K111	T82-Q91 WeakPolarHBondContact CA-O 3.45Å; V83-Q91 PolarHBondContact N-O 2.59Å; V83-Q91 PolarHBondContact O-N 3.03Å; Q91-I93 HydrophobicContact CG-CD1 4.39Å; Q91-I93 HydrophobicContact CG-CG1 4.09Å; Q91-V108 HydrophobicContact CB-CG1 4.48Å; Q91-V108 HydrophobicContact CB-CG2 4.49Å; Q91-V108 HydrophobicContact CG-CG2 4.39Å; Q91-K111 HydrophobicContact CG-CD 4.15Å
92	T	89.6	Confident	86.7	Confident	77 Å²	77	54.9 Å²	54.9	47%	0.472	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	135.8	170.4	-53.5	0	0	0	0	110.3	A80 V81 T82	A80-T92 HydrophobicContact CB-CG2 4.03Å; V81-T92 CarbonylContact O-C 3.52Å; V81-T92 VanDerWaalsContact O-CA 3.26Å; V81-T92 WeakPolarHBondContact O-CA 3.45Å; T82-T92 PolarHBondContact OG1-OG1 3.38Å
93	I	89	Confident	86.6	Confident	18 Å²	18	57.5 Å²	57.5	9%	0.092	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.1	176.8	-60.6	-171.6	0	0	0	108.2	A80 V81 Q91 V95 D107 V108	A80-I93 WeakPolarHBondContact CA-O 3.37Å; V81-I93 HydrophobicContact CG1-CB 4.07Å; V81-I93 PolarHBondContact N-O 3.06Å; V81-I93 PolarHBondContact O-N 3.5Å; Q91-I93 HydrophobicContact CG-CD1 4.39Å; Q91-I93 HydrophobicContact CG-CG1 4.09Å; I93-V95 HydrophobicContact CG2-CG1 4.13Å; I93-D107 HydrophobicContact CD1-CB 3.87Å; I93-V108 HydrophobicContact CD1-CB 4.46Å; I93-V108 HydrophobicContact CD1-CG2 3.49Å; I93-V108 VanDerWaalsContact CD1-CG2 3.49Å; I93-V108 HydrophobicContact CG1-CG2 4.42Å
94	K	89.1	Confident	86.4	Confident	189 Å²	189	57.5 Å²	57.5	82%	0.822	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.5	170.2	-63.7	-175	179.2	-176.4	0	108.3
95	V	88.4	Confident	86.3	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.1	-177.6	-67.8	0	0	0	0	110.5	S79 V81 I93 T99 V104 W134	S79-V95 PolarHBondContact N-O 3.2Å; S79-V95 WeakPolarHBondContact O-CG2 3.49Å; S79-V95 PolarHBondContact O-N 2.96Å; V81-V95 HydrophobicContact CB-CG2 4.47Å; V81-V95 HydrophobicContact CG1-CG1 3.8Å; V81-V95 HydrophobicContact CG1-CG2 4.26Å; I93-V95 HydrophobicContact CG2-CG1 4.13Å; V95-T99 HydrophobicContact CG1-CG2 4.45Å; V95-V104 HydrophobicContact CG1-CG1 4.32Å; V95-V104 HydrophobicContact CG1-CG2 3.6Å; V95-W134 HydrophobicContact CB-CD2 4.37Å; V95-W134 HydrophobicContact CB-CG 4.49Å; V95-W134 HydrophobicContact CG2-CD2 3.53Å; V95-W134 HydrophobicContact CG2-CE3 3.81Å; V95-W134 HydrophobicContact CG2-CG 3.94Å; V95-W134 HydrophobicContact CG2-CH2 4.33Å; V95-W134 HydrophobicContact CG2-CZ2 4.07Å; V95-W134 HydrophobicContact CG2-CZ3 4.19Å
96	A	85.4	Confident	86.3	Confident	51 Å²	51	56.9 Å²	56.9	42%	0.421	30%	0.296	S	S	.	.			trans	-87.3	154.8	171.4	0	0	0	0	0	109.2	N98 T99	A96-N98 PolarHBondContact O-N 3.33Å; A96-T99 PolarHBondContact N-OG1 3.18Å; A96-T99 WeakPolarHBondContact O-CB 3.46Å; A96-T99 PolarHBondContact O-N 2.9Å; A96-T99 PolarHBondContact O-OG1 3.36Å
97	P	82.4	Confident	86.5	Confident	57 Å²	57	55.6 Å²	55.6	37%	0.37	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-12.6	-178.2	-25.5	36.3	0	0	0	115.8	R135	P97-R135 HydrophobicContact CB-CB 4.25Å; P97-R135 WeakPolarHBondContact O-CB 3.25Å; P97-R135 WeakPolarHBondContact O-CG 3.3Å; P97-R135 PolarHBondContact O-N 2.77Å; P97-R135 PolarHBondContact O-NE 3.16Å
98	N	82.4	Confident	86.8	Confident	39 Å²	39	52.4 Å²	52.4	21%	0.209	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-15.8	169.7	-81.7	-7	0	0	0	113.6	A96 P133 R135 D212	A96-N98 PolarHBondContact O-N 3.33Å; N98-P133 VanDerWaalsContact O-CB 3.26Å; N98-P133 WeakPolarHBondContact O-CB 3.29Å; N98-R135 PolarHBondContact OD1-NH1 2.69Å; N98-R135 PolarHBondContact OD1-NH2 2.72Å; N98-D212 WeakPolarHBondContact CB-OD2 3.42Å; N98-D212 PolarHBondContact ND2-OD1 2.88Å; N98-D212 PolarHBondContact ND2-OD2 3.46Å; N98-D212 VanDerWaalsContact ND2-OD2 3.16Å
99	T	85.3	Confident	87.1	Confident	23 Å²	23	49.8 Å²	49.8	14%	0.141	24%	0.241	C	C	.	.			trans	-59.3	122.9	-171.6	-58.6	0	0	0	0	111.1	V95 A96 Q103 V104 P133 W134	V95-T99 HydrophobicContact CG1-CG2 4.45Å; A96-T99 PolarHBondContact N-OG1 3.18Å; A96-T99 WeakPolarHBondContact O-CB 3.46Å; A96-T99 PolarHBondContact O-N 2.9Å; A96-T99 PolarHBondContact O-OG1 3.36Å; T99-Q103 HydrophobicContact CG2-CB 4.19Å; T99-Q103 HydrophobicContact CG2-CG 4.35Å; T99-V104 HydrophobicContact CG2-CG2 3.97Å; T99-P133 WeakPolarHBondContact O-CA 3.37Å; T99-W134 PolarHBondContact O-N 3.43Å
100	P	85.9	Confident	87.1	Confident	18 Å²	18	48.5 Å²	48.5	12%	0.117	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-66.1	140.5	177.3	26.3	-32.3	0	0	0	110.7	L102 Q103 V104	P100-L102 PolarHBondContact O-N 3.19Å; P100-Q103 HydrophobicContact CG-CB 3.92Å; P100-Q103 WeakPolarHBondContact O-CB 3.4Å; P100-Q103 PolarHBondContact O-N 2.97Å; P100-V104 PolarHBondContact O-N 3.21Å
101	L	86.8	Confident	86.9	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-28.5	178.4	-79.8	178.9	0	0	0	112.8	Q103 V104 L105 L121 L128 D129 L130 L132 W134 A137 L139	L101-Q103 PolarHBondContact O-N 3.09Å; L101-V104 HydrophobicContact CD2-CG2 4.48Å; L101-V104 WeakPolarHBondContact O-CB 3.39Å; L101-V104 PolarHBondContact O-N 2.95Å; L101-L105 PolarHBondContact O-N 3.42Å; L101-L121 HydrophobicContact CD2-CD1 4.34Å; L101-L128 HydrophobicContact CD1-CB 3.85Å; L101-L128 HydrophobicContact CD1-CD1 4.07Å; L101-L128 HydrophobicContact CD2-CD1 4.49Å; L101-D129 WeakPolarHBondContact CD1-O 3.18Å; L101-L130 HydrophobicContact CB-CD2 4.27Å; L101-L132 WeakPolarHBondContact CG-O 3.47Å; L101-L132 PolarHBondContact N-O 3.48Å; L101-W134 HydrophobicContact CD2-CE3 4.01Å; L101-W134 HydrophobicContact CD2-CZ3 4.31Å; L101-A137 HydrophobicContact CD1-CB 3.66Å; L101-A137 HydrophobicContact CD2-CB 4.41Å; L101-A137 HydrophobicContact CG-CB 4.24Å; L101-L139 HydrophobicContact CD2-CD1 4.18Å
102	L	86.9	Confident	86.6	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-55.5	-45.9	169.2	-178.1	62.3	0	0	0	112.7	P100 V104 L105 E106 L130 K226 T231	P100-L102 PolarHBondContact O-N 3.19Å; L102-V104 VanDerWaalsContact C-N 3.31Å; L102-V104 PolarHBondContact O-N 3.33Å; L102-L105 WeakPolarHBondContact O-CB 3.26Å; L102-L105 PolarHBondContact O-N 3.01Å; L102-E106 WeakPolarHBondContact O-CG 3.44Å; L102-E106 PolarHBondContact O-N 3.3Å; L102-L130 HydrophobicContact CB-CB 4.2Å; L102-L130 HydrophobicContact CD1-CD1 4.17Å; L102-L130 PolarHBondContact N-O 2.99Å; L102-L130 VanDerWaalsContact N-O 3.13Å; L102-K226 HydrophobicContact CD2-CD 4.49Å; L102-K226 HydrophobicContact CD2-CG 3.75Å; L102-T231 HydrophobicContact CD2-CG2 3.83Å
103	Q	86.6	Confident	86.1	Confident	86 Å²	86	46 Å²	46	40%	0.402	25%	0.248	S	C	.	.	H	α-helix	trans	-65	-37.3	177.8	-178.3	-179.2	-2.1	0	0	111.2	T99 P100 L101 L105 E106 D107	T99-Q103 HydrophobicContact CG2-CB 4.19Å; T99-Q103 HydrophobicContact CG2-CG 4.35Å; P100-Q103 HydrophobicContact CG-CB 3.92Å; P100-Q103 WeakPolarHBondContact O-CB 3.4Å; P100-Q103 PolarHBondContact O-N 2.97Å; L101-Q103 PolarHBondContact O-N 3.09Å; Q103-L105 VanDerWaalsContact C-N 3.33Å; Q103-L105 PolarHBondContact O-N 2.95Å; Q103-E106 PolarHBondContact O-N 2.86Å; Q103-D107 WeakPolarHBondContact O-CB 3.46Å; Q103-D107 PolarHBondContact O-N 3.04Å
104	V	88.4	Confident	85.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-42.8	175.2	-173.1	0	0	0	0	111.1	V81 V83 V95 T99 P100 L101 L102 V108 L121	V81-V104 HydrophobicContact CG1-CG1 3.77Å; V83-V104 HydrophobicContact CG2-CG1 4.49Å; V95-V104 HydrophobicContact CG1-CG1 4.32Å; V95-V104 HydrophobicContact CG1-CG2 3.6Å; T99-V104 HydrophobicContact CG2-CG2 3.97Å; P100-V104 PolarHBondContact O-N 3.21Å; L101-V104 HydrophobicContact CD2-CG2 4.48Å; L101-V104 WeakPolarHBondContact O-CB 3.39Å; L101-V104 PolarHBondContact O-N 2.95Å; L102-V104 VanDerWaalsContact C-N 3.31Å; L102-V104 PolarHBondContact O-N 3.33Å; V104-V108 WeakPolarHBondContact O-CG2 3.44Å; V104-V108 PolarHBondContact O-N 2.8Å; V104-L121 HydrophobicContact CB-CD1 4.28Å; V104-L121 HydrophobicContact CG1-CD1 4.35Å
105	L	87.1	Confident	85.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-50.9	174.2	177.3	63.5	0	0	0	111	L101 L102 Q103 D107 V108 C109 H119 L121 L130 M147	L101-L105 PolarHBondContact O-N 3.42Å; L102-L105 WeakPolarHBondContact O-CB 3.26Å; L102-L105 PolarHBondContact O-N 3.01Å; Q103-L105 VanDerWaalsContact C-N 3.33Å; Q103-L105 PolarHBondContact O-N 2.95Å; L105-D107 VanDerWaalsContact C-N 3.3Å; L105-D107 PolarHBondContact O-N 3.26Å; L105-V108 WeakPolarHBondContact O-CB 3.45Å; L105-V108 PolarHBondContact O-N 2.9Å; L105-V108 VanDerWaalsContact O-N 3.14Å; L105-C109 WeakPolarHBondContact O-CB 3.39Å; L105-C109 PolarHBondContact O-N 2.98Å; L105-C109 PolarHBondContact O-SG 2.9Å; L105-C109 VanDerWaalsContact O-SG 3.4Å; L105-H119 HydrophobicContact CD1-CB 4.11Å; L105-H119 WeakPolarHBondContact CD2-O 3.5Å; L105-L121 HydrophobicContact CB-CD1 4.02Å; L105-L121 HydrophobicContact CB-CD2 4.45Å; L105-L121 HydrophobicContact CB-CG 4.07Å; L105-L121 HydrophobicContact CD1-CD2 3.91Å; L105-L121 HydrophobicContact CD1-CG 4.13Å; L105-L130 HydrophobicContact CB-CD2 4.4Å; L105-L130 HydrophobicContact CD2-CD1 3.6Å; L105-L130 HydrophobicContact CD2-CD2 4.19Å; L105-M147 HydrophobicContact CD1-CG 3.84Å; L105-M147 HydrophobicContact CD1-SD 3.59Å; L105-M147 VanDerWaalsContact CD1-SD 3.59Å
106	E	87.4	Confident	84.9	Confident	48 Å²	48	44.6 Å²	44.6	22%	0.224	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-42.8	179.4	-77.6	-168.9	-170	0	0	112.6	L102 Q103 V108 C109 K110 P116	L102-E106 WeakPolarHBondContact O-CG 3.44Å; L102-E106 PolarHBondContact O-N 3.3Å; Q103-E106 PolarHBondContact O-N 2.86Å; E106-V108 VanDerWaalsContact C-N 3.28Å; E106-V108 PolarHBondContact O-N 2.92Å; E106-C109 WeakPolarHBondContact O-CB 3.41Å; E106-C109 PolarHBondContact O-N 2.86Å; E106-K110 WeakPolarHBondContact O-CB 3.39Å; E106-K110 WeakPolarHBondContact O-CD 3.37Å; E106-K110 WeakPolarHBondContact O-CG 3.3Å; E106-K110 PolarHBondContact O-N 3.17Å; E106-K110 WeakPolarHBondContact OE2-CE 3.32Å; E106-K110 IonicContact OE2-NZ 2.82Å; E106-K110 PolarHBondContact OE2-NZ 3.26Å; E106-P116 HydrophobicContact CG-CB 4.05Å; E106-P116 HydrophobicContact CG-CG 4.02Å
107	D	88.5	Confident	84.4	Confident	45 Å²	45	45.9 Å²	45.9	24%	0.241	25%	0.248	C	C	.	.	H	α-helix	trans	-76.9	-13.7	-176.7	-68.3	-8.9	0	0	0	113.3	I93 Q103 L105 K110 K111	I93-D107 HydrophobicContact CD1-CB 3.87Å; Q103-D107 WeakPolarHBondContact O-CB 3.46Å; Q103-D107 PolarHBondContact O-N 3.04Å; L105-D107 VanDerWaalsContact C-N 3.3Å; L105-D107 PolarHBondContact O-N 3.26Å; D107-K110 IonicContact OD1-NZ 2.8Å; D107-K110 PolarHBondContact OD1-NZ 2.89Å; D107-K111 WeakPolarHBondContact O-CD 3.23Å; D107-K111 WeakPolarHBondContact O-CG 3.48Å
108	V	88.1	Confident	84.2	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-80.5	-49.5	162.1	176.2	0	0	0	0	110.4	V83 T85 Q91 I93 V104 L105 E106 K110 K111 H112 M147	V83-V108 HydrophobicContact CB-CG1 4.46Å; V83-V108 HydrophobicContact CB-CG2 3.75Å; V83-V108 HydrophobicContact CG1-CG1 4.35Å; V83-V108 HydrophobicContact CG1-CG2 4.17Å; V83-V108 HydrophobicContact CG2-CG2 3.68Å; T85-V108 HydrophobicContact CG2-CG1 3.19Å; Q91-V108 HydrophobicContact CB-CG1 4.48Å; Q91-V108 HydrophobicContact CB-CG2 4.49Å; Q91-V108 HydrophobicContact CG-CG2 4.39Å; I93-V108 HydrophobicContact CD1-CB 4.46Å; I93-V108 HydrophobicContact CD1-CG2 3.49Å; I93-V108 VanDerWaalsContact CD1-CG2 3.49Å; I93-V108 HydrophobicContact CG1-CG2 4.42Å; V104-V108 WeakPolarHBondContact O-CG2 3.44Å; V104-V108 PolarHBondContact O-N 2.8Å; L105-V108 WeakPolarHBondContact O-CB 3.45Å; L105-V108 PolarHBondContact O-N 2.9Å; L105-V108 VanDerWaalsContact O-N 3.14Å; E106-V108 VanDerWaalsContact C-N 3.28Å; E106-V108 PolarHBondContact O-N 2.92Å; V108-K110 PolarHBondContact O-N 3.03Å; V108-K111 PolarHBondContact O-N 2.99Å; V108-H112 PolarHBondContact O-N 3.26Å; V108-H112 VanDerWaalsContact O-N 3.17Å; V108-M147 HydrophobicContact CG1-SD 4.09Å
109	C	86.4	Confident	84.2	Confident	2 Å²	2	46 Å²	46	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-53.9	-50.8	-180	-82	0	0	0	0	112.3	L105 E106 K111 H112 G113 F114 P116	L105-C109 WeakPolarHBondContact O-CB 3.39Å; L105-C109 PolarHBondContact O-N 2.98Å; L105-C109 PolarHBondContact O-SG 2.9Å; L105-C109 VanDerWaalsContact O-SG 3.4Å; E106-C109 WeakPolarHBondContact O-CB 3.41Å; E106-C109 PolarHBondContact O-N 2.86Å; C109-K111 PolarHBondContact O-N 3.3Å; C109-K111 VanDerWaalsContact O-N 3.17Å; C109-H112 PolarHBondContact O-N 3.47Å; C109-G113 PolarHBondContact O-N 3.48Å; C109-F114 WeakPolarHBondContact CB-O 3.43Å; C109-F114 PolarHBondContact O-N 3.5Å; C109-P116 HydrophobicContact CB-CG 3.84Å
110	K	86.6	Confident	84.2	Confident	132 Å²	132	45.3 Å²	45.3	57%	0.574	24%	0.243	S	C	*	.	H	α-helix	trans	-55.6	-30	175.4	-69.8	160.1	-166	158	0	113.3	E106 D107 V108	E106-K110 WeakPolarHBondContact O-CB 3.39Å; E106-K110 WeakPolarHBondContact O-CD 3.37Å; E106-K110 WeakPolarHBondContact O-CG 3.3Å; E106-K110 PolarHBondContact O-N 3.17Å; E106-K110 WeakPolarHBondContact OE2-CE 3.32Å; E106-K110 IonicContact OE2-NZ 2.82Å; E106-K110 PolarHBondContact OE2-NZ 3.26Å; D107-K110 IonicContact OD1-NZ 2.8Å; D107-K110 PolarHBondContact OD1-NZ 2.89Å; V108-K110 PolarHBondContact O-N 3.03Å
111	K	86.2	Confident	84.4	Confident	127 Å²	127	44.4 Å²	44.4	55%	0.552	24%	0.237	S	C	*	.	H	α-helix	trans	-88.9	-20.2	-178.6	-73.7	-178	179.1	178.6	0	114.7	Q91 D107 V108 C109	Q91-K111 HydrophobicContact CG-CD 4.15Å; D107-K111 WeakPolarHBondContact O-CD 3.23Å; D107-K111 WeakPolarHBondContact O-CG 3.48Å; V108-K111 PolarHBondContact O-N 2.99Å; C109-K111 PolarHBondContact O-N 3.3Å; C109-K111 VanDerWaalsContact O-N 3.17Å
112	H	82.4	Confident	84.4	Confident	48 Å²	48	46.9 Å²	46.9	22%	0.222	25%	0.248	C	C	.	.	H	α-helix	trans	-119.8	-0.1	-175.5	-71.8	-88.8	0	0	0	114.4	N87 R89 V108 C109 F114	N87-H112 PolarHBondContact ND2-CE1 3.23Å; N87-H112 PolarHBondContact ND2-ND1 2.86Å; R89-H112 WeakPolarHBondContact CB-NE2 3.42Å; R89-H112 VanDerWaalsContact CD-NE2 3.26Å; R89-H112 WeakPolarHBondContact CD-NE2 3.26Å; V108-H112 PolarHBondContact O-N 3.26Å; V108-H112 VanDerWaalsContact O-N 3.17Å; C109-H112 PolarHBondContact O-N 3.47Å; H112-F114 HydrophobicContact CB-CD2 3.56Å; H112-F114 HydrophobicContact CB-CE2 3.58Å
113	G	79.3	Confident	84.6	Confident	73 Å²	73	48.3 Å²	48.3	75%	0.753	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	36.3	176.2	0	0	0	0	0	113.8	C109	C109-G113 PolarHBondContact O-N 3.48Å
114	F	83.6	Confident	84.5	Confident	51 Å²	51	51.1 Å²	51.1	22%	0.224	27%	0.267	C	S	.	.			trans	-111.4	144.8	177.5	-64.5	-68.5	0	0	0	111.2	T85 P86 N87 C109 H112 H119 M147	T85-F114 HydrophobicContact CG2-CE2 4.28Å; P86-F114 HydrophobicContact CB-CZ 4.42Å; P86-F114 HydrophobicContact CG-CZ 4.43Å; N87-F114 HydrophobicContact CB-CZ 4.2Å; N87-F114 WeakPolarHBondContact ND2-CE2 3.45Å; C109-F114 WeakPolarHBondContact CB-O 3.43Å; C109-F114 PolarHBondContact O-N 3.5Å; H112-F114 HydrophobicContact CB-CD2 3.56Å; H112-F114 HydrophobicContact CB-CE2 3.58Å; F114-H119 AromaticContact CD1-CE1 3.89Å; F114-H119 AromaticContact CD1-NE2 3.95Å; F114-M147 HydrophobicContact CB-CE 3.81Å; F114-M147 HydrophobicContact CD1-CE 4.32Å; F114-M147 HydrophobicContact CD2-CE 3.37Å; F114-M147 HydrophobicContact CE2-CE 3.93Å; F114-M147 HydrophobicContact CG-CE 3.6Å
115	D	79.9	Confident	84.3	Confident	102 Å²	102	62.1 Å²	62.1	55%	0.545	31%	0.308	S	S	.	.			trans	-75.2	126.3	175.1	-76.2	-69.9	0	0	0	112.5	N117 D118 H119	D115-N117 PolarHBondContact O-N 2.9Å; D115-D118 PolarHBondContact O-N 3.28Å; D115-H119 PolarHBondContact O-ND1 3.49Å
116	P	77.8	Confident	84.2	Confident	28 Å²	28	66.4 Å²	66.4	18%	0.182	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.5	-179.8	-23.8	33.3	0	0	0	115.1	E106 C109	E106-P116 HydrophobicContact CG-CB 4.05Å; E106-P116 HydrophobicContact CG-CG 4.02Å; C109-P116 HydrophobicContact CB-CG 3.84Å
117	N	73.9	Confident	84.1	Confident	77 Å²	77	69.3 Å²	69.3	41%	0.412	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-29	-175.3	-52.6	-47.9	0	0	0	112.9	D115	D115-N117 PolarHBondContact O-N 2.9Å
118	D	79.6	Confident	83.9	Confident	81 Å²	81	68.1 Å²	68.1	43%	0.433	35%	0.349	S	S	.	.	S	Bend	trans	-91.9	2.4	-179.2	-74.6	-34	0	0	0	112.9	D115 T149 S150	D115-D118 PolarHBondContact O-N 3.28Å; D118-T149 CarbonylContact O-C 3.56Å; D118-T149 WeakPolarHBondContact O-CA 3.15Å; D118-S150 PolarHBondContact O-N 2.67Å
119	H	82.5	Confident	83.6	Confident	18 Å²	18	72.4 Å²	72.4	8%	0.083	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	158	-177.1	-65.7	89.3	0	0	0	111.9	L105 F114 D115 M147 V148 Q154	L105-H119 HydrophobicContact CD1-CB 4.11Å; L105-H119 WeakPolarHBondContact CD2-O 3.5Å; F114-H119 AromaticContact CD1-CE1 3.89Å; F114-H119 AromaticContact CD1-NE2 3.95Å; D115-H119 PolarHBondContact O-ND1 3.49Å; H119-M147 HydrophobicContact CB-CE 4.29Å; H119-M147 HydrophobicContact CB-CG 3.99Å; H119-M147 HydrophobicContact CB-SD 4.2Å; H119-M147 VanDerWaalsContact CD2-CE 3.47Å; H119-M147 WeakPolarHBondContact CD2-CE 3.29Å; H119-V148 CarbonylContact C-O 3.48Å; H119-V148 WeakPolarHBondContact CA-O 3.41Å; H119-Q154 PolarHBondContact O-NE2 2.67Å
120	G	85.4	Confident	83.4	Confident	8 Å²	8	73 Å²	73	8%	0.082	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161	173.9	0	0	0	0	0	111	M147 V148	G120-M147 WeakPolarHBondContact O-CA 3.29Å; G120-V148 PolarHBondContact N-O 3.19Å; G120-V148 PolarHBondContact O-N 3.33Å
121	L	88.5	Confident	83.1	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	138.2	176.8	-63	175.1	0	0	0	110.4	V83 L101 V104 L105 L128 L130 L145	V83-L121 HydrophobicContact CG1-CD2 3.8Å; V83-L121 HydrophobicContact CG2-CD2 4.46Å; L101-L121 HydrophobicContact CD2-CD1 4.34Å; V104-L121 HydrophobicContact CB-CD1 4.28Å; V104-L121 HydrophobicContact CG1-CD1 4.35Å; L105-L121 HydrophobicContact CB-CD1 4.02Å; L105-L121 HydrophobicContact CB-CD2 4.45Å; L105-L121 HydrophobicContact CB-CG 4.07Å; L105-L121 HydrophobicContact CD1-CD2 3.91Å; L105-L121 HydrophobicContact CD1-CG 4.13Å; L121-L128 HydrophobicContact CB-CB 4.46Å; L121-L128 HydrophobicContact CB-CD1 4.07Å; L121-L128 WeakPolarHBondContact O-CB 3.29Å; L121-L128 PolarHBondContact O-N 3.39Å; L121-L130 HydrophobicContact CB-CD2 4.3Å; L121-L130 HydrophobicContact CD1-CD2 4.18Å; L121-L130 HydrophobicContact CG-CD2 4.15Å; L121-L145 HydrophobicContact CB-CD1 4.35Å; L121-L145 HydrophobicContact CD1-CD1 4.01Å; L121-L145 HydrophobicContact CD2-CD1 4.4Å; L121-L145 HydrophobicContact CG-CD1 4.49Å
122	K	88.4	Confident	83	Confident	51 Å²	51	65.2 Å²	65.2	22%	0.222	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.7	177.8	173.1	175.9	173.3	-91	0	109.8	Q124 T126 L145 E146 V148	K122-Q124 WeakPolarHBondContact CE-O 3.3Å; K122-Q124 PolarHBondContact NZ-O 2.86Å; K122-T126 CarbonylContact C-O 3.58Å; K122-T126 WeakPolarHBondContact CA-O 3.44Å; K122-L145 WeakPolarHBondContact O-CA 3.46Å; K122-E146 HydrophobicContact CB-CB 4.34Å; K122-E146 PolarHBondContact N-O 3.39Å; K122-E146 IonicContact NZ-OE2 2.63Å; K122-E146 PolarHBondContact NZ-OE2 2.7Å; K122-E146 PolarHBondContact O-N 2.89Å; K122-V148 HydrophobicContact CB-CG2 3.78Å; K122-V148 HydrophobicContact CD-CG2 3.79Å; K122-V148 HydrophobicContact CG-CG2 4.44Å
123	F	89.6	Confident	83.1	Confident	36 Å²	36	63.6 Å²	63.6	16%	0.158	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.8	169.2	-173.8	-121.5	0	0	0	109.6	R125 T126 L128 L139 P140 A143 K144 L145	F123-R125 PolarHBondContact O-N 3.09Å; F123-T126 PolarHBondContact N-O 2.9Å; F123-T126 PolarHBondContact O-N 3.02Å; F123-L128 HydrophobicContact CB-CD1 4.42Å; F123-L128 HydrophobicContact CB-CD2 4.16Å; F123-L128 HydrophobicContact CB-CG 4.45Å; F123-L139 HydrophobicContact CB-CD2 3.69Å; F123-L139 HydrophobicContact CD1-CD2 3.62Å; F123-L139 HydrophobicContact CD2-CD2 4.08Å; F123-L139 HydrophobicContact CE1-CD2 4.25Å; F123-L139 HydrophobicContact CG-CD2 3.52Å; F123-P140 HydrophobicContact CE1-CG 4.31Å; F123-P140 HydrophobicContact CZ-CG 3.77Å; F123-A143 HydrophobicContact CD2-CB 4.45Å; F123-A143 HydrophobicContact CE2-CB 4.04Å; F123-K144 WeakPolarHBondContact CD2-O 3.33Å; F123-L145 HydrophobicContact CB-CD2 3.8Å; F123-L145 HydrophobicContact CD2-CD2 3.85Å; F123-L145 HydrophobicContact CG-CD2 4.15Å
124	Q	85.9	Confident	83.4	Confident	145 Å²	145	60.6 Å²	60.6	68%	0.678	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	-94.7	-178.6	-55.7	178.2	-2.6	0	0	113.3	K122	K122-Q124 WeakPolarHBondContact CE-O 3.3Å; K122-Q124 PolarHBondContact NZ-O 2.86Å
125	R	82.8	Confident	83.5	Confident	233 Å²	233	61.6 Å²	61.6	88%	0.879	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-6.6	177.3	-156	174.4	73.7	149.2	1	113.5	F123	F123-R125 PolarHBondContact O-N 3.09Å
126	T	85.2	Confident	83.8	Confident	90 Å²	90	60.9 Å²	60.9	55%	0.552	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.3	-171.8	-54.8	0	0	0	0	110.5	K122 F123	K122-T126 CarbonylContact C-O 3.58Å; K122-T126 WeakPolarHBondContact CA-O 3.44Å; F123-T126 PolarHBondContact N-O 2.9Å; F123-T126 PolarHBondContact O-N 3.02Å
127	V	84.9	Confident	84	Confident	108 Å²	108	60.1 Å²	60.1	66%	0.655	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	130.4	165.1	-178.4	0	0	0	0	107.7
128	L	84.8	Confident	84.4	Confident	20 Å²	20	63.6 Å²	63.6	11%	0.105	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-85.8	142.7	-176.4	-57.4	176.1	0	0	0	110.8	L101 L121 F123 L130 L139 L145	L101-L128 HydrophobicContact CD1-CB 3.85Å; L101-L128 HydrophobicContact CD1-CD1 4.07Å; L101-L128 HydrophobicContact CD2-CD1 4.49Å; L121-L128 HydrophobicContact CB-CB 4.46Å; L121-L128 HydrophobicContact CB-CD1 4.07Å; L121-L128 WeakPolarHBondContact O-CB 3.29Å; L121-L128 PolarHBondContact O-N 3.39Å; F123-L128 HydrophobicContact CB-CD1 4.42Å; F123-L128 HydrophobicContact CB-CD2 4.16Å; F123-L128 HydrophobicContact CB-CG 4.45Å; L128-L130 PolarHBondContact O-N 3.03Å; L128-L139 HydrophobicContact CD1-CD1 3.93Å; L128-L139 HydrophobicContact CD1-CD2 4.16Å; L128-L139 HydrophobicContact CD2-CD2 4.2Å; L128-L145 HydrophobicContact CD1-CD1 4.09Å; L128-L145 HydrophobicContact CD1-CD2 3.78Å
129	D	82.2	Confident	84.7	Confident	91 Å²	91	60.8 Å²	60.8	49%	0.487	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-78.7	117.1	171.4	-166.7	-32	0	0	0	109.7	L101 T131 L132	L101-D129 WeakPolarHBondContact CD1-O 3.18Å; D129-T131 PolarHBondContact O-N 2.86Å; D129-T131 VanDerWaalsContact OD1-CB 3.31Å; D129-T131 WeakPolarHBondContact OD1-CB 3.17Å; D129-T131 VanDerWaalsContact OD1-CG2 3.3Å; D129-T131 WeakPolarHBondContact OD1-CG2 3.31Å; D129-T131 PolarHBondContact OD1-N 2.79Å; D129-T131 PolarHBondContact OD1-OG1 2.87Å; D129-T131 PolarHBondContact OD2-OG1 3.46Å; D129-L132 HydrophobicContact CB-CD1 4.06Å; D129-L132 HydrophobicContact CB-CG 4.14Å; D129-L132 PolarHBondContact O-N 2.8Å
130	L	82.6	Confident	84.8	Confident	13 Å²	13	63.1 Å²	63.1	7%	0.068	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.5	-178.1	-60	-179.8	0	0	0	113.3	L101 L102 L105 L121 L128 L132	L101-L130 HydrophobicContact CB-CD2 4.27Å; L102-L130 HydrophobicContact CB-CB 4.2Å; L102-L130 HydrophobicContact CD1-CD1 4.17Å; L102-L130 PolarHBondContact N-O 2.99Å; L102-L130 VanDerWaalsContact N-O 3.13Å; L105-L130 HydrophobicContact CB-CD2 4.4Å; L105-L130 HydrophobicContact CD2-CD1 3.6Å; L105-L130 HydrophobicContact CD2-CD2 4.19Å; L121-L130 HydrophobicContact CB-CD2 4.3Å; L121-L130 HydrophobicContact CD1-CD2 4.18Å; L121-L130 HydrophobicContact CG-CD2 4.15Å; L128-L130 PolarHBondContact O-N 3.03Å; L130-L132 VanDerWaalsContact C-N 3.27Å; L130-L132 PolarHBondContact O-N 3.05Å
131	T	79.3	Confident	84.6	Confident	33 Å²	33	68.3 Å²	68.3	20%	0.202	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21.7	175.3	63.9	0	0	0	0	113.2	D129 G229 T231	D129-T131 PolarHBondContact O-N 2.86Å; D129-T131 VanDerWaalsContact OD1-CB 3.31Å; D129-T131 WeakPolarHBondContact OD1-CB 3.17Å; D129-T131 VanDerWaalsContact OD1-CG2 3.3Å; D129-T131 WeakPolarHBondContact OD1-CG2 3.31Å; D129-T131 PolarHBondContact OD1-N 2.79Å; D129-T131 PolarHBondContact OD1-OG1 2.87Å; D129-T131 PolarHBondContact OD2-OG1 3.46Å; T131-G229 WeakPolarHBondContact CA-O 3.4Å; T131-G229 WeakPolarHBondContact CB-O 3.38Å; T131-G229 VanDerWaalsContact CG2-O 3.29Å; T131-G229 WeakPolarHBondContact CG2-O 3.41Å; T131-T231 WeakPolarHBondContact CG2-OG1 3.32Å
132	L	83.4	Confident	84.4	Confident	64 Å²	64	73.4 Å²	73.4	34%	0.335	37%	0.37	S	S	.	.	S	Bend	trans	-81.9	139.3	-174.3	-62.3	176	0	0	0	112.1	L101 D129 L130	L101-L132 WeakPolarHBondContact CG-O 3.47Å; L101-L132 PolarHBondContact N-O 3.48Å; D129-L132 HydrophobicContact CB-CD1 4.06Å; D129-L132 HydrophobicContact CB-CG 4.14Å; D129-L132 PolarHBondContact O-N 2.8Å; L130-L132 VanDerWaalsContact C-N 3.27Å; L130-L132 PolarHBondContact O-N 3.05Å
133	P	85.8	Confident	84.3	Confident	14 Å²	14	71.1 Å²	71.1	9%	0.091	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-74	152.8	166.7	34	-35.9	0	0	0	110.8	N98 T99 R135 F136 A137 M210	N98-P133 VanDerWaalsContact O-CB 3.26Å; N98-P133 WeakPolarHBondContact O-CB 3.29Å; T99-P133 WeakPolarHBondContact O-CA 3.37Å; P133-R135 PolarHBondContact O-N 2.92Å; P133-F136 HydrophobicContact CG-CD2 3.52Å; P133-F136 HydrophobicContact CG-CE2 4.11Å; P133-F136 HydrophobicContact CG-CG 4.43Å; P133-F136 PolarHBondContact O-N 2.66Å; P133-A137 PolarHBondContact O-N 2.93Å; P133-M210 HydrophobicContact CG-SD 4.01Å
134	W	86.3	Confident	84.4	Confident	9 Å²	9	76.9 Å²	76.9	3%	0.034	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-41.4	-46	-173.3	-179.8	-103.2	0	0	0	114.6	S79 V81 V95 T99 L101 F136 A137 L139 A143	S79-W134 PolarHBondContact OG-NE1 2.98Å; V81-W134 HydrophobicContact CB-CH2 3.54Å; V81-W134 HydrophobicContact CB-CZ2 4.41Å; V81-W134 HydrophobicContact CB-CZ3 3.77Å; V81-W134 HydrophobicContact CG1-CZ3 4.31Å; V81-W134 HydrophobicContact CG2-CH2 3.57Å; V81-W134 HydrophobicContact CG2-CZ3 3.69Å; V95-W134 HydrophobicContact CB-CD2 4.37Å; V95-W134 HydrophobicContact CB-CG 4.49Å; V95-W134 HydrophobicContact CG2-CD2 3.53Å; V95-W134 HydrophobicContact CG2-CE3 3.81Å; V95-W134 HydrophobicContact CG2-CG 3.94Å; V95-W134 HydrophobicContact CG2-CH2 4.33Å; V95-W134 HydrophobicContact CG2-CZ2 4.07Å; V95-W134 HydrophobicContact CG2-CZ3 4.19Å; T99-W134 PolarHBondContact O-N 3.43Å; L101-W134 HydrophobicContact CD2-CE3 4.01Å; L101-W134 HydrophobicContact CD2-CZ3 4.31Å; W134-F136 VanDerWaalsContact C-N 3.27Å; W134-F136 PolarHBondContact O-N 3.16Å; W134-A137 WeakPolarHBondContact O-CB 3.19Å; W134-A137 PolarHBondContact O-N 2.83Å; W134-L139 HydrophobicContact CE3-CD1 3.87Å; W134-L139 HydrophobicContact CH2-CB 3.93Å; W134-L139 HydrophobicContact CH2-CD1 3.59Å; W134-L139 HydrophobicContact CH2-CG 4.42Å; W134-L139 HydrophobicContact CZ2-CB 4.05Å; W134-L139 HydrophobicContact CZ2-CD1 4.4Å; W134-L139 HydrophobicContact CZ3-CB 4.4Å; W134-L139 HydrophobicContact CZ3-CD1 3.29Å; W134-L139 HydrophobicContact CZ3-CG 4.48Å; W134-A143 HydrophobicContact CH2-CB 4.23Å
135	R	84.9	Confident	84.6	Confident	72 Å²	72	70.1 Å²	70.1	27%	0.272	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-65.7	-22.1	-177.6	72.2	167.5	67.3	105.7	3.8	115.5	P97 N98 P133	P97-R135 HydrophobicContact CB-CB 4.25Å; P97-R135 WeakPolarHBondContact O-CB 3.25Å; P97-R135 WeakPolarHBondContact O-CG 3.3Å; P97-R135 PolarHBondContact O-N 2.77Å; P97-R135 PolarHBondContact O-NE 3.16Å; N98-R135 PolarHBondContact OD1-NH1 2.69Å; N98-R135 PolarHBondContact OD1-NH2 2.72Å; P133-R135 PolarHBondContact O-N 2.92Å
136	F	85.4	Confident	85	Confident	87 Å²	87	62.6 Å²	62.6	38%	0.382	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-103.2	0.1	-179.6	-58.4	-47.1	0	0	0	112.6	P133 W134 N138 M210	P133-F136 HydrophobicContact CG-CD2 3.52Å; P133-F136 HydrophobicContact CG-CE2 4.11Å; P133-F136 HydrophobicContact CG-CG 4.43Å; P133-F136 PolarHBondContact O-N 2.66Å; W134-F136 VanDerWaalsContact C-N 3.27Å; W134-F136 PolarHBondContact O-N 3.16Å; F136-N138 PolarHBondContact O-N 3.38Å; F136-M210 HydrophobicContact CD2-CE 3.76Å; F136-M210 HydrophobicContact CD2-SD 4.24Å; F136-M210 HydrophobicContact CE2-CE 3.44Å; F136-M210 VanDerWaalsContact CE2-CE 3.44Å; F136-M210 HydrophobicContact CE2-SD 3.98Å; F136-M210 HydrophobicContact CZ-CE 4.43Å
137	A	82.4	Confident	85.1	Confident	12 Å²	12	58.8 Å²	58.8	10%	0.099	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-4.2	173.3	0	0	0	0	0	114	L101 P133 W134 L139	L101-A137 HydrophobicContact CD1-CB 3.66Å; L101-A137 HydrophobicContact CD2-CB 4.41Å; L101-A137 HydrophobicContact CG-CB 4.24Å; P133-A137 PolarHBondContact O-N 2.93Å; W134-A137 WeakPolarHBondContact O-CB 3.19Å; W134-A137 PolarHBondContact O-N 2.83Å; A137-L139 HydrophobicContact CB-CD1 3.79Å; A137-L139 HydrophobicContact CB-CG 3.77Å; A137-L139 PolarHBondContact O-N 2.75Å
138	N	83.2	Confident	85.2	Confident	150 Å²	150	56.4 Å²	56.4	80%	0.802	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	34.6	-174.9	-63	-30.5	0	0	0	113.8	F136	F136-N138 PolarHBondContact O-N 3.38Å
139	L	85.6	Confident	84.9	Confident	22 Å²	22	60 Å²	60	12%	0.115	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-92.1	134.7	-179.6	-65.3	175.6	0	0	0	111.5	L101 F123 L128 W134 A137 A143 L145	L101-L139 HydrophobicContact CD2-CD1 4.18Å; F123-L139 HydrophobicContact CB-CD2 3.69Å; F123-L139 HydrophobicContact CD1-CD2 3.62Å; F123-L139 HydrophobicContact CD2-CD2 4.08Å; F123-L139 HydrophobicContact CE1-CD2 4.25Å; F123-L139 HydrophobicContact CG-CD2 3.52Å; L128-L139 HydrophobicContact CD1-CD1 3.93Å; L128-L139 HydrophobicContact CD1-CD2 4.16Å; L128-L139 HydrophobicContact CD2-CD2 4.2Å; W134-L139 HydrophobicContact CE3-CD1 3.87Å; W134-L139 HydrophobicContact CH2-CB 3.93Å; W134-L139 HydrophobicContact CH2-CD1 3.59Å; W134-L139 HydrophobicContact CH2-CG 4.42Å; W134-L139 HydrophobicContact CZ2-CB 4.05Å; W134-L139 HydrophobicContact CZ2-CD1 4.4Å; W134-L139 HydrophobicContact CZ3-CB 4.4Å; W134-L139 HydrophobicContact CZ3-CD1 3.29Å; W134-L139 HydrophobicContact CZ3-CG 4.48Å; A137-L139 HydrophobicContact CB-CD1 3.79Å; A137-L139 HydrophobicContact CB-CG 3.77Å; A137-L139 PolarHBondContact O-N 2.75Å; L139-A143 HydrophobicContact CB-CB 4.14Å; L139-A143 HydrophobicContact CD2-CB 4.41Å; L139-L145 HydrophobicContact CD1-CD1 4.29Å; L139-L145 HydrophobicContact CD1-CD2 3.97Å; L139-L145 HydrophobicContact CD2-CD2 3.82Å
140	P	83.6	Confident	84.3	Confident	67 Å²	67	57.2 Å²	57.2	44%	0.435	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-69.4	158	173.1	29.5	-34.8	0	0	0	111.6	F123 N142 A143	F123-P140 HydrophobicContact CE1-CG 4.31Å; F123-P140 HydrophobicContact CZ-CG 3.77Å; P140-N142 PolarHBondContact O-N 3.38Å; P140-A143 HydrophobicContact CG-CB 4.14Å; P140-A143 VanDerWaalsContact O-CB 3.29Å; P140-A143 WeakPolarHBondContact O-CB 3.39Å; P140-A143 PolarHBondContact O-N 3.36Å
141	N	82.4	Confident	83.2	Confident	118 Å²	118	63.8 Å²	63.8	63%	0.631	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	134.6	170.7	-78.6	-40.9	0	0	0	110.7	S79 A143	S79-N141 WeakPolarHBondContact CB-OD1 3.3Å; S79-N141 PolarHBondContact OG-OD1 2.68Å; N141-A143 VanDerWaalsContact C-N 3.29Å; N141-A143 PolarHBondContact O-N 3Å
142	N	83.9	Confident	82	Confident	107 Å²	107	71.9 Å²	71.9	57%	0.572	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	29.6	-174.6	-50.3	-65	0	0	0	114.2	A80 P140	A80-N142 WeakPolarHBondContact O-CA 3.35Å; A80-N142 PolarHBondContact O-N 2.65Å; A80-N142 VanDerWaalsContact O-N 3.16Å; P140-N142 PolarHBondContact O-N 3.38Å
143	A	86.4	Confident	80.4	Confident	3 Å²	3	77.1 Å²	77.1	3%	0.025	39%	0.389	C	S	.	.			trans	-51.6	141.2	173.3	0	0	0	0	0	112.4	T82 F123 W134 L139 P140 N141 L145	T82-A143 PolarHBondContact N-O 3.24Å; F123-A143 HydrophobicContact CD2-CB 4.45Å; F123-A143 HydrophobicContact CE2-CB 4.04Å; W134-A143 HydrophobicContact CH2-CB 4.23Å; L139-A143 HydrophobicContact CB-CB 4.14Å; L139-A143 HydrophobicContact CD2-CB 4.41Å; P140-A143 HydrophobicContact CG-CB 4.14Å; P140-A143 VanDerWaalsContact O-CB 3.29Å; P140-A143 WeakPolarHBondContact O-CB 3.39Å; P140-A143 PolarHBondContact O-N 3.36Å; N141-A143 VanDerWaalsContact C-N 3.29Å; N141-A143 PolarHBondContact O-N 3Å; A143-L145 HydrophobicContact CB-CD2 4.49Å
144	K	90.4	Very high	78.9	Confident	157 Å²	157	79.1 Å²	79.1	68%	0.683	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	103.7	173.9	-65.9	171.1	-174.2	167.7	0	107.9	T82 F123	T82-K144 CarbonylContact O-C 3.55Å; T82-K144 VanDerWaalsContact O-CA 3.3Å; T82-K144 WeakPolarHBondContact O-CA 3.49Å; F123-K144 WeakPolarHBondContact CD2-O 3.33Å
145	L	90.8	Very high	76.8	Confident	2 Å²	2	82.7 Å²	82.7	1%	0.01	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	154.5	176.9	-57.3	-174.1	0	0	0	110.4	V81 T82 V83 L84 L121 K122 F123 L128 L139 A143	V81-L145 HydrophobicContact CG2-CD1 3.65Å; V81-L145 HydrophobicContact CG2-CG 3.7Å; T82-L145 PolarHBondContact O-N 3.29Å; V83-L145 CarbonylContact C-O 3.58Å; V83-L145 WeakPolarHBondContact CA-O 3.35Å; V83-L145 HydrophobicContact CG1-CB 4.34Å; V83-L145 HydrophobicContact CG2-CB 4.18Å; V83-L145 HydrophobicContact CG2-CD1 4.38Å; L84-L145 PolarHBondContact N-O 3.26Å; L121-L145 HydrophobicContact CB-CD1 4.35Å; L121-L145 HydrophobicContact CD1-CD1 4.01Å; L121-L145 HydrophobicContact CD2-CD1 4.4Å; L121-L145 HydrophobicContact CG-CD1 4.49Å; K122-L145 WeakPolarHBondContact O-CA 3.46Å; F123-L145 HydrophobicContact CB-CD2 3.8Å; F123-L145 HydrophobicContact CD2-CD2 3.85Å; F123-L145 HydrophobicContact CG-CD2 4.15Å; L128-L145 HydrophobicContact CD1-CD1 4.09Å; L128-L145 HydrophobicContact CD1-CD2 3.78Å; L139-L145 HydrophobicContact CD1-CD1 4.29Å; L139-L145 HydrophobicContact CD1-CD2 3.97Å; L139-L145 HydrophobicContact CD2-CD2 3.82Å; A143-L145 HydrophobicContact CB-CD2 4.49Å
146	E	90.6	Very high	75	Confident	76 Å²	76	82.6 Å²	82.6	36%	0.355	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.2	169.7	-64.4	170.7	163.8	0	0	108	K122 V148	K122-E146 HydrophobicContact CB-CB 4.34Å; K122-E146 PolarHBondContact N-O 3.39Å; K122-E146 IonicContact NZ-OE2 2.63Å; K122-E146 PolarHBondContact NZ-OE2 2.7Å; K122-E146 PolarHBondContact O-N 2.89Å; E146-V148 HydrophobicContact CB-CG2 4.36Å
147	M	88.1	Confident	73.3	Confident	10 Å²	10	82.4 Å²	82.4	5%	0.049	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.9	169.9	-168.7	173.6	95.2	0	0	108.6	V83 L84 T85 P86 L105 V108 F114 H119 G120	V83-M147 HydrophobicContact CG1-CB 3.96Å; L84-M147 PolarHBondContact O-N 2.89Å; T85-M147 HydrophobicContact CG2-CE 4.22Å; T85-M147 HydrophobicContact CG2-SD 4.3Å; P86-M147 VanDerWaalsContact CD-CE 3.45Å; P86-M147 HydrophobicContact CG-CE 4.06Å; L105-M147 HydrophobicContact CD1-CG 3.84Å; L105-M147 HydrophobicContact CD1-SD 3.59Å; L105-M147 VanDerWaalsContact CD1-SD 3.59Å; V108-M147 HydrophobicContact CG1-SD 4.09Å; F114-M147 HydrophobicContact CB-CE 3.81Å; F114-M147 HydrophobicContact CD1-CE 4.32Å; F114-M147 HydrophobicContact CD2-CE 3.37Å; F114-M147 HydrophobicContact CE2-CE 3.93Å; F114-M147 HydrophobicContact CG-CE 3.6Å; H119-M147 HydrophobicContact CB-CE 4.29Å; H119-M147 HydrophobicContact CB-CG 3.99Å; H119-M147 HydrophobicContact CB-SD 4.2Å; H119-M147 VanDerWaalsContact CD2-CE 3.47Å; H119-M147 WeakPolarHBondContact CD2-CE 3.29Å; G120-M147 WeakPolarHBondContact O-CA 3.29Å
148	V	86.4	Confident	72.2	Confident	58 Å²	58	85.9 Å²	85.9	35%	0.352	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.9	-174.1	-173.9	0	0	0	0	108.9	H119 G120 K122 E146 S150	H119-V148 CarbonylContact C-O 3.48Å; H119-V148 WeakPolarHBondContact CA-O 3.41Å; G120-V148 PolarHBondContact N-O 3.19Å; G120-V148 PolarHBondContact O-N 3.33Å; K122-V148 HydrophobicContact CB-CG2 3.78Å; K122-V148 HydrophobicContact CD-CG2 3.79Å; K122-V148 HydrophobicContact CG-CG2 4.44Å; E146-V148 HydrophobicContact CB-CG2 4.36Å; V148-S150 PolarHBondContact O-N 2.87Å
149	T	80	Confident	71.7	Confident	96 Å²	96	80.7 Å²	80.7	59%	0.589	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	127.4	171.2	44	0	0	0	0	110.1	D118 T151	D118-T149 CarbonylContact O-C 3.56Å; D118-T149 WeakPolarHBondContact O-CA 3.15Å; T149-T151 PolarHBondContact O-N 2.88Å
150	S	69.8	Low	71.4	Confident	32 Å²	32	86 Å²	86	22%	0.224	48%	0.476	C	S	.	.			trans	-78.9	105.2	-173	-168.9	0	0	0	0	110.6	D118 V148 R152	D118-S150 PolarHBondContact O-N 2.67Å; V148-S150 PolarHBondContact O-N 2.87Å; S150-R152 WeakPolarHBondContact CB-O 3.41Å; S150-R152 CarbonylContact O-C 3.58Å; S150-R152 PolarHBondContact O-N 2.84Å; S150-R152 PolarHBondContact OG-O 2.96Å
151	T	57.5	Low	71.5	Confident	150 Å²	150	82.9 Å²	82.9	92%	0.92	46%	0.455	S	S	*	.	S	Bend	trans	-59.8	-28.6	173.3	55.3	0	0	0	0	112.3	T149 K153	T149-T151 PolarHBondContact O-N 2.88Å; T151-K153 PolarHBondContact O-N 2.83Å
152	R	54.8	Low	71.6	Confident	204 Å²	204	84.9 Å²	84.9	77%	0.77	45%	0.454	S	S	*	.	S	Bend	trans	-83	99.5	163.7	-170.8	-176.2	-160.9	-169.5	6.1	108.3	S150 Q154	S150-R152 WeakPolarHBondContact CB-O 3.41Å; S150-R152 CarbonylContact O-C 3.58Å; S150-R152 PolarHBondContact O-N 2.84Å; S150-R152 PolarHBondContact OG-O 2.96Å; R152-Q154 PolarHBondContact O-N 2.81Å
153	K	49.9	Very low	71.9	Confident	173 Å²	173	79.8 Å²	79.8	75%	0.752	43%	0.427	S	S	*	.			trans	-51.5	114.7	160	-75.7	-168.7	173.1	-169.4	0	107.5	T151 S155	T151-K153 PolarHBondContact O-N 2.83Å; K153-S155 PolarHBondContact O-N 2.67Å
154	Q	53.4	Low	72	Confident	57 Å²	57	80.4 Å²	80.4	27%	0.266	43%	0.432	S	S	.	.			trans	-65.5	128.8	169.4	-63.6	176.3	33.9	0	0	106	H119 R152 G156	H119-Q154 PolarHBondContact O-NE2 2.67Å; R152-Q154 PolarHBondContact O-N 2.81Å; Q154-G156 PolarHBondContact O-N 2.92Å
155	S	43.2	Very low	71.9	Confident	83 Å²	83	73 Å²	73	58%	0.58	40%	0.4	S	S	*	.			trans	-58.2	115.3	-166.8	-167.6	0	0	0	0	110.3	K153 A157	K153-S155 PolarHBondContact O-N 2.67Å; S155-A157 CarbonylContact O-C 3.57Å; S155-A157 PolarHBondContact O-N 3.17Å
156	G	47.5	Very low	71.9	Confident	71 Å²	71	75.3 Å²	75.3	73%	0.732	41%	0.411	S	S	*	.	S	Bend	trans	-61.6	131.3	165.9	0	0	0	0	0	108	Q154	Q154-G156 PolarHBondContact O-N 2.92Å
157	A	48.5	Very low	71.6	Confident	82 Å²	82	73 Å²	73	68%	0.678	40%	0.4	S	S	*	.	S	Bend	trans	64.1	107	-156.6	0	0	0	0	0	113.5	S155	S155-A157 CarbonylContact O-C 3.57Å; S155-A157 PolarHBondContact O-N 3.17Å
158	D	59.4	Low	71.1	Confident	86 Å²	86	77.7 Å²	77.7	46%	0.46	42%	0.422	S	S	.	.			trans	43.4	87.4	146	-73.7	-52.2	0	0	0	119.5	Q160 S178 S179 G180	D158-Q160 PolarHBondContact O-N 3.23Å; D158-S178 VanDerWaalsContact CG-CB 3.47Å; D158-S178 WeakPolarHBondContact OD1-CB 3.39Å; D158-S179 PolarHBondContact OD1-OG 3.3Å; D158-G180 PolarHBondContact OD1-N 2.95Å
159	S	72.5	Confident	70.6	Confident	40 Å²	40	81 Å²	81	28%	0.28	44%	0.437	S	S	.	.			trans	-54.3	122.4	154.9	-71	0	0	0	0	110.8	S179 T231	S159-S179 PolarHBondContact O-N 3.29Å; S159-T231 WeakPolarHBondContact CB-O 3.39Å; S159-T231 PolarHBondContact OG-O 2.73Å
160	Q	79.4	Confident	70.4	Confident	135 Å²	135	78.1 Å²	78.1	63%	0.631	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	128.6	172.1	-164.4	179.5	17.6	0	0	110.3	D158 S176 F177	D158-Q160 PolarHBondContact O-N 3.23Å; Q160-S176 VanDerWaalsContact NE2-CB 3.35Å; Q160-S176 PolarHBondContact NE2-OG 3.02Å; Q160-F177 WeakPolarHBondContact CA-O 3.31Å
161	V	86	Confident	71	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.5	179.9	-167.6	0	0	0	0	108.9	I163 S176 F177 L230	V161-I163 HydrophobicContact CB-CD1 4.39Å; V161-I163 HydrophobicContact CG1-CD1 3.71Å; V161-S176 WeakPolarHBondContact O-CA 3.38Å; V161-F177 PolarHBondContact N-O 3.06Å; V161-F177 PolarHBondContact O-N 2.99Å; V161-L230 HydrophobicContact CG1-CB 4.46Å; V161-L230 WeakPolarHBondContact CG2-O 3.3Å
162	R	85.3	Confident	72.5	Confident	160 Å²	160	78.2 Å²	78.2	60%	0.604	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	117	169.9	-63.5	-174.4	-60.6	-166.3	-0.8	110.1	G175 G233 S234 A235	R162-G175 CarbonylContact C-O 3.6Å; R162-G175 WeakPolarHBondContact CA-O 3.46Å; R162-G233 PolarHBondContact N-O 3.48Å; R162-G233 VanDerWaalsContact N-O 3.09Å; R162-S234 PolarHBondContact NE-OG 2.86Å; R162-S234 PolarHBondContact NH2-OG 2.84Å; R162-S234 VanDerWaalsContact NH2-OG 3.16Å; R162-S234 CarbonylContact O-C 3.59Å; R162-S234 VanDerWaalsContact O-CA 3.24Å; R162-S234 WeakPolarHBondContact O-CA 3.26Å; R162-A235 PolarHBondContact O-N 3.06Å
163	I	88.9	Confident	73.8	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.9	175	-53.1	-59.6	0	0	0	108.5	V161 Q174 G175 F177 V186 L225 L230 A235 V237	V161-I163 HydrophobicContact CB-CD1 4.39Å; V161-I163 HydrophobicContact CG1-CD1 3.71Å; I163-Q174 WeakPolarHBondContact O-CA 3.16Å; I163-G175 PolarHBondContact N-O 3.12Å; I163-G175 PolarHBondContact O-N 3.08Å; I163-F177 HydrophobicContact CB-CD2 3.74Å; I163-F177 HydrophobicContact CB-CE2 3.96Å; I163-F177 HydrophobicContact CG1-CD2 3.71Å; I163-F177 HydrophobicContact CG1-CE2 4.42Å; I163-F177 HydrophobicContact CG1-CG 4.49Å; I163-V186 HydrophobicContact CB-CG1 4.41Å; I163-V186 HydrophobicContact CG2-CG1 4.14Å; I163-L225 HydrophobicContact CD1-CD1 4.39Å; I163-L225 HydrophobicContact CD1-CD2 3.98Å; I163-L225 HydrophobicContact CG1-CD1 4.12Å; I163-L225 HydrophobicContact CG1-CD2 4.18Å; I163-L230 HydrophobicContact CD1-CD1 3.95Å; I163-A235 HydrophobicContact CD1-CB 4.1Å; I163-V237 HydrophobicContact CG2-CB 4.28Å; I163-V237 HydrophobicContact CG2-CG2 3.93Å
164	A	89	Confident	75.7	Confident	16 Å²	16	68.9 Å²	68.9	13%	0.132	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	101.6	165.1	0	0	0	0	0	108.1	Q166 L173 Q174 A235 I236 V237	A164-Q166 PolarHBondContact O-N 2.87Å; A164-L173 CarbonylContact C-O 3.58Å; A164-L173 WeakPolarHBondContact CA-O 3.41Å; A164-Q174 HydrophobicContact CB-CG 4.13Å; A164-A235 PolarHBondContact N-O 2.91Å; A164-I236 HydrophobicContact CB-CG1 4.29Å; A164-I236 WeakPolarHBondContact O-CA 3.5Å; A164-V237 PolarHBondContact O-N 3.45Å
165	L	88.4	Confident	77.2	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	113.1	176.1	-166.8	64.2	0	0	0	108.5	R172 L173 I187 F190 I193 V237 F239	L165-R172 WeakPolarHBondContact O-CA 3.34Å; L165-L173 PolarHBondContact N-O 3.47Å; L165-L173 PolarHBondContact O-N 3.04Å; L165-I187 HydrophobicContact CD2-CG1 4.45Å; L165-F190 HydrophobicContact CB-CD2 4.42Å; L165-F190 HydrophobicContact CB-CE2 3.94Å; L165-F190 HydrophobicContact CD2-CD2 3.68Å; L165-F190 HydrophobicContact CD2-CE2 3.94Å; L165-I193 HydrophobicContact CD2-CD1 3.51Å; L165-V237 CarbonylContact C-O 3.49Å; L165-V237 WeakPolarHBondContact CA-O 3.48Å; L165-V237 HydrophobicContact CD1-CB 4.1Å; L165-V237 HydrophobicContact CD1-CG1 4.07Å; L165-F239 HydrophobicContact CD1-CB 4.05Å; L165-F239 HydrophobicContact CG-CB 4.24Å
166	Q	90.1	Very high	79.2	Confident	51 Å²	51	65.8 Å²	65.8	24%	0.238	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.8	177	-175	175	8	0	0	109.9	A164 S171 R172 I236 V237 R238 F239	A164-Q166 PolarHBondContact O-N 2.87Å; Q166-S171 WeakPolarHBondContact CA-O 3.42Å; Q166-R172 HydrophobicContact CB-CG 4.41Å; Q166-R172 HydrophobicContact CG-CG 4.31Å; Q166-I236 HydrophobicContact CB-CG2 4.41Å; Q166-V237 PolarHBondContact N-O 2.86Å; Q166-R238 WeakPolarHBondContact O-CA 3.49Å; Q166-F239 PolarHBondContact O-N 3.45Å
167	M	84.6	Confident	81.1	Confident	27 Å²	27	62.5 Å²	62.5	13%	0.133	33%	0.333	C	S	.	.			trans	-86.6	170.6	179.4	-64.2	-63.3	-70	0	0	111.6	D169 G170 S171 L173 I193 F239	M167-D169 VanDerWaalsContact C-N 3.32Å; M167-D169 WeakPolarHBondContact CB-OD1 3.24Å; M167-D169 PolarHBondContact O-N 2.8Å; M167-G170 PolarHBondContact O-N 3.27Å; M167-S171 WeakPolarHBondContact CB-OG 3.34Å; M167-S171 PolarHBondContact N-O 3.38Å; M167-L173 HydrophobicContact CG-CD1 4.07Å; M167-L173 HydrophobicContact CG-CG 4.25Å; M167-L173 HydrophobicContact SD-CD1 4.25Å; M167-I193 HydrophobicContact CE-CD1 4.22Å; M167-I193 HydrophobicContact CE-CG1 3.84Å; M167-I193 HydrophobicContact SD-CD1 3.72Å; M167-I193 HydrophobicContact SD-CG1 3.94Å; M167-F239 HydrophobicContact CE-CD1 3.98Å; M167-F239 HydrophobicContact CE-CE1 4.41Å; M167-F239 HydrophobicContact SD-CB 4.35Å; M167-F239 HydrophobicContact SD-CD1 3.81Å
168	E	77.9	Confident	82.8	Confident	109 Å²	109	60.3 Å²	60.3	51%	0.509	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.7	-178.2	-62.4	-172.8	130.7	0	0	113.7	G170 L240 H241	E168-G170 PolarHBondContact O-N 3.04Å; E168-L240 HydrophobicContact CG-CD2 4.26Å; E168-L240 WeakPolarHBondContact OE1-CA 3.36Å; E168-H241 PolarHBondContact OE1-N 2.89Å; E168-H241 IonicContact OE2-CE1 3.65Å; E168-H241 IonicContact OE2-CG 3.74Å; E168-H241 IonicContact OE2-ND1 3.88Å; E168-H241 PolarHBondContact OE2-ND1 2.8Å
169	D	76.1	Confident	83.8	Confident	126 Å²	126	56.8 Å²	56.8	67%	0.674	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-2.8	170	70.6	-14.8	0	0	0	113.2	M167 S171	M167-D169 VanDerWaalsContact C-N 3.32Å; M167-D169 WeakPolarHBondContact CB-OD1 3.24Å; M167-D169 PolarHBondContact O-N 2.8Å; D169-S171 VanDerWaalsContact C-N 3.29Å; D169-S171 PolarHBondContact O-N 3.39Å; D169-S171 WeakPolarHBondContact OD1-CB 3.49Å; D169-S171 PolarHBondContact OD1-N 3.49Å; D169-S171 PolarHBondContact OD1-OG 2.84Å; D169-S171 WeakPolarHBondContact OD2-CB 3.26Å; D169-S171 PolarHBondContact OD2-OG 2.99Å
170	G	75.5	Confident	84.2	Confident	37 Å²	37	56.9 Å²	56.9	38%	0.381	30%	0.302	S	S	.	.	S	Bend	trans	83.3	-4.1	-176.4	0	0	0	0	0	114.8	M167 E168	M167-G170 PolarHBondContact O-N 3.27Å; E168-G170 PolarHBondContact O-N 3.04Å
171	S	83.4	Confident	84.5	Confident	40 Å²	40	52.7 Å²	52.7	28%	0.28	28%	0.282	S	S	.	.			trans	-64.5	159.8	175.1	73.4	0	0	0	0	111.6	Q166 M167 D169	Q166-S171 WeakPolarHBondContact CA-O 3.42Å; M167-S171 WeakPolarHBondContact CB-OG 3.34Å; M167-S171 PolarHBondContact N-O 3.38Å; D169-S171 VanDerWaalsContact C-N 3.29Å; D169-S171 PolarHBondContact O-N 3.39Å; D169-S171 WeakPolarHBondContact OD1-CB 3.49Å; D169-S171 PolarHBondContact OD1-N 3.49Å; D169-S171 PolarHBondContact OD1-OG 2.84Å; D169-S171 WeakPolarHBondContact OD2-CB 3.26Å; D169-S171 PolarHBondContact OD2-OG 2.99Å
172	R	87.7	Confident	84.5	Confident	143 Å²	143	53 Å²	53	54%	0.54	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	104	-174.7	-65.8	-175.9	-179.2	-173	-0.8	111	L165 Q166	L165-R172 WeakPolarHBondContact O-CA 3.34Å; Q166-R172 HydrophobicContact CB-CG 4.41Å; Q166-R172 HydrophobicContact CG-CG 4.31Å
173	L	83.7	Confident	84.6	Confident	27 Å²	27	45.6 Å²	45.6	14%	0.141	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.7	177.3	-51.5	-179.2	0	0	0	108.7	A164 L165 M167 F190 M192	A164-L173 CarbonylContact C-O 3.58Å; A164-L173 WeakPolarHBondContact CA-O 3.41Å; L165-L173 PolarHBondContact N-O 3.47Å; L165-L173 PolarHBondContact O-N 3.04Å; M167-L173 HydrophobicContact CG-CD1 4.07Å; M167-L173 HydrophobicContact CG-CG 4.25Å; M167-L173 HydrophobicContact SD-CD1 4.25Å; L173-F190 HydrophobicContact CB-CD1 3.71Å; L173-F190 HydrophobicContact CB-CD2 4.35Å; L173-F190 HydrophobicContact CB-CE1 3.64Å; L173-F190 HydrophobicContact CB-CE2 4.28Å; L173-F190 HydrophobicContact CB-CG 4.07Å; L173-F190 HydrophobicContact CB-CZ 3.93Å; L173-F190 HydrophobicContact CD1-CB 3.85Å; L173-F190 HydrophobicContact CD1-CD1 4.12Å; L173-F190 HydrophobicContact CD1-CD2 4.5Å; L173-F190 HydrophobicContact CD1-CG 3.91Å; L173-F190 HydrophobicContact CG-CD1 4.49Å; L173-M192 HydrophobicContact CD1-CB 4.17Å; L173-M192 HydrophobicContact CD2-SD 3.78Å
174	Q	89.1	Confident	84.3	Confident	155 Å²	155	47.5 Å²	47.5	72%	0.724	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	131.2	-178.2	-62.4	-174.6	36.4	0	0	110.4	I163 A164	I163-Q174 WeakPolarHBondContact O-CA 3.16Å; A164-Q174 HydrophobicContact CB-CG 4.13Å
175	G	84.4	Confident	84.1	Confident	13 Å²	13	50.8 Å²	50.8	13%	0.134	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	162.8	175.3	0	0	0	0	0	111.6	R162 I163 F177	R162-G175 CarbonylContact C-O 3.6Å; R162-G175 WeakPolarHBondContact CA-O 3.46Å; I163-G175 PolarHBondContact N-O 3.12Å; I163-G175 PolarHBondContact O-N 3.08Å; G175-F177 VanDerWaalsContact C-CE2 3.44Å
176	S	86.8	Confident	84	Confident	61 Å²	61	50.9 Å²	50.9	43%	0.427	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.7	174	68.6	0	0	0	0	109.8	Q160 V161	Q160-S176 VanDerWaalsContact NE2-CB 3.35Å; Q160-S176 PolarHBondContact NE2-OG 3.02Å; V161-S176 WeakPolarHBondContact O-CA 3.38Å
177	F	86.6	Confident	83.7	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	153	-170.4	-60.6	-80.6	0	0	0	109.7	Q160 V161 I163 G175 Q181 V186 H189 F190 L225	Q160-F177 WeakPolarHBondContact CA-O 3.31Å; V161-F177 PolarHBondContact N-O 3.06Å; V161-F177 PolarHBondContact O-N 2.99Å; I163-F177 HydrophobicContact CB-CD2 3.74Å; I163-F177 HydrophobicContact CB-CE2 3.96Å; I163-F177 HydrophobicContact CG1-CD2 3.71Å; I163-F177 HydrophobicContact CG1-CE2 4.42Å; I163-F177 HydrophobicContact CG1-CG 4.49Å; G175-F177 VanDerWaalsContact C-CE2 3.44Å; F177-Q181 VanDerWaalsContact CA-OE1 3.28Å; F177-V186 HydrophobicContact CB-CG2 4.26Å; F177-V186 HydrophobicContact CD1-CB 4.37Å; F177-V186 HydrophobicContact CD1-CG2 3.81Å; F177-V186 HydrophobicContact CD2-CG1 4.18Å; F177-V186 HydrophobicContact CD2-CG2 4.31Å; F177-V186 HydrophobicContact CE1-CB 4.27Å; F177-V186 HydrophobicContact CE1-CG1 4.23Å; F177-V186 HydrophobicContact CE1-CG2 4.22Å; F177-V186 HydrophobicContact CE2-CG1 3.86Å; F177-V186 HydrophobicContact CG-CG1 4.48Å; F177-V186 HydrophobicContact CG-CG2 3.86Å; F177-V186 HydrophobicContact CZ-CB 4.43Å; F177-V186 HydrophobicContact CZ-CG1 3.89Å; F177-H189 HydrophobicContact CE1-CB 3.68Å; F177-H189 AromaticContact CE1-CG 3.63Å; F177-H189 AromaticContact CE1-ND1 4Å; F177-H189 HydrophobicContact CZ-CB 4.17Å; F177-H189 AromaticContact CZ-ND1 3.96Å; F177-F190 HydrophobicContact CE2-CE2 4.11Å; F177-F190 AromaticContact CE2-CZ 4Å; F177-F190 HydrophobicContact CE2-CZ 4Å; F177-F190 AromaticContact CZ-CE2 3.7Å; F177-F190 HydrophobicContact CZ-CE2 3.7Å; F177-F190 AromaticContact CZ-CZ 3.75Å; F177-F190 HydrophobicContact CZ-CZ 3.75Å; F177-L225 HydrophobicContact CB-CD1 3.65Å
178	S	84.5	Confident	83.5	Confident	36 Å²	36	50.1 Å²	50.1	25%	0.252	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	146.3	173.7	53.7	0	0	0	0	111.4	D158 G180 Q181	D158-S178 VanDerWaalsContact CG-CB 3.47Å; D158-S178 WeakPolarHBondContact OD1-CB 3.39Å; S178-G180 PolarHBondContact O-N 3.3Å; S178-Q181 PolarHBondContact O-N 3.41Å; S178-Q181 WeakPolarHBondContact OG-CG 3.36Å; S178-Q181 PolarHBondContact OG-OE1 3.48Å
179	S	80.4	Confident	83.5	Confident	12 Å²	12	50.3 Å²	50.3	8%	0.084	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23.6	-178.1	58.5	0	0	0	0	114.6	D158 S159 K226	D158-S179 PolarHBondContact OD1-OG 3.3Å; S159-S179 PolarHBondContact O-N 3.29Å; S179-K226 VanDerWaalsContact O-CB 3.28Å; S179-K226 WeakPolarHBondContact O-CB 3.26Å; S179-K226 PolarHBondContact O-N 2.82Å
180	G	80.8	Confident	83.7	Confident	42 Å²	42	45.2 Å²	45.2	43%	0.433	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-21.2	174.7	0	0	0	0	0	116	D158 S178 T224	D158-G180 PolarHBondContact OD1-N 2.95Å; S178-G180 PolarHBondContact O-N 3.3Å; G180-T224 VanDerWaalsContact O-CG2 3.3Å; G180-T224 WeakPolarHBondContact O-CG2 3.4Å
181	Q	84.9	Confident	83.1	Confident	47 Å²	47	49.2 Å²	49.2	22%	0.22	28%	0.275	C	S	.	.			trans	-69.6	146.3	-171.7	-65.6	-177.2	-74.4	0	0	113	F177 S178 E185 T224 L225	F177-Q181 VanDerWaalsContact CA-OE1 3.28Å; S178-Q181 PolarHBondContact O-N 3.41Å; S178-Q181 WeakPolarHBondContact OG-CG 3.36Å; S178-Q181 PolarHBondContact OG-OE1 3.48Å; Q181-E185 HydrophobicContact CB-CB 4.39Å; Q181-E185 WeakPolarHBondContact CG-OE2 3.4Å; Q181-T224 CarbonylContact O-C 3.58Å; Q181-T224 VanDerWaalsContact O-CA 3.26Å; Q181-T224 WeakPolarHBondContact O-CA 3.45Å; Q181-L225 PolarHBondContact O-N 2.9Å
182	S	87.3	Confident	81.9	Confident	7 Å²	7	54.3 Å²	54.3	5%	0.049	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-71.9	155.4	171.2	67.2	0	0	0	0	112.2	W184 E185 V186 K221 T223	S182-W184 PolarHBondContact O-N 2.86Å; S182-E185 VanDerWaalsContact CB-OE1 3.23Å; S182-E185 WeakPolarHBondContact CB-OE1 3.32Å; S182-E185 PolarHBondContact N-OE1 3.13Å; S182-E185 PolarHBondContact O-N 3.09Å; S182-E185 WeakPolarHBondContact OG-CG 3.37Å; S182-E185 PolarHBondContact OG-N 2.87Å; S182-E185 VanDerWaalsContact OG-N 3.17Å; S182-E185 PolarHBondContact OG-OE1 3.1Å; S182-V186 WeakPolarHBondContact O-CG2 3.43Å; S182-V186 PolarHBondContact O-N 3.32Å; S182-K221 VanDerWaalsContact CB-O 3.32Å; S182-K221 WeakPolarHBondContact CB-O 3.45Å; S182-T223 WeakPolarHBondContact CA-O 3.35Å
183	L	86	Confident	80.7	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-57.7	-32.4	169.5	-74.7	-176.3	0	0	0	111.7	V186 I187 C207 V214 L220 T223 L225 L228	L183-V186 PolarHBondContact O-N 2.96Å; L183-I187 WeakPolarHBondContact O-CD1 3.41Å; L183-I187 VanDerWaalsContact O-CG1 3.26Å; L183-I187 WeakPolarHBondContact O-CG1 3.35Å; L183-I187 PolarHBondContact O-N 3.43Å; L183-C207 HydrophobicContact CD1-CB 3.78Å; L183-V214 HydrophobicContact CD1-CB 4.23Å; L183-V214 HydrophobicContact CD1-CG2 4.17Å; L183-L220 HydrophobicContact CB-CB 4.41Å; L183-L220 HydrophobicContact CB-CD2 3.83Å; L183-L220 HydrophobicContact CD1-CD2 3.79Å; L183-L220 PolarHBondContact N-O 2.87Å; L183-T223 PolarHBondContact N-O 3.17Å; L183-L225 HydrophobicContact CD2-CD2 3.99Å; L183-L228 HydrophobicContact CD1-CD1 3.77Å; L183-L228 HydrophobicContact CD2-CD1 3.76Å; L183-L228 HydrophobicContact CG-CD1 3.82Å
184	W	84.3	Confident	79.5	Confident	42 Å²	42	54.4 Å²	54.4	16%	0.159	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-42.5	175.6	-170.6	-101.6	0	0	0	113.2	S182 I187 A188 V195 P205 E217 L220 K221	S182-W184 PolarHBondContact O-N 2.86Å; W184-I187 PolarHBondContact O-N 3.33Å; W184-A188 WeakPolarHBondContact O-CB 3.28Å; W184-A188 PolarHBondContact O-N 3.21Å; W184-V195 HydrophobicContact CH2-CG1 3.59Å; W184-V195 HydrophobicContact CZ2-CG1 3.56Å; W184-P205 HydrophobicContact CZ3-CG 4.06Å; W184-E217 HydrophobicContact CD2-CG 4.17Å; W184-E217 HydrophobicContact CE3-CB 4.32Å; W184-E217 HydrophobicContact CE3-CG 3.96Å; W184-E217 HydrophobicContact CH2-CB 3.95Å; W184-E217 VanDerWaalsContact CH2-CD 3.4Å; W184-E217 HydrophobicContact CH2-CG 3.49Å; W184-E217 VanDerWaalsContact CH2-CG 3.49Å; W184-E217 VanDerWaalsContact CZ2-CD 3.44Å; W184-E217 HydrophobicContact CZ2-CG 3.72Å; W184-E217 VanDerWaalsContact CZ2-OE1 3.3Å; W184-E217 WeakPolarHBondContact CZ2-OE1 3.47Å; W184-E217 HydrophobicContact CZ3-CB 3.78Å; W184-E217 HydrophobicContact CZ3-CG 3.63Å; W184-L220 HydrophobicContact CB-CB 4.3Å; W184-L220 HydrophobicContact CE3-CB 4.12Å; W184-L220 HydrophobicContact CE3-CD1 4.19Å; W184-L220 HydrophobicContact CZ3-CD1 4.43Å; W184-L220 PolarHBondContact N-O 2.94Å; W184-L220 VanDerWaalsContact N-O 3.09Å; W184-K221 HydrophobicContact CB-CB 4.43Å; W184-K221 HydrophobicContact CB-CG 3.6Å; W184-K221 HydrophobicContact CD2-CG 4.19Å; W184-K221 HydrophobicContact CG-CD 4.4Å; W184-K221 HydrophobicContact CG-CG 3.57Å
185	E	84.6	Confident	77.7	Confident	85 Å²	85	48.9 Å²	48.9	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-66	-38.9	174.5	-71.1	154.5	-104.5	0	0	112.2	Q181 S182 I187 A188 H189	Q181-E185 HydrophobicContact CB-CB 4.39Å; Q181-E185 WeakPolarHBondContact CG-OE2 3.4Å; S182-E185 VanDerWaalsContact CB-OE1 3.23Å; S182-E185 WeakPolarHBondContact CB-OE1 3.32Å; S182-E185 PolarHBondContact N-OE1 3.13Å; S182-E185 PolarHBondContact O-N 3.09Å; S182-E185 WeakPolarHBondContact OG-CG 3.37Å; S182-E185 PolarHBondContact OG-N 2.87Å; S182-E185 VanDerWaalsContact OG-N 3.17Å; S182-E185 PolarHBondContact OG-OE1 3.1Å; E185-I187 VanDerWaalsContact C-N 3.29Å; E185-I187 PolarHBondContact O-N 3.14Å; E185-A188 PolarHBondContact O-N 2.83Å; E185-H189 WeakPolarHBondContact O-CB 3.06Å; E185-H189 PolarHBondContact O-N 3.38Å
186	V	85.4	Confident	76	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-39.3	175.7	174.7	0	0	0	0	111.2	I163 F177 S182 L183 F190 L225	I163-V186 HydrophobicContact CB-CG1 4.41Å; I163-V186 HydrophobicContact CG2-CG1 4.14Å; F177-V186 HydrophobicContact CB-CG2 4.26Å; F177-V186 HydrophobicContact CD1-CB 4.37Å; F177-V186 HydrophobicContact CD1-CG2 3.81Å; F177-V186 HydrophobicContact CD2-CG1 4.18Å; F177-V186 HydrophobicContact CD2-CG2 4.31Å; F177-V186 HydrophobicContact CE1-CB 4.27Å; F177-V186 HydrophobicContact CE1-CG1 4.23Å; F177-V186 HydrophobicContact CE1-CG2 4.22Å; F177-V186 HydrophobicContact CE2-CG1 3.86Å; F177-V186 HydrophobicContact CG-CG1 4.48Å; F177-V186 HydrophobicContact CG-CG2 3.86Å; F177-V186 HydrophobicContact CZ-CB 4.43Å; F177-V186 HydrophobicContact CZ-CG1 3.89Å; S182-V186 WeakPolarHBondContact O-CG2 3.43Å; S182-V186 PolarHBondContact O-N 3.32Å; L183-V186 PolarHBondContact O-N 2.96Å; V186-F190 WeakPolarHBondContact O-CD2 3.4Å; V186-F190 WeakPolarHBondContact O-CE2 3.2Å; V186-L225 HydrophobicContact CG2-CD1 3.96Å; V186-L225 HydrophobicContact CG2-CD2 4.28Å; V186-L225 HydrophobicContact CG2-CG 4.25Å
187	I	83.5	Confident	74	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-53	173.8	-66.5	159.4	0	0	0	110.4	L165 L183 W184 E185 H189 F190 I193 V195 L220 F239	L165-I187 HydrophobicContact CD2-CG1 4.45Å; L183-I187 WeakPolarHBondContact O-CD1 3.41Å; L183-I187 VanDerWaalsContact O-CG1 3.26Å; L183-I187 WeakPolarHBondContact O-CG1 3.35Å; L183-I187 PolarHBondContact O-N 3.43Å; W184-I187 PolarHBondContact O-N 3.33Å; E185-I187 VanDerWaalsContact C-N 3.29Å; E185-I187 PolarHBondContact O-N 3.14Å; I187-H189 PolarHBondContact O-N 3.43Å; I187-F190 PolarHBondContact O-N 3.5Å; I187-I193 HydrophobicContact CG2-CB 4.27Å; I187-I193 HydrophobicContact CG2-CD1 3.89Å; I187-I193 HydrophobicContact CG2-CG2 3.76Å; I187-V195 HydrophobicContact CG2-CG2 4.28Å; I187-L220 HydrophobicContact CD1-CD1 3.94Å; I187-L220 HydrophobicContact CD1-CD2 4.3Å; I187-F239 HydrophobicContact CD1-CD2 4.13Å; I187-F239 HydrophobicContact CD1-CE2 3.84Å; I187-F239 HydrophobicContact CG1-CD2 4.27Å; I187-F239 HydrophobicContact CG1-CE2 4.21Å; I187-F239 HydrophobicContact CG2-CE2 4.27Å; I187-F239 HydrophobicContact CG2-CZ 4.25Å
188	A	79.9	Confident	72.2	Confident	60 Å²	60	57.4 Å²	57.4	50%	0.496	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-22	-174.8	0	0	0	0	0	114.1	W184 E185 F190	W184-A188 WeakPolarHBondContact O-CB 3.28Å; W184-A188 PolarHBondContact O-N 3.21Å; E185-A188 PolarHBondContact O-N 2.83Å; A188-F190 PolarHBondContact O-N 3.04Å
189	H	79.6	Confident	70.4	Confident	114 Å²	114	61 Å²	61	53%	0.528	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.6	173.1	-177.3	-78.8	0	0	0	113.3	F177 E185 I187 P191	F177-H189 HydrophobicContact CE1-CB 3.68Å; F177-H189 AromaticContact CE1-CG 3.63Å; F177-H189 AromaticContact CE1-ND1 4Å; F177-H189 HydrophobicContact CZ-CB 4.17Å; F177-H189 AromaticContact CZ-ND1 3.96Å; E185-H189 WeakPolarHBondContact O-CB 3.06Å; E185-H189 PolarHBondContact O-N 3.38Å; I187-H189 PolarHBondContact O-N 3.43Å; H189-P191 WeakPolarHBondContact O-CD 3.41Å
190	F	79.8	Confident	68.9	Low	18 Å²	18	69.1 Å²	69.1	8%	0.079	37%	0.372	C	S	.	.			trans	-97.2	108	-178.7	-67	-65.5	0	0	0	111.6	L165 L173 F177 V186 I187 A188 M192 I193	L165-F190 HydrophobicContact CB-CD2 4.42Å; L165-F190 HydrophobicContact CB-CE2 3.94Å; L165-F190 HydrophobicContact CD2-CD2 3.68Å; L165-F190 HydrophobicContact CD2-CE2 3.94Å; L173-F190 HydrophobicContact CB-CD1 3.71Å; L173-F190 HydrophobicContact CB-CD2 4.35Å; L173-F190 HydrophobicContact CB-CE1 3.64Å; L173-F190 HydrophobicContact CB-CE2 4.28Å; L173-F190 HydrophobicContact CB-CG 4.07Å; L173-F190 HydrophobicContact CB-CZ 3.93Å; L173-F190 HydrophobicContact CD1-CB 3.85Å; L173-F190 HydrophobicContact CD1-CD1 4.12Å; L173-F190 HydrophobicContact CD1-CD2 4.5Å; L173-F190 HydrophobicContact CD1-CG 3.91Å; L173-F190 HydrophobicContact CG-CD1 4.49Å; F177-F190 HydrophobicContact CE2-CE2 4.11Å; F177-F190 AromaticContact CE2-CZ 4Å; F177-F190 HydrophobicContact CE2-CZ 4Å; F177-F190 AromaticContact CZ-CE2 3.7Å; F177-F190 HydrophobicContact CZ-CE2 3.7Å; F177-F190 AromaticContact CZ-CZ 3.75Å; F177-F190 HydrophobicContact CZ-CZ 3.75Å; V186-F190 WeakPolarHBondContact O-CD2 3.4Å; V186-F190 WeakPolarHBondContact O-CE2 3.2Å; I187-F190 PolarHBondContact O-N 3.5Å; A188-F190 PolarHBondContact O-N 3.04Å; F190-M192 PolarHBondContact O-N 2.86Å; F190-I193 HydrophobicContact CB-CD1 4.18Å; F190-I193 HydrophobicContact CB-CG1 4.18Å; F190-I193 PolarHBondContact O-N 2.95Å
191	P	61.6	Low	67.2	Low	121 Å²	121	70.5 Å²	70.5	79%	0.786	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-5.8	-175.9	28.8	-36.7	0	0	0	114.6	H189 I193	H189-P191 WeakPolarHBondContact O-CD 3.41Å; P191-I193 VanDerWaalsContact C-N 3.25Å
192	M	59.3	Low	65.9	Low	148 Å²	148	70.6 Å²	70.6	73%	0.729	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-15.1	167.4	-78	178.5	146.5	0	0	112.9	L173 F190	L173-M192 HydrophobicContact CD1-CB 4.17Å; L173-M192 HydrophobicContact CD2-SD 3.78Å; F190-M192 PolarHBondContact O-N 2.86Å
193	I	63.4	Low	65	Low	12 Å²	12	71 Å²	71	6%	0.062	39%	0.393	C	S	.	.	S	Bend	trans	-99.4	92.3	177.6	-47.6	-177.5	0	0	0	108.5	L165 M167 I187 F190 P191 V195 F239	L165-I193 HydrophobicContact CD2-CD1 3.51Å; M167-I193 HydrophobicContact CE-CD1 4.22Å; M167-I193 HydrophobicContact CE-CG1 3.84Å; M167-I193 HydrophobicContact SD-CD1 3.72Å; M167-I193 HydrophobicContact SD-CG1 3.94Å; I187-I193 HydrophobicContact CG2-CB 4.27Å; I187-I193 HydrophobicContact CG2-CD1 3.89Å; I187-I193 HydrophobicContact CG2-CG2 3.76Å; F190-I193 HydrophobicContact CB-CD1 4.18Å; F190-I193 HydrophobicContact CB-CG1 4.18Å; F190-I193 PolarHBondContact O-N 2.95Å; P191-I193 VanDerWaalsContact C-N 3.25Å; I193-V195 HydrophobicContact CG2-CG2 4.3Å; I193-V195 PolarHBondContact O-N 3.13Å; I193-F239 HydrophobicContact CD1-CD1 4.2Å; I193-F239 HydrophobicContact CD1-CE1 4.27Å; I193-F239 HydrophobicContact CG2-CE1 3.62Å; I193-F239 HydrophobicContact CG2-CZ 3.93Å
194	R	56.6	Low	64.5	Low	160 Å²	160	73.5 Å²	73.5	60%	0.604	41%	0.408	S	S	*	.			trans	-74.9	74.8	177.2	-69.9	-171.1	175.3	-172.8	2.5	111.3	S196 E197	R194-S196 PolarHBondContact O-N 3.33Å; R194-S196 VanDerWaalsContact O-N 3.09Å; R194-E197 HydrophobicContact CB-CB 4.28Å; R194-E197 HydrophobicContact CB-CG 4.26Å; R194-E197 VanDerWaalsContact CD-OE1 3.28Å; R194-E197 WeakPolarHBondContact CD-OE1 3.16Å; R194-E197 WeakPolarHBondContact CD-OE2 3.47Å; R194-E197 IonicContact CZ-OE1 2.8Å; R194-E197 IonicContact NE-OE1 2.8Å; R194-E197 IonicContact NH1-OE1 2.68Å; R194-E197 PolarHBondContact NH1-OE1 3.37Å; R194-E197 IonicContact NH1-OE2 3.79Å; R194-E197 PolarHBondContact O-N 2.88Å
195	V	52.5	Low	64.5	Low	38 Å²	38	72.5 Å²	72.5	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-47.8	-38.3	174.4	178.4	0	0	0	0	111.7	W184 I187 I193 E197 L198	W184-V195 HydrophobicContact CH2-CG1 3.59Å; W184-V195 HydrophobicContact CZ2-CG1 3.56Å; I187-V195 HydrophobicContact CG2-CG2 4.28Å; I193-V195 HydrophobicContact CG2-CG2 4.3Å; I193-V195 PolarHBondContact O-N 3.13Å; V195-E197 VanDerWaalsContact C-N 3.33Å; V195-E197 PolarHBondContact O-N 3.39Å; V195-L198 PolarHBondContact O-N 3.21Å
196	S	48	Very low	64.5	Low	104 Å²	104	68.4 Å²	68.4	73%	0.727	39%	0.388	S	S	*	.	H	α-helix	trans	-67.1	-21.4	-179.8	-51.2	0	0	0	0	115.8	R194	R194-S196 PolarHBondContact O-N 3.33Å; R194-S196 VanDerWaalsContact O-N 3.09Å
197	E	45.4	Very low	64.5	Low	111 Å²	111	68.4 Å²	68.4	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-90.3	-13.5	176.9	-71.8	173.1	178.1	0	0	112.2	R194 V195	R194-E197 HydrophobicContact CB-CB 4.28Å; R194-E197 HydrophobicContact CB-CG 4.26Å; R194-E197 VanDerWaalsContact CD-OE1 3.28Å; R194-E197 WeakPolarHBondContact CD-OE1 3.16Å; R194-E197 WeakPolarHBondContact CD-OE2 3.47Å; R194-E197 IonicContact CZ-OE1 2.8Å; R194-E197 IonicContact NE-OE1 2.8Å; R194-E197 IonicContact NH1-OE1 2.68Å; R194-E197 PolarHBondContact NH1-OE1 3.37Å; R194-E197 IonicContact NH1-OE2 3.79Å; R194-E197 PolarHBondContact O-N 2.88Å; V195-E197 VanDerWaalsContact C-N 3.33Å; V195-E197 PolarHBondContact O-N 3.39Å
198	L	48.7	Very low	64.7	Low	40 Å²	40	69.7 Å²	69.7	21%	0.209	40%	0.396	C	S	.	.	H	α-helix	trans	-84.7	-28.5	-177.1	-72.1	161.1	0	0	0	112.9	V195 E200 S201 A203 H241	V195-L198 PolarHBondContact O-N 3.21Å; L198-E200 PolarHBondContact O-N 3.26Å; L198-S201 PolarHBondContact O-N 2.84Å; L198-S201 VanDerWaalsContact O-N 3.17Å; L198-A203 HydrophobicContact CD2-CB 4.1Å; L198-H241 WeakPolarHBondContact CD1-NE2 3.3Å; L198-H241 VanDerWaalsContact CD2-CD2 3.47Å; L198-H241 WeakPolarHBondContact CD2-CD2 3.33Å
199	T	45.7	Very low	64.9	Low	113 Å²	113	68.8 Å²	68.8	69%	0.693	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-29	179.4	-40.7	0	0	0	0	112.5
200	E	49	Very low	64.9	Low	182 Å²	182	68 Å²	68	85%	0.85	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-17.5	179	-59.1	-171.2	161.2	0	0	113.5	L198	L198-E200 PolarHBondContact O-N 3.26Å
201	S	46.7	Very low	64.7	Low	70 Å²	70	75.6 Å²	75.6	49%	0.49	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	3.2	-168.1	-151.5	0	0	0	0	115.1	L198 A203	L198-S201 PolarHBondContact O-N 2.84Å; L198-S201 VanDerWaalsContact O-N 3.17Å; S201-A203 PolarHBondContact O-N 3.46Å
202	G	56.9	Low	65.4	Low	49 Å²	49	72.9 Å²	72.9	51%	0.505	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	22.9	177.4	0	0	0	0	0	114.7
203	A	68.1	Low	66.7	Low	17 Å²	17	69.6 Å²	69.6	14%	0.14	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.8	178.3	0	0	0	0	0	110.7	L198 S201 P205 H241	L198-A203 HydrophobicContact CD2-CB 4.1Å; S201-A203 PolarHBondContact O-N 3.46Å; A203-P205 WeakPolarHBondContact O-CD 3.37Å; A203-H241 HydrophobicContact CB-CB 4.42Å
204	T	75.4	Confident	67.7	Low	56 Å²	56	69.9 Å²	69.9	34%	0.344	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120	175.7	55.9	0	0	0	0	110.2	K242	T204-K242 PolarHBondContact N-O 2.82Å; T204-K242 PolarHBondContact O-N 3.42Å; T204-K242 VanDerWaalsContact OG1-CB 3.26Å; T204-K242 WeakPolarHBondContact OG1-CB 3.47Å; T204-K242 PolarHBondContact OG1-O 3.34Å
205	P	84.4	Confident	69	Low	20 Å²	20	64.8 Å²	64.8	13%	0.13	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	138.3	176	28.2	-32.8	0	0	0	109.8	W184 A203 G216 L220 F239	W184-P205 HydrophobicContact CZ3-CG 4.06Å; A203-P205 WeakPolarHBondContact O-CD 3.37Å; P205-G216 PolarHBondContact O-N 3.19Å; P205-L220 HydrophobicContact CB-CD1 4.01Å; P205-L220 HydrophobicContact CG-CD1 4.05Å; P205-F239 HydrophobicContact CB-CE2 3.87Å; P205-F239 HydrophobicContact CB-CZ 4.11Å
206	A	84.9	Confident	70.4	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.3	179.4	0	0	0	0	0	112	E213 V214 F239 L240	A206-E213 HydrophobicContact CB-CG 4.31Å; A206-V214 CarbonylContact C-O 3.53Å; A206-V214 VanDerWaalsContact CA-O 3.31Å; A206-V214 WeakPolarHBondContact CA-O 3.37Å; A206-F239 CarbonylContact O-C 3.44Å; A206-F239 WeakPolarHBondContact O-CA 3.47Å; A206-L240 HydrophobicContact CB-CB 4.36Å; A206-L240 PolarHBondContact N-O 3.02Å; A206-L240 PolarHBondContact O-N 3.14Å
207	C	85.3	Confident	72	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.014	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.8	169.7	-78.6	0	0	0	0	110.3	L183 E213 V214 L220 V237 R238	L183-C207 HydrophobicContact CD1-CB 3.78Å; C207-E213 WeakPolarHBondContact O-CA 3.46Å; C207-V214 PolarHBondContact N-O 3.31Å; C207-V214 PolarHBondContact O-N 3.47Å; C207-L220 HydrophobicContact CB-CD2 3.72Å; C207-V237 HydrophobicContact CB-CG1 3.9Å; C207-R238 CarbonylContact C-O 3.55Å; C207-R238 WeakPolarHBondContact CA-O 3.34Å
208	V	86.8	Confident	73.6	Confident	29 Å²	29	65.8 Å²	65.8	18%	0.176	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.3	171.5	-180	0	0	0	0	109.1	D212 E213 R238 L240	V208-D212 WeakPolarHBondContact CA-O 3.4Å; V208-E213 HydrophobicContact CG2-CB 4.1Å; V208-E213 HydrophobicContact CG2-CG 3.94Å; V208-R238 PolarHBondContact N-O 2.62Å; V208-R238 PolarHBondContact O-N 3.04Å; V208-L240 HydrophobicContact CG2-CD1 3.8Å
209	Y	84.6	Confident	75.3	Confident	41 Å²	41	65.6 Å²	65.6	16%	0.161	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.5	168.4	-179.9	-118.6	0	0	0	109.7	R211 D212 L228 L230 A235 I236 V237	Y209-R211 VanDerWaalsContact C-N 3.34Å; Y209-R211 PolarHBondContact O-N 3.04Å; Y209-D212 PolarHBondContact N-O 3.24Å; Y209-D212 PolarHBondContact O-N 3.01Å; Y209-L228 HydrophobicContact CD1-CB 4.27Å; Y209-L230 HydrophobicContact CE1-CD1 4.41Å; Y209-L230 HydrophobicContact CE1-CD2 4.12Å; Y209-L230 HydrophobicContact CE1-CG 4.24Å; Y209-L230 HydrophobicContact CE2-CD2 4.24Å; Y209-L230 WeakPolarHBondContact OH-CD2 3.47Å; Y209-A235 HydrophobicContact CE2-CB 4Å; Y209-I236 WeakPolarHBondContact CD2-O 3.44Å; Y209-V237 HydrophobicContact CD2-CG2 4.04Å; Y209-V237 HydrophobicContact CG-CG2 4.49Å
210	M	80.8	Confident	77.1	Confident	98 Å²	98	60.2 Å²	60.2	48%	0.483	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	-81.8	-171.5	-49.7	-164.9	99.1	0	0	114.7	P133 F136	P133-M210 HydrophobicContact CG-SD 4.01Å; F136-M210 HydrophobicContact CD2-CE 3.76Å; F136-M210 HydrophobicContact CD2-SD 4.24Å; F136-M210 HydrophobicContact CE2-CE 3.44Å; F136-M210 VanDerWaalsContact CE2-CE 3.44Å; F136-M210 HydrophobicContact CE2-SD 3.98Å; F136-M210 HydrophobicContact CZ-CE 4.43Å
211	R	74.8	Confident	78.8	Confident	176 Å²	176	56.2 Å²	56.2	66%	0.664	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140	5.2	175.6	-64.4	-167.8	-173.5	163.6	0.2	113.3	Y209	Y209-R211 VanDerWaalsContact C-N 3.34Å; Y209-R211 PolarHBondContact O-N 3.04Å
212	D	75.1	Confident	80.7	Confident	64 Å²	64	61.5 Å²	61.5	34%	0.342	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.7	174.6	-67.5	-67.9	0	0	0	108.5	N98 V208 Y209	N98-D212 WeakPolarHBondContact CB-OD2 3.42Å; N98-D212 PolarHBondContact ND2-OD1 2.88Å; N98-D212 PolarHBondContact ND2-OD2 3.46Å; N98-D212 VanDerWaalsContact ND2-OD2 3.16Å; V208-D212 WeakPolarHBondContact CA-O 3.4Å; Y209-D212 PolarHBondContact N-O 3.24Å; Y209-D212 PolarHBondContact O-N 3.01Å
213	E	86.9	Confident	82	Confident	80 Å²	80	60.6 Å²	60.6	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.1	171.9	-174.2	-167.4	123.1	0	0	109	A206 C207 V208 S215 K242	A206-E213 HydrophobicContact CB-CG 4.31Å; C207-E213 WeakPolarHBondContact O-CA 3.46Å; V208-E213 HydrophobicContact CG2-CB 4.1Å; V208-E213 HydrophobicContact CG2-CG 3.94Å; E213-S215 WeakPolarHBondContact OE1-CB 3.06Å; E213-S215 PolarHBondContact OE1-OG 2.84Å; E213-K242 WeakPolarHBondContact OE1-CE 3.15Å; E213-K242 IonicContact OE1-NZ 3.66Å; E213-K242 PolarHBondContact OE1-NZ 3.01Å; E213-K242 WeakPolarHBondContact OE2-CE 3.5Å; E213-K242 IonicContact OE2-NZ 3.75Å; E213-K242 PolarHBondContact OE2-NZ 3.35Å
214	V	84.8	Confident	83	Confident	18 Å²	18	61.8 Å²	61.8	11%	0.109	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	108.7	168.5	-174.8	0	0	0	0	107.3	L183 A206 C207 A219 L220 T223	L183-V214 HydrophobicContact CD1-CB 4.23Å; L183-V214 HydrophobicContact CD1-CG2 4.17Å; A206-V214 CarbonylContact C-O 3.53Å; A206-V214 VanDerWaalsContact CA-O 3.31Å; A206-V214 WeakPolarHBondContact CA-O 3.37Å; C207-V214 PolarHBondContact N-O 3.31Å; C207-V214 PolarHBondContact O-N 3.47Å; V214-A219 VanDerWaalsContact CG1-C 3.48Å; V214-A219 HydrophobicContact CG1-CB 3.63Å; V214-L220 HydrophobicContact CB-CD2 4.03Å; V214-L220 HydrophobicContact CG1-CD2 3.82Å; V214-L220 HydrophobicContact CG1-CG 4.13Å; V214-T223 HydrophobicContact CG1-CG2 4.06Å; V214-T223 WeakPolarHBondContact CG1-OG1 3.45Å; V214-T223 HydrophobicContact CG2-CG2 4.01Å
215	S	84.5	Confident	83.4	Confident	53 Å²	53	59.1 Å²	59.1	37%	0.371	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.3	179.2	29.5	0	0	0	0	112.1	E213 A219	E213-S215 WeakPolarHBondContact OE1-CB 3.06Å; E213-S215 PolarHBondContact OE1-OG 2.84Å; S215-A219 WeakPolarHBondContact O-CB 3.46Å
216	G	81.6	Confident	83.2	Confident	21 Å²	21	61.4 Å²	61.4	22%	0.216	30%	0.302	C	S	.	.	S	Bend	trans	93.1	143	-176.8	0	0	0	0	0	113.8	P205 E218 A219 L220	P205-G216 PolarHBondContact O-N 3.19Å; G216-E218 PolarHBondContact O-N 2.89Å; G216-A219 PolarHBondContact O-N 2.95Å; G216-L220 WeakPolarHBondContact O-CG 3.38Å; G216-L220 PolarHBondContact O-N 2.96Å
217	E	80.6	Confident	83.1	Confident	80 Å²	80	64.2 Å²	64.2	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-57.4	-44	-176.1	174	169.9	178.1	0	0	113.2	W184 A219 L220 K221	W184-E217 HydrophobicContact CD2-CG 4.17Å; W184-E217 HydrophobicContact CE3-CB 4.32Å; W184-E217 HydrophobicContact CE3-CG 3.96Å; W184-E217 HydrophobicContact CH2-CB 3.95Å; W184-E217 VanDerWaalsContact CH2-CD 3.4Å; W184-E217 HydrophobicContact CH2-CG 3.49Å; W184-E217 VanDerWaalsContact CH2-CG 3.49Å; W184-E217 VanDerWaalsContact CZ2-CD 3.44Å; W184-E217 HydrophobicContact CZ2-CG 3.72Å; W184-E217 VanDerWaalsContact CZ2-OE1 3.3Å; W184-E217 WeakPolarHBondContact CZ2-OE1 3.47Å; W184-E217 HydrophobicContact CZ3-CB 3.78Å; W184-E217 HydrophobicContact CZ3-CG 3.63Å; E217-A219 VanDerWaalsContact C-N 3.33Å; E217-A219 PolarHBondContact O-N 3.44Å; E217-L220 PolarHBondContact O-N 3.42Å; E217-K221 HydrophobicContact CG-CD 4.14Å; E217-K221 VanDerWaalsContact CG-CE 3.5Å; E217-K221 WeakPolarHBondContact O-CG 3.5Å; E217-K221 PolarHBondContact O-N 3.42Å; E217-K221 VanDerWaalsContact OE1-CE 3.25Å; E217-K221 WeakPolarHBondContact OE1-CE 3.38Å; E217-K221 IonicContact OE1-NZ 2.59Å; E217-K221 PolarHBondContact OE1-NZ 2.87Å
218	E	80.7	Confident	82.7	Confident	172 Å²	172	65.4 Å²	65.4	80%	0.804	33%	0.328	S	S	*	.	H	α-helix	trans	-62.2	-39.5	177.9	-61.6	-174.6	175.9	0	0	112.6	G216 K221 K222	G216-E218 PolarHBondContact O-N 2.89Å; E218-K221 PolarHBondContact O-N 3.23Å; E218-K222 VanDerWaalsContact O-CB 3.29Å; E218-K222 WeakPolarHBondContact O-CB 3.26Å; E218-K222 PolarHBondContact O-N 3.25Å
219	A	82.9	Confident	82.3	Confident	36 Å²	36	64 Å²	64	30%	0.298	32%	0.319	S	S	.	.	H	α-helix	trans	-70.3	-39.7	178.7	0	0	0	0	0	111.4	V214 S215 G216 E217 K221 K222 T223	V214-A219 VanDerWaalsContact CG1-C 3.48Å; V214-A219 HydrophobicContact CG1-CB 3.63Å; S215-A219 WeakPolarHBondContact O-CB 3.46Å; G216-A219 PolarHBondContact O-N 2.95Å; E217-A219 VanDerWaalsContact C-N 3.33Å; E217-A219 PolarHBondContact O-N 3.44Å; A219-K221 VanDerWaalsContact C-N 3.35Å; A219-K222 PolarHBondContact O-N 3.5Å; A219-T223 WeakPolarHBondContact O-CG2 3.19Å; A219-T223 PolarHBondContact O-N 3.08Å; A219-T223 PolarHBondContact O-OG1 3.31Å
220	L	84.8	Confident	82.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.7	-31.8	175.9	-68.8	168.2	0	0	0	112.7	L183 W184 I187 P205 C207 V214 G216 E217	L183-L220 HydrophobicContact CB-CB 4.41Å; L183-L220 HydrophobicContact CB-CD2 3.83Å; L183-L220 HydrophobicContact CD1-CD2 3.79Å; L183-L220 PolarHBondContact N-O 2.87Å; W184-L220 HydrophobicContact CB-CB 4.3Å; W184-L220 HydrophobicContact CE3-CB 4.12Å; W184-L220 HydrophobicContact CE3-CD1 4.19Å; W184-L220 HydrophobicContact CZ3-CD1 4.43Å; W184-L220 PolarHBondContact N-O 2.94Å; W184-L220 VanDerWaalsContact N-O 3.09Å; I187-L220 HydrophobicContact CD1-CD1 3.94Å; I187-L220 HydrophobicContact CD1-CD2 4.3Å; P205-L220 HydrophobicContact CB-CD1 4.01Å; P205-L220 HydrophobicContact CG-CD1 4.05Å; C207-L220 HydrophobicContact CB-CD2 3.72Å; V214-L220 HydrophobicContact CB-CD2 4.03Å; V214-L220 HydrophobicContact CG1-CD2 3.82Å; V214-L220 HydrophobicContact CG1-CG 4.13Å; G216-L220 WeakPolarHBondContact O-CG 3.38Å; G216-L220 PolarHBondContact O-N 2.96Å; E217-L220 PolarHBondContact O-N 3.42Å
221	K	84.8	Confident	81.8	Confident	98 Å²	98	59 Å²	59	43%	0.426	30%	0.298	S	S	.	.	H	α-helix	trans	-72.9	-36.4	171.1	-72.3	173.2	-176.3	173.9	0	112.3	S182 W184 E217 E218 A219	S182-K221 VanDerWaalsContact CB-O 3.32Å; S182-K221 WeakPolarHBondContact CB-O 3.45Å; W184-K221 HydrophobicContact CB-CB 4.43Å; W184-K221 HydrophobicContact CB-CG 3.6Å; W184-K221 HydrophobicContact CD2-CG 4.19Å; W184-K221 HydrophobicContact CG-CD 4.4Å; W184-K221 HydrophobicContact CG-CG 3.57Å; E217-K221 HydrophobicContact CG-CD 4.14Å; E217-K221 VanDerWaalsContact CG-CE 3.5Å; E217-K221 WeakPolarHBondContact O-CG 3.5Å; E217-K221 PolarHBondContact O-N 3.42Å; E217-K221 VanDerWaalsContact OE1-CE 3.25Å; E217-K221 WeakPolarHBondContact OE1-CE 3.38Å; E217-K221 IonicContact OE1-NZ 2.59Å; E217-K221 PolarHBondContact OE1-NZ 2.87Å; E218-K221 PolarHBondContact O-N 3.23Å; A219-K221 VanDerWaalsContact C-N 3.35Å
222	K	85.4	Confident	81.6	Confident	181 Å²	181	51.9 Å²	51.9	79%	0.787	28%	0.28	S	S	*	.	H	α-helix	trans	-77.2	-27.4	-178.7	-172.6	173	-179.3	176.5	0	113.9	E218 A219	E218-K222 VanDerWaalsContact O-CB 3.29Å; E218-K222 WeakPolarHBondContact O-CB 3.26Å; E218-K222 PolarHBondContact O-N 3.25Å; A219-K222 PolarHBondContact O-N 3.5Å
223	T	84.8	Confident	81.8	Confident	30 Å²	30	51.3 Å²	51.3	18%	0.184	29%	0.289	C	S	.	.			trans	-90.3	112.3	178.6	49.7	0	0	0	0	111	S182 L183 V214 A219	S182-T223 WeakPolarHBondContact CA-O 3.35Å; L183-T223 PolarHBondContact N-O 3.17Å; V214-T223 HydrophobicContact CG1-CG2 4.06Å; V214-T223 WeakPolarHBondContact CG1-OG1 3.45Å; V214-T223 HydrophobicContact CG2-CG2 4.01Å; A219-T223 WeakPolarHBondContact O-CG2 3.19Å; A219-T223 PolarHBondContact O-N 3.08Å; A219-T223 PolarHBondContact O-OG1 3.31Å
224	T	88.2	Confident	81.6	Confident	43 Å²	43	51.1 Å²	51.1	26%	0.264	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-88.8	157.7	172.9	60.9	0	0	0	0	111.4	G180 Q181 K226 S227 L228	G180-T224 VanDerWaalsContact O-CG2 3.3Å; G180-T224 WeakPolarHBondContact O-CG2 3.4Å; Q181-T224 CarbonylContact O-C 3.58Å; Q181-T224 VanDerWaalsContact O-CA 3.26Å; Q181-T224 WeakPolarHBondContact O-CA 3.45Å; T224-K226 VanDerWaalsContact C-N 3.26Å; T224-K226 PolarHBondContact O-N 3.18Å; T224-S227 PolarHBondContact N-OG 3.3Å; T224-S227 WeakPolarHBondContact O-CB 3.3Å; T224-S227 PolarHBondContact O-N 2.87Å; T224-S227 PolarHBondContact O-OG 3.05Å; T224-S227 PolarHBondContact OG1-N 3Å; T224-L228 PolarHBondContact O-N 3.2Å
225	L	84.5	Confident	81.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-44.9	173.4	-68	179	0	0	0	111.3	I163 F177 Q181 L183 V186 S227 L228 L230	I163-L225 HydrophobicContact CD1-CD1 4.39Å; I163-L225 HydrophobicContact CD1-CD2 3.98Å; I163-L225 HydrophobicContact CG1-CD1 4.12Å; I163-L225 HydrophobicContact CG1-CD2 4.18Å; F177-L225 HydrophobicContact CB-CD1 3.65Å; Q181-L225 PolarHBondContact O-N 2.9Å; L183-L225 HydrophobicContact CD2-CD2 3.99Å; V186-L225 HydrophobicContact CG2-CD1 3.96Å; V186-L225 HydrophobicContact CG2-CD2 4.28Å; V186-L225 HydrophobicContact CG2-CG 4.25Å; L225-S227 VanDerWaalsContact C-N 3.3Å; L225-S227 PolarHBondContact O-N 3.37Å; L225-L228 PolarHBondContact O-N 3.1Å; L225-L230 HydrophobicContact CB-CB 4.02Å; L225-L230 HydrophobicContact CD2-CB 4.5Å; L225-L230 HydrophobicContact CD2-CD1 3.75Å; L225-L230 WeakPolarHBondContact O-CA 3.44Å; L225-L230 VanDerWaalsContact O-CB 3.29Å; L225-L230 WeakPolarHBondContact O-CB 3.23Å; L225-L230 PolarHBondContact O-N 3.46Å
226	K	81.5	Confident	81.7	Confident	68 Å²	68	52.4 Å²	52.4	30%	0.296	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-54.4	-41.3	173.1	179.3	169.9	-178.5	176.3	0	113	L102 S179 T224 L228 G229 T231	L102-K226 HydrophobicContact CD2-CD 4.49Å; L102-K226 HydrophobicContact CD2-CG 3.75Å; S179-K226 VanDerWaalsContact O-CB 3.28Å; S179-K226 WeakPolarHBondContact O-CB 3.26Å; S179-K226 PolarHBondContact O-N 2.82Å; T224-K226 VanDerWaalsContact C-N 3.26Å; T224-K226 PolarHBondContact O-N 3.18Å; K226-L228 PolarHBondContact O-N 3.36Å; K226-G229 PolarHBondContact O-N 3.46Å; K226-G229 VanDerWaalsContact O-N 3.09Å; K226-T231 HydrophobicContact CB-CG2 4.3Å; K226-T231 HydrophobicContact CG-CG2 3.89Å
227	S	80.8	Confident	82.1	Confident	59 Å²	59	51.4 Å²	51.4	41%	0.413	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-66	-24.2	179.1	74.6	0	0	0	0	113.8	T224 L225 G229	T224-S227 PolarHBondContact N-OG 3.3Å; T224-S227 WeakPolarHBondContact O-CB 3.3Å; T224-S227 PolarHBondContact O-N 2.87Å; T224-S227 PolarHBondContact O-OG 3.05Å; T224-S227 PolarHBondContact OG1-N 3Å; L225-S227 VanDerWaalsContact C-N 3.3Å; L225-S227 PolarHBondContact O-N 3.37Å; S227-G229 VanDerWaalsContact C-N 3.28Å
228	L	78.8	Confident	82.4	Confident	27 Å²	27	53.3 Å²	53.3	14%	0.141	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-88.5	8.8	175.5	-60.8	166.4	0	0	0	112.8	L183 Y209 T224 L225 K226 L230	L183-L228 HydrophobicContact CD1-CD1 3.77Å; L183-L228 HydrophobicContact CD2-CD1 3.76Å; L183-L228 HydrophobicContact CG-CD1 3.82Å; Y209-L228 HydrophobicContact CD1-CB 4.27Å; T224-L228 PolarHBondContact O-N 3.2Å; L225-L228 PolarHBondContact O-N 3.1Å; K226-L228 PolarHBondContact O-N 3.36Å; L228-L230 VanDerWaalsContact C-N 3.26Å; L228-L230 HydrophobicContact CB-CD1 4.3Å; L228-L230 HydrophobicContact CB-CG 4.32Å; L228-L230 PolarHBondContact O-N 2.67Å
229	G	76.8	Confident	82.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	1.6	-172.7	0	0	0	0	0	114.2	T131 K226 S227 T231	T131-G229 WeakPolarHBondContact CA-O 3.4Å; T131-G229 WeakPolarHBondContact CB-O 3.38Å; T131-G229 VanDerWaalsContact CG2-O 3.29Å; T131-G229 WeakPolarHBondContact CG2-O 3.41Å; K226-G229 PolarHBondContact O-N 3.46Å; K226-G229 VanDerWaalsContact O-N 3.09Å; S227-G229 VanDerWaalsContact C-N 3.28Å; G229-T231 VanDerWaalsContact C-N 3.3Å; G229-T231 PolarHBondContact O-N 3.25Å
230	L	80.6	Confident	82.8	Confident	6 Å²	6	44.9 Å²	44.9	3%	0.031	25%	0.248	C	C	.	.			trans	-82.1	75.5	-177.2	-60.9	172.3	0	0	0	110.8	V161 I163 Y209 L225 L228 A235	V161-L230 HydrophobicContact CG1-CB 4.46Å; V161-L230 WeakPolarHBondContact CG2-O 3.3Å; I163-L230 HydrophobicContact CD1-CD1 3.95Å; Y209-L230 HydrophobicContact CE1-CD1 4.41Å; Y209-L230 HydrophobicContact CE1-CD2 4.12Å; Y209-L230 HydrophobicContact CE1-CG 4.24Å; Y209-L230 HydrophobicContact CE2-CD2 4.24Å; Y209-L230 WeakPolarHBondContact OH-CD2 3.47Å; L225-L230 HydrophobicContact CB-CB 4.02Å; L225-L230 HydrophobicContact CD2-CB 4.5Å; L225-L230 HydrophobicContact CD2-CD1 3.75Å; L225-L230 WeakPolarHBondContact O-CA 3.44Å; L225-L230 VanDerWaalsContact O-CB 3.29Å; L225-L230 WeakPolarHBondContact O-CB 3.23Å; L225-L230 PolarHBondContact O-N 3.46Å; L228-L230 VanDerWaalsContact C-N 3.26Å; L228-L230 HydrophobicContact CB-CD1 4.3Å; L228-L230 HydrophobicContact CB-CG 4.32Å; L228-L230 PolarHBondContact O-N 2.67Å; L230-A235 HydrophobicContact CD1-CB 4.32Å; L230-A235 HydrophobicContact CD2-CB 3.47Å; L230-A235 VanDerWaalsContact CD2-CB 3.47Å
231	T	74.7	Confident	82.7	Confident	26 Å²	26	47.4 Å²	47.4	16%	0.16	26%	0.259	C	S	.	.	S	Bend	trans	-105.3	14.8	176.6	60.8	0	0	0	0	113.7	L102 T131 S159 K226 G229	L102-T231 HydrophobicContact CD2-CG2 3.83Å; T131-T231 WeakPolarHBondContact CG2-OG1 3.32Å; S159-T231 WeakPolarHBondContact CB-O 3.39Å; S159-T231 PolarHBondContact OG-O 2.73Å; K226-T231 HydrophobicContact CB-CG2 4.3Å; K226-T231 HydrophobicContact CG-CG2 3.89Å; G229-T231 VanDerWaalsContact C-N 3.3Å; G229-T231 PolarHBondContact O-N 3.25Å
232	G	71.8	Confident	82.2	Confident	28 Å²	28	47.1 Å²	47.1	29%	0.289	26%	0.258	S	S	.	.	S	Bend	trans	170.4	173.5	172.2	0	0	0	0	0	113.1
233	G	79.2	Confident	81.3	Confident	51 Å²	51	45.7 Å²	45.7	53%	0.526	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	85.3	-135.5	167.4	0	0	0	0	0	114.8	R162	R162-G233 PolarHBondContact N-O 3.48Å; R162-G233 VanDerWaalsContact N-O 3.09Å
234	S	82	Confident	79.6	Confident	76 Å²	76	50.3 Å²	50.3	53%	0.531	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	131.2	-177.2	-57.8	0	0	0	0	110.7	R162	R162-S234 PolarHBondContact NE-OG 2.86Å; R162-S234 PolarHBondContact NH2-OG 2.84Å; R162-S234 VanDerWaalsContact NH2-OG 3.16Å; R162-S234 CarbonylContact O-C 3.59Å; R162-S234 VanDerWaalsContact O-CA 3.24Å; R162-S234 WeakPolarHBondContact O-CA 3.26Å
235	A	83.8	Confident	77.2	Confident	12 Å²	12	57.7 Å²	57.7	10%	0.099	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	155.6	-172.1	0	0	0	0	0	112.3	R162 I163 A164 Y209 L230	R162-A235 PolarHBondContact O-N 3.06Å; I163-A235 HydrophobicContact CD1-CB 4.1Å; A164-A235 PolarHBondContact N-O 2.91Å; Y209-A235 HydrophobicContact CE2-CB 4Å; L230-A235 HydrophobicContact CD1-CB 4.32Å; L230-A235 HydrophobicContact CD2-CB 3.47Å; L230-A235 VanDerWaalsContact CD2-CB 3.47Å
236	I	88.2	Confident	75	Confident	86 Å²	86	61.5 Å²	61.5	44%	0.441	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125	175.9	-52.2	178.2	0	0	0	108.3	A164 Q166 Y209	A164-I236 HydrophobicContact CB-CG1 4.29Å; A164-I236 WeakPolarHBondContact O-CA 3.5Å; Q166-I236 HydrophobicContact CB-CG2 4.41Å; Y209-I236 WeakPolarHBondContact CD2-O 3.44Å
237	V	89.1	Confident	72.7	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.006	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.7	175.3	179.3	0	0	0	0	107.2	I163 A164 L165 Q166 C207 Y209	I163-V237 HydrophobicContact CG2-CB 4.28Å; I163-V237 HydrophobicContact CG2-CG2 3.93Å; A164-V237 PolarHBondContact O-N 3.45Å; L165-V237 CarbonylContact C-O 3.49Å; L165-V237 WeakPolarHBondContact CA-O 3.48Å; L165-V237 HydrophobicContact CD1-CB 4.1Å; L165-V237 HydrophobicContact CD1-CG1 4.07Å; Q166-V237 PolarHBondContact N-O 2.86Å; C207-V237 HydrophobicContact CB-CG1 3.9Å; Y209-V237 HydrophobicContact CD2-CG2 4.04Å; Y209-V237 HydrophobicContact CG-CG2 4.49Å
238	R	88	Confident	70.3	Confident	119 Å²	119	65.5 Å²	65.5	45%	0.449	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.5	176.3	-174.3	175.4	65.4	152.6	0	110.3	Q166 C207 V208 L240	Q166-R238 WeakPolarHBondContact O-CA 3.49Å; C207-R238 CarbonylContact C-O 3.55Å; C207-R238 WeakPolarHBondContact CA-O 3.34Å; V208-R238 PolarHBondContact N-O 2.62Å; V208-R238 PolarHBondContact O-N 3.04Å; R238-L240 HydrophobicContact CG-CD2 4.3Å; R238-L240 HydrophobicContact CG-CG 4.38Å
239	F	86.7	Confident	68	Low	2 Å²	2	73.1 Å²	73.1	1%	0.009	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.7	173.6	-174	-121.1	0	0	0	110.5	L165 Q166 M167 I187 I193 P205 A206 H241	L165-F239 HydrophobicContact CD1-CB 4.05Å; L165-F239 HydrophobicContact CG-CB 4.24Å; Q166-F239 PolarHBondContact O-N 3.45Å; M167-F239 HydrophobicContact CE-CD1 3.98Å; M167-F239 HydrophobicContact CE-CE1 4.41Å; M167-F239 HydrophobicContact SD-CB 4.35Å; M167-F239 HydrophobicContact SD-CD1 3.81Å; I187-F239 HydrophobicContact CD1-CD2 4.13Å; I187-F239 HydrophobicContact CD1-CE2 3.84Å; I187-F239 HydrophobicContact CG1-CD2 4.27Å; I187-F239 HydrophobicContact CG1-CE2 4.21Å; I187-F239 HydrophobicContact CG2-CE2 4.27Å; I187-F239 HydrophobicContact CG2-CZ 4.25Å; I193-F239 HydrophobicContact CD1-CD1 4.2Å; I193-F239 HydrophobicContact CD1-CE1 4.27Å; I193-F239 HydrophobicContact CG2-CE1 3.62Å; I193-F239 HydrophobicContact CG2-CZ 3.93Å; P205-F239 HydrophobicContact CB-CE2 3.87Å; P205-F239 HydrophobicContact CB-CZ 4.11Å; A206-F239 CarbonylContact O-C 3.44Å; A206-F239 WeakPolarHBondContact O-CA 3.47Å; F239-H241 AromaticContact CE1-CE1 3.6Å; F239-H241 AromaticContact CE1-NE2 3.2Å; F239-H241 WeakPolarHBondContact CE1-NE2 3.2Å; F239-H241 AromaticContact CZ-NE2 3.61Å
240	L	84.6	Confident	65.9	Low	29 Å²	29	81.9 Å²	81.9	15%	0.152	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	148.4	-173.6	-63.5	169.5	0	0	0	110.7	E168 A206 V208 R238	E168-L240 HydrophobicContact CG-CD2 4.26Å; E168-L240 WeakPolarHBondContact OE1-CA 3.36Å; A206-L240 HydrophobicContact CB-CB 4.36Å; A206-L240 PolarHBondContact N-O 3.02Å; A206-L240 PolarHBondContact O-N 3.14Å; V208-L240 HydrophobicContact CG2-CD1 3.8Å; R238-L240 HydrophobicContact CG-CD2 4.3Å; R238-L240 HydrophobicContact CG-CG 4.38Å
241	H	81.8	Confident	63.4	Low	53 Å²	53	89.5 Å²	89.5	25%	0.245	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	97.8	172.9	-57.7	108.5	0	0	0	110.5	E168 L198 A203 F239 K243	E168-H241 PolarHBondContact OE1-N 2.89Å; E168-H241 IonicContact OE2-CE1 3.65Å; E168-H241 IonicContact OE2-CG 3.74Å; E168-H241 IonicContact OE2-ND1 3.88Å; E168-H241 PolarHBondContact OE2-ND1 2.8Å; L198-H241 WeakPolarHBondContact CD1-NE2 3.3Å; L198-H241 VanDerWaalsContact CD2-CD2 3.47Å; L198-H241 WeakPolarHBondContact CD2-CD2 3.33Å; A203-H241 HydrophobicContact CB-CB 4.42Å; F239-H241 AromaticContact CE1-CE1 3.6Å; F239-H241 AromaticContact CE1-NE2 3.2Å; F239-H241 WeakPolarHBondContact CE1-NE2 3.2Å; F239-H241 AromaticContact CZ-NE2 3.61Å; H241-K243 PolarHBondContact O-N 3.41Å
242	K	76.1	Confident	61	Low	92 Å²	92	91.5 Å²	91.5	40%	0.4	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	89.7	172.3	-82.4	-175.5	179.2	176.1	0	109.9	T204 E213 N244	T204-K242 PolarHBondContact N-O 2.82Å; T204-K242 PolarHBondContact O-N 3.42Å; T204-K242 VanDerWaalsContact OG1-CB 3.26Å; T204-K242 WeakPolarHBondContact OG1-CB 3.47Å; T204-K242 PolarHBondContact OG1-O 3.34Å; E213-K242 WeakPolarHBondContact OE1-CE 3.15Å; E213-K242 IonicContact OE1-NZ 3.66Å; E213-K242 PolarHBondContact OE1-NZ 3.01Å; E213-K242 WeakPolarHBondContact OE2-CE 3.5Å; E213-K242 IonicContact OE2-NZ 3.75Å; E213-K242 PolarHBondContact OE2-NZ 3.35Å; K242-N244 PolarHBondContact O-N 3.28Å
243	K	66.1	Low	59.7	Low	152 Å²	152	96.5 Å²	96.5	66%	0.661	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61.3	128.9	165.9	-175	168.9	-175.9	170.7	0	109.4	H241 Q245	H241-K243 PolarHBondContact O-N 3.41Å; K243-Q245 PolarHBondContact O-N 3.48Å; K243-Q245 VanDerWaalsContact O-N 3.13Å
244	N	49.7	Very low	57.1	Low	127 Å²	127	98.5 Å²	98.5	68%	0.679	57%	0.57	S	S	*	*			trans	-74.6	102.7	-177	-140.1	6.3	0	0	0	109.8	K242 A246	K242-N244 PolarHBondContact O-N 3.28Å; N244-A246 PolarHBondContact O-N 3.39Å; N244-A246 VanDerWaalsContact O-N 3.14Å
245	Q	37.2	Very low	54.4	Low	197 Å²	197	99.8 Å²	99.8	92%	0.921	59%	0.585	S	S	*	*			trans	-80.2	89.8	171.4	-89.1	-165.8	-13	0	0	110.3	K243	K243-Q245 PolarHBondContact O-N 3.48Å; K243-Q245 VanDerWaalsContact O-N 3.13Å
246	A	37.2	Very low	51.6	Low	80 Å²	80	103.8 Å²	103.8	66%	0.661	62%	0.618	S	S	*	*			trans	-132.5	115.2	163.7	0	0	0	0	0	108.8	N244	N244-A246 PolarHBondContact O-N 3.39Å; N244-A246 VanDerWaalsContact O-N 3.14Å
247	A	33.1	Very low	49.3	Very low	109 Å²	109	105.4 Å²	105.4	90%	0.901	63%	0.634	S	S	*	*			trans	58.7	118.9	176.6	0	0	0	0	0	117.9
248	A	31.9	Very low	46.1	Very low	103 Å²	103	110.6 Å²	110.6	85%	0.851	67%	0.67	S	S	*	*			trans	-158.5	85.6	159	0	0	0	0	0	110.6
249	E	30	Very low	43.1	Very low	187 Å²	187	111.2 Å²	111.2	87%	0.874	69%	0.688	S	S	*	*			trans	-133.2	113.4	151.7	-78.2	-166.5	158.5	0	0	107.5
250	E	32.2	Very low	41	Very low	184 Å²	184	116.7 Å²	116.7	86%	0.86	72%	0.723	S	S	*	*			trans	54.4	148.2	159.7	-55.9	-60.3	96.5	0	0	123.1
251	D	27.8	Very low	38.1	Very low	165 Å²	165	121.4 Å²	121.4	88%	0.882	75%	0.753	S	S	*	*			trans	-60.6	161.4	160.5	-76.8	-65.8	0	0	0	111.4
252	G	24.1	Very low	35.5	Very low	68 Å²	68	123 Å²	123	70%	0.701	78%	0.775	S	S	*	*			cis	142.4	174	12.7	0	0	0	0	0	108.3
253	P	45.4	Very low	33.2	Very low	133 Å²	133	127 Å²	127	86%	0.864	80%	0.798	S	S	*	*			cis	-129.2	-172.7	-8.3	42.9	-27.3	0	0	0	114
254	A	24.7	Very low	31.3	Very low	94 Å²	94	127.4 Å²	127.4	78%	0.777	80%	0.802	S	S	*	*			trans	125.5	135	140	0	0	0	0	0	119.8
255	A	25.1	Very low	29.9	Very low	103 Å²	103	127.3 Å²	127.3	85%	0.851	81%	0.806	S	S	*	*			trans	66.4	117	153.5	0	0	0	0	0	122.1
256	A	25	Very low	29.3	Very low	95 Å²	95	122 Å²	122	79%	0.785	80%	0.796	S	S	*	*			trans	-82.2	177.7	154.5	0	0	0	0	0	110.3
257	P	38.8	Very low	29.6	Very low	120 Å²	120	123.6 Å²	123.6	78%	0.779	80%	0.799	S	S	*	*			cis	-129	-166.2	18.4	33	-7.4	0	0	0	113.1
258	S	23.6	Very low	29.2	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	79%	0.79	S	S	*	*			cis	-160	163.4	24.6	-38.9	0	0	0	0	114.3
259	T	23.9	Very low	28.9	Very low	133 Å²	133	127 Å²	127	82%	0.816	79%	0.79	S	S	*	*			trans	-89.1	-172.9	163.9	42.5	0	0	0	0	111.9
260	P	42.2	Very low	28.8	Very low	117 Å²	117	123.5 Å²	123.5	76%	0.76	79%	0.786	S	S	*	*			cis	-114.6	-148.7	-3.9	21.9	4.9	0	0	0	112.1
261	V	24.5	Very low	28.6	Very low	127 Å²	127	120.8 Å²	120.8	77%	0.77	78%	0.784	S	S	*	*			cis	-154	148.3	16.2	179.2	0	0	0	0	107.8
262	A	27.4	Very low	28.7	Very low	87 Å²	87	121.7 Å²	121.7	72%	0.719	78%	0.783	S	S	*	*			cis	109.8	79.7	1.9	0	0	0	0	0	118.8
263	M	27.8	Very low	29.4	Very low	176 Å²	176	123.1 Å²	123.1	87%	0.867	78%	0.78	S	S	*	*			trans	-158.6	134.7	157.7	-95.9	-178.7	164.1	0	0	108.3
264	E	25.1	Very low	28.3	Very low	161 Å²	161	123.8 Å²	123.8	75%	0.752	78%	0.777	S	S	*	*			cis	77	131	49.4	-154.5	175.1	167.6	0	0	111.3
265	T	21.2	Very low	28.8	Very low	125 Å²	125	125.2 Å²	125.2	77%	0.767	78%	0.778	S	S	*	*			cis	-155.4	179.9	42.8	-29.9	0	0	0	0	112.8
266	A	23.7	Very low	28.9	Very low	85 Å²	85	124.6 Å²	124.6	70%	0.702	77%	0.773	S	S	*	*			trans	-138.3	-169.9	167.4	0	0	0	0	0	109.4
267	P	45.2	Very low	29.2	Very low	114 Å²	114	126.3 Å²	126.3	74%	0.74	78%	0.776	S	S	*	*			cis	-132.1	-156.5	-13.6	41.7	-21.9	0	0	0	113.3
268	S	24.2	Very low	28.6	Very low	100 Å²	100	125.6 Å²	125.6	70%	0.699	77%	0.774	S	S	*	*			trans	71.2	156.8	162.4	-63.9	0	0	0	0	118.5
269	E	24.3	Very low	28.8	Very low	182 Å²	182	127.3 Å²	127.3	85%	0.85	77%	0.773	S	S	*	*			cis	-153.2	-177.2	-12	-124.5	175.1	126.5	0	0	111.6
270	S	28.6	Very low	29.4	Very low	114 Å²	114	126.7 Å²	126.7	80%	0.797	77%	0.771	S	S	*	*			trans	-86.5	158.7	179.5	-57.7	0	0	0	0	114.3
271	P	27.6	Very low	28.6	Very low	127 Å²	127	127.3 Å²	127.3	83%	0.825	77%	0.773	S	S	*	*				-154.6	177.1	105.5	39.9	-21.4	0	0	0	117.7
272	Q	29.9	Very low	28.7	Very low	184 Å²	184	125.4 Å²	125.4	86%	0.86	77%	0.77	S	S	*	*			trans	-112.8	-173.8	163.2	-75	-158.2	-82.1	0	0	109.4
273	P	38.3	Very low	28.6	Very low	98 Å²	98	126.7 Å²	126.7	64%	0.636	77%	0.774	S	S	*	*			cis	-140.7	-176.3	4.3	44.6	-25.9	0	0	0	117.8
274	D	22.5	Very low	28.6	Very low	147 Å²	147	122.4 Å²	122.4	79%	0.786	77%	0.766	S	S	*	*			trans	62.5	167	148.3	-69.8	-13.1	0	0	0	122.1
275	P	36.3	Very low	28.6	Very low	124 Å²	124	123.6 Å²	123.6	81%	0.805	77%	0.772	S	S	*	*			cis	-125.8	-172.9	-10.3	26.2	-2.8	0	0	0	114.8
276	A	26.4	Very low	28.9	Very low	91 Å²	91	123.8 Å²	123.8	75%	0.752	77%	0.773	S	S	*	*			trans	-91.3	178.1	176.5	0	0	0	0	0	114.7
277	P	30.8	Very low	29.1	Very low	131 Å²	131	125.6 Å²	125.6	85%	0.851	78%	0.775	S	S	*	*				-138.4	160.8	127	39	-28.5	0	0	0	116
278	S	26.2	Very low	28.4	Very low	104 Å²	104	125.9 Å²	125.9	73%	0.727	78%	0.777	S	S	*	*			trans	-85.1	-177.2	167.4	49	0	0	0	0	111.1
279	I	29.2	Very low	28.3	Very low	146 Å²	146	126.2 Å²	126.2	75%	0.749	78%	0.775	S	S	*	*			cis	-153.4	-164.2	27.4	-4	177	0	0	0	107.6
280	P	36.1	Very low	28.5	Very low	120 Å²	120	125.6 Å²	125.6	78%	0.779	78%	0.776	S	S	*	*			cis	-122	-117.3	7.6	28.5	-2.2	0	0	0	116.8
281	V	26	Very low	28.3	Very low	130 Å²	130	126.6 Å²	126.6	79%	0.788	77%	0.767	S	S	*	*				-155.7	164.2	-127.4	160.5	0	0	0	0	113.7
282	A	25.7	Very low	28.3	Very low	88 Å²	88	131.2 Å²	131.2	73%	0.727	77%	0.769	S	S	*	*			trans	83.8	152.3	162.5	0	0	0	0	0	119.6
283	S	25.7	Very low	28.2	Very low	113 Å²	113	126 Å²	126	79%	0.79	76%	0.756	S	S	*	*			cis	-170.2	164.8	-20.2	-96	0	0	0	0	112.6
284	A	28.3	Very low	27.8	Very low	86 Å²	86	127.1 Å²	127.1	71%	0.711	76%	0.761	S	S	*	*			trans	74.4	131.1	152.3	0	0	0	0	0	122.2
285	E	24.8	Very low	28.1	Very low	186 Å²	186	127.9 Å²	127.9	87%	0.869	76%	0.76	S	S	*	*			trans	45.7	143.2	139.5	-56.9	-169.6	131.2	0	0	120.8
286	V	27.1	Very low	27.8	Very low	129 Å²	129	129.4 Å²	129.4	78%	0.782	76%	0.762	S	S	*	*				-156.7	151.3	64.2	159.4	0	0	0	0	111.9
287	V	27.3	Very low	27.9	Very low	124 Å²	124	128 Å²	128	75%	0.752	76%	0.756	S	S	*	*			trans	-108.8	143.6	167.6	176.3	0	0	0	0	110
288	P	30.4	Very low	28	Very low	119 Å²	119	131 Å²	131	77%	0.773	76%	0.759	S	S	*	*			trans	-132.6	136.5	138.7	27.4	-11.4	0	0	0	113.6
289	T	23.7	Very low	28.1	Very low	108 Å²	108	134.8 Å²	134.8	66%	0.663	77%	0.765	S	S	*	*			trans	-93.7	136	169.6	-64.5	0	0	0	0	110	Q291	T289-Q291 HydrophobicContact CG2-CG 4.05Å
290	I	27.2	Very low	28.1	Very low	169 Å²	169	131.8 Å²	131.8	87%	0.867	76%	0.762	S	S	*	*			trans	-129.1	144.5	156.6	-65	-175.3	0	0	0	108.3
291	Q	25.5	Very low	27.7	Very low	134 Å²	134	129 Å²	129	63%	0.626	75%	0.754	S	S	*	*			trans	-118.3	175.6	-171.2	-57.7	177.1	-28.6	0	0	112.1	T289	T289-Q291 HydrophobicContact CG2-CG 4.05Å
292	R	27.1	Very low	29	Very low	225 Å²	225	128.5 Å²	128.5	85%	0.849	75%	0.754	S	S	*	*			trans	86.3	146.5	153.5	-67.6	-175.1	170.5	123.2	1.1	118.2
293	A	27	Very low	29.2	Very low	73 Å²	73	130.3 Å²	130.3	60%	0.603	76%	0.762	S	S	*	*			cis	-168.5	158	-16.9	0	0	0	0	0	112.2
294	V	30.7	Very low	29.3	Very low	122 Å²	122	128.2 Å²	128.2	74%	0.739	76%	0.758	S	S	*	*			trans	54.2	157.6	157.5	-66.9	0	0	0	0	119.1
295	E	29.1	Very low	29.4	Very low	164 Å²	164	132.1 Å²	132.1	77%	0.766	77%	0.766	S	S	*	*			cis	-149.7	164.2	6.5	-127.9	130.5	-125.6	0	0	107.6
296	D	29.2	Very low	29.5	Very low	155 Å²	155	131.4 Å²	131.4	83%	0.829	77%	0.768	S	S	*	*			cis	-128.3	-117.2	-0.6	-171	14.2	0	0	0	110.8
297	G	29.5	Very low	29.6	Very low	61 Å²	61	130.1 Å²	130.1	63%	0.629	77%	0.765	S	S	*	*			cis	122.2	127.9	1.8	0	0	0	0	0	112.3
298	E	32.1	Very low	29.5	Very low	196 Å²	196	132.1 Å²	132.1	92%	0.916	77%	0.77	S	S	*	*			cis	-124.6	170	-5.8	-67.5	-173	98.7	0	0	111.8
299	E	28.9	Very low	30	Very low	182 Å²	182	132 Å²	132	85%	0.85	77%	0.769	S	S	*	*			trans	-131.2	169.4	169.1	-121.2	-137.8	106.3	0	0	109.4
300	A	28.4	Very low	30	Very low	84 Å²	84	131.3 Å²	131.3	69%	0.694	78%	0.775	S	S	*	*			cis	-134.2	-140	18.8	0	0	0	0	0	111.4
301	G	28.8	Very low	30	Very low	60 Å²	60	128.5 Å²	128.5	62%	0.619	78%	0.777	S	S	*	*			cis	-179.5	178.6	10.6	0	0	0	0	0	112.4
302	P	52.7	Low	30.1	Very low	120 Å²	120	128 Å²	128	78%	0.779	79%	0.789	S	S	*	*				-131.5	173.9	-118.9	42.5	-31.6	0	0	0	118.5
303	S	29.7	Very low	30.4	Very low	127 Å²	127	121.9 Å²	121.9	89%	0.888	79%	0.786	S	S	*	*			trans	72.3	148	158.2	-58.2	0	0	0	0	119.1
304	G	28.4	Very low	30.8	Very low	69 Å²	69	124.5 Å²	124.5	71%	0.711	80%	0.797	S	S	*	*			cis	172.4	166.4	-7.9	0	0	0	0	0	114.6
305	L	30.3	Very low	30.9	Very low	168 Å²	168	123.6 Å²	123.6	88%	0.88	80%	0.802	S	S	*	*			trans	47.8	119.4	159.2	-57.8	177	0	0	0	121.9
306	N	26.9	Very low	31.3	Very low	170 Å²	170	120.6 Å²	120.6	91%	0.909	81%	0.805	S	S	*	*				-172.8	171.3	117	-99.4	-42.8	0	0	0	112.8
307	S	28.6	Very low	31.6	Very low	102 Å²	102	117.6 Å²	117.6	71%	0.713	80%	0.802	S	S	*	*			trans	-116.5	150.1	-162.7	48.7	0	0	0	0	116.6
308	L	25.6	Very low	31.8	Very low	166 Å²	166	124 Å²	124	87%	0.869	81%	0.813	S	S	*	*			trans	16.8	156.4	145.5	-65.4	176.6	0	0	0	122
309	P	40.2	Very low	32.4	Very low	116 Å²	116	121.9 Å²	121.9	75%	0.753	81%	0.806	S	S	*	*			cis	-135.2	-174	-4.1	37.7	-18.4	0	0	0	115.4
310	A	24.2	Very low	32.9	Very low	94 Å²	94	118.1 Å²	118.1	78%	0.777	80%	0.797	S	S	*	*			trans	126.9	155	133.1	0	0	0	0	0	119.1
311	A	27.6	Very low	33	Very low	111 Å²	111	123.1 Å²	123.1	92%	0.917	80%	0.804	S	S	*	*			trans	70.6	152.8	165.4	0	0	0	0	0	119.5
312	S	27.2	Very low	33.5	Very low	124 Å²	124	126 Å²	126	87%	0.867	81%	0.814	S	S	*	*			trans	-136.3	135.9	-167.7	52.2	0	0	0	0	113.4
313	A	32.6	Very low	32.4	Very low	96 Å²	96	123.1 Å²	123.1	79%	0.793	81%	0.807	S	S	*	*			trans	-155.2	147	162.3	0	0	0	0	0	109.5
314	P	37.1	Very low	32.8	Very low	128 Å²	128	120.7 Å²	120.7	83%	0.831	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-83.6	143.7	-174.5	32.7	-34.8	0	0	0	113.2
315	A	32.4	Very low	33	Very low	102 Å²	102	121.2 Å²	121.2	84%	0.843	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77	143.5	166.6	0	0	0	0	0	111
316	A	36.3	Very low	33.2	Very low	102 Å²	102	122 Å²	122	84%	0.843	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.4	155	-176.1	0	0	0	0	0	113.4
317	A	36.3	Very low	33.7	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.1	144.4	177.5	0	0	0	0	0	112.6
318	F	34	Very low	33.9	Very low	196 Å²	196	129 Å²	129	86%	0.86	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.5	120.8	177.7	-171.9	-92.1	0	0	0	110.7
319	I	44.4	Very low	34.1	Very low	151 Å²	151	124.5 Å²	124.5	77%	0.774	81%	0.811	S	S	*	*			trans	-106.6	120.5	179.5	-57.9	178	0	0	0	109.5
320	P	39.1	Very low	33.5	Very low	103 Å²	103	122.7 Å²	122.7	67%	0.669	81%	0.813	S	S	*	*			trans	-62.7	139.9	173.4	-24	35.4	0	0	0	112.9
321	F	30.9	Very low	33.7	Very low	190 Å²	190	126.3 Å²	126.3	83%	0.833	82%	0.819	S	S	*	*			trans	-74.2	127	-172	179.3	-91.7	0	0	0	113.2
322	S	38.6	Very low	33.6	Very low	119 Å²	119	125.9 Å²	125.9	83%	0.832	82%	0.815	S	S	*	*			trans	-118.6	108.8	162.1	-74.6	0	0	0	0	109.1	G324	S322-G324 PolarHBondContact O-N 3.4Å
323	G	30.1	Very low	33.6	Very low	61 Å²	61	123.8 Å²	123.8	63%	0.629	81%	0.813	S	S	*	*			trans	-76.8	99.3	-170.8	0	0	0	0	0	114.1
324	G	37.7	Very low	33.3	Very low	75 Å²	75	127.6 Å²	127.6	77%	0.773	81%	0.814	S	S	*	*			trans	-90.5	113	168.8	0	0	0	0	0	112.3	S322 Q326	S322-G324 PolarHBondContact O-N 3.4Å; G324-Q326 PolarHBondContact O-N 3.42Å
325	G	33.2	Very low	32.9	Very low	80 Å²	80	130 Å²	130	83%	0.825	82%	0.816	S	S	*	*			trans	-76.4	83.6	-172.7	0	0	0	0	0	116.4
326	Q	34.8	Very low	32.6	Very low	186 Å²	186	128.5 Å²	128.5	87%	0.869	81%	0.812	S	S	*	*			trans	66.6	155.9	158	-58.7	-151.5	50.4	0	0	120.3	G324	G324-Q326 PolarHBondContact O-N 3.42Å
327	R	36.8	Very low	32.3	Very low	234 Å²	234	132.7 Å²	132.7	88%	0.883	81%	0.813	S	S	*	*			trans	-140.9	145.5	179	-66.2	168.2	166.4	-102.4	4.9	109.1
328	L	32.2	Very low	31.8	Very low	183 Å²	183	133.2 Å²	133.2	96%	0.958	81%	0.811	S	S	*	*			trans	-148.1	135.6	154.5	-67.3	176.6	0	0	0	108
329	G	29.8	Very low	31.5	Very low	73 Å²	73	131.7 Å²	131.7	75%	0.753	81%	0.811	S	S	*	*			cis	165.4	126.2	-12.4	0	0	0	0	0	112.8
330	G	27.7	Very low	30.8	Very low	77 Å²	77	129 Å²	129	79%	0.794	81%	0.805	S	S	*	*			trans	80.6	159.4	172.3	0	0	0	0	0	116.3
331	L	28.4	Very low	30.2	Very low	171 Å²	171	129 Å²	129	90%	0.895	81%	0.809	S	S	*	*			cis	-152.5	144.4	-5.7	-105.6	171.7	0	0	0	111.7
332	A	26.3	Very low	30.2	Very low	101 Å²	101	125 Å²	125	84%	0.835	80%	0.803	S	S	*	*			trans	27.6	133.5	149.9	0	0	0	0	0	123.2
333	G	26.6	Very low	29.9	Very low	80 Å²	80	123.9 Å²	123.9	83%	0.825	80%	0.796	S	S	*	*			trans	178	128.8	162.9	0	0	0	0	0	111
334	E	26.2	Very low	29.9	Very low	177 Å²	177	125.5 Å²	125.5	83%	0.827	80%	0.798	S	S	*	*			trans	-85.2	162	-167.9	-60.5	173.6	80.9	0	0	115.3
335	M	29.6	Very low	29.6	Very low	177 Å²	177	130.5 Å²	130.5	87%	0.872	81%	0.806	S	S	*	*			trans	56.6	124.8	146.3	-142.6	76.4	72.2	0	0	120.1
336	G	26.5	Very low	29.4	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	80%	0.803	S	S	*	*			trans	159.7	127.7	161.3	0	0	0	0	0	116.1
337	H	29	Very low	29.1	Very low	190 Å²	190	126.8 Å²	126.8	88%	0.88	80%	0.799	S	S	*	*			trans	-73.6	146.9	-178	-67.1	-97.9	0	0	0	114.7
338	S	25.4	Very low	28.6	Very low	101 Å²	101	123.9 Å²	123.9	71%	0.706	80%	0.8	S	S	*	*			trans	13.1	154.8	142.6	-51.9	0	0	0	0	123.1
339	L	28.8	Very low	28.4	Very low	165 Å²	165	120.9 Å²	120.9	86%	0.864	79%	0.789	S	S	*	*			trans	77.2	149.5	169.6	-45.8	-179.9	0	0	0	113.9
340	S	28.7	Very low	28.7	Very low	93 Å²	93	123.4 Å²	123.4	65%	0.65	79%	0.793	S	S	*	*			cis	-172.8	-168.6	-18.8	-96.2	0	0	0	0	107
341	S	27.8	Very low	28.7	Very low	105 Å²	105	125.8 Å²	125.8	73%	0.734	79%	0.792	S	S	*	*			trans	81.6	139.5	170.2	-49.5	0	0	0	0	114.7
342	S	29.8	Very low	28.8	Very low	104 Å²	104	123.7 Å²	123.7	73%	0.727	79%	0.786	S	S	*	*			cis	72.1	135	33.8	89.1	0	0	0	0	113.5
343	S	31.6	Very low	28.8	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	79%	0.79	S	S	*	*			cis	-169.1	165.5	-6.2	38	0	0	0	0	110.2
344	S	31.3	Very low	29	Very low	95 Å²	95	129.4 Å²	129.4	66%	0.664	79%	0.786	S	S	*	*			trans	54	127.9	148.9	61.7	0	0	0	0	121.2
345	L	31.3	Very low	29.4	Very low	180 Å²	180	127.3 Å²	127.3	94%	0.942	79%	0.787	S	S	*	*				172.4	179.5	107.3	-87.6	178.6	0	0	0	110.9
346	A	28.3	Very low	29.2	Very low	93 Å²	93	128.7 Å²	128.7	77%	0.769	79%	0.788	S	S	*	*			trans	-130.6	162.7	-162	0	0	0	0	0	115.6
347	A	28.9	Very low	29.4	Very low	95 Å²	95	129.4 Å²	129.4	79%	0.785	79%	0.787	S	S	*	*			trans	67.3	132.8	162.2	0	0	0	0	0	120
348	L	27.6	Very low	29.6	Very low	173 Å²	173	130.5 Å²	130.5	91%	0.906	79%	0.79	S	S	*	*				-171.6	169.4	126.6	-103	170.1	0	0	0	112
349	T	27.9	Very low	29.8	Very low	119 Å²	119	135 Å²	135	73%	0.73	80%	0.797	S	S	*	*			trans	-95.6	170.7	-176.8	54.2	0	0	0	0	113.1
350	P	35.7	Very low	29.6	Very low	126 Å²	126	132.1 Å²	132.1	82%	0.818	80%	0.796	S	S	*	*				-146	171	124.5	39.2	-25.5	0	0	0	115.8
351	T	27.1	Very low	29.6	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	80%	0.803	S	S	*	*			trans	-150.7	158.3	-178.9	54.4	0	0	0	0	109.8
352	V	30.7	Very low	29.4	Very low	127 Å²	127	136 Å²	136	77%	0.77	80%	0.801	S	S	*	*			cis	-158.9	149.9	-14.8	124.3	0	0	0	0	108.1
353	Q	25.9	Very low	29.2	Very low	195 Å²	195	138.3 Å²	138.3	91%	0.911	81%	0.805	S	S	*	*			trans	-150.9	160.3	160.5	-114.8	-178.8	38.8	0	0	112.4
354	S	31.3	Very low	29	Very low	105 Å²	105	141 Å²	141	73%	0.734	81%	0.806	S	S	*	*			trans	-156	154.9	-172.6	-47.8	0	0	0	0	112.7
355	P	33.6	Very low	28.9	Very low	133 Å²	133	140.6 Å²	140.6	86%	0.864	80%	0.803	S	S	*	*			trans	-113.8	153.5	153.4	-1.5	23.1	0	0	0	114.5
356	K	26.8	Very low	28.8	Very low	206 Å²	206	139 Å²	139	90%	0.896	80%	0.801	S	S	*	*			trans	-80.5	169.6	169.9	-69.6	163.9	179	168.2	0	110.6
357	A	31.1	Very low	28.9	Very low	87 Å²	87	143.3 Å²	143.3	72%	0.719	80%	0.803	S	S	*	*			cis	175.8	151.9	-27.9	0	0	0	0	0	108.2
358	K	33	Very low	28.7	Very low	213 Å²	213	144.9 Å²	144.9	93%	0.926	81%	0.806	S	S	*	*			trans	-162.4	89.9	157.4	-116.2	167	-173	178.1	0	116.5
359	K	28.3	Very low	29.1	Very low	197 Å²	197	145.8 Å²	145.8	86%	0.857	80%	0.803	S	S	*	*			trans	-6.7	126.6	149.9	-177.2	-176.5	-176.6	-179.3	0	119.5
360	A	26.1	Very low	29.2	Very low	104 Å²	104	144.9 Å²	144.9	86%	0.86	81%	0.808	S	S	*	*			trans	-139.1	166.1	147.6	0	0	0	0	0	109.4
361	K	28.7	Very low	28.9	Very low	182 Å²	182	144.8 Å²	144.8	79%	0.791	81%	0.805	S	S	*	*			trans	-152.3	133.9	-159.7	-169.4	-169.1	176.8	-172.2	0	115.3
362	S	23.2	Very low	29.6	Very low	98 Å²	98	145.6 Å²	145.6	69%	0.685	81%	0.81	S	S	*	*			trans	69.7	160.8	161.7	83.3	0	0	0	0	117
363	N	25	Very low	29.9	Very low	152 Å²	152	148.9 Å²	148.9	81%	0.813	81%	0.814	S	S	*	*			cis	-155.2	164.9	4.5	-140	3.9	0	0	0	114.4
364	H	28.3	Very low	30.4	Very low	153 Å²	153	145 Å²	145	71%	0.708	81%	0.808	S	S	*	*			trans	65.5	93.7	149	-161.4	-79	0	0	0	122.3
365	S	28.3	Very low	30.7	Very low	86 Å²	86	143.7 Å²	143.7	60%	0.601	80%	0.803	S	S	*	*				41.6	121.8	125.8	161.8	0	0	0	0	121.4
366	T	28.7	Very low	30.6	Very low	147 Å²	147	144.1 Å²	144.1	90%	0.902	80%	0.798	S	S	*	*				-140.2	158	122.2	-18	0	0	0	0	111.8
367	K	30.2	Very low	31.3	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.796	79%	0.793	S	S	*	*			trans	-102	118.1	-165.1	168.2	-171.8	177.2	-179.8	0	112.3
368	C	26.4	Very low	32	Very low	128 Å²	128	144.1 Å²	144.1	87%	0.865	78%	0.78	S	S	*	*			trans	-122.7	123.5	166.6	-70.5	0	0	0	0	110.5
369	K	35.5	Very low	32.6	Very low	192 Å²	192	139.6 Å²	139.6	84%	0.835	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-76.1	121.4	164.7	-77.6	-176.5	172.3	-174.7	0	108.2
370	A	29.6	Very low	33.3	Very low	101 Å²	101	136.1 Å²	136.1	84%	0.835	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-103	127.8	152.5	0	0	0	0	0	107.2
371	T	28.5	Very low	34.4	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-83.7	128.2	-176.9	40.8	0	0	0	0	111.3	K373	T371-K373 PolarHBondContact O-N 2.82Å
372	V	41.7	Very low	35.5	Very low	145 Å²	145	129.2 Å²	129.2	88%	0.879	72%	0.716	S	S	*	*			trans	-59.8	113.9	160.3	176.6	0	0	0	0	108.2
373	K	38.1	Very low	37	Very low	196 Å²	196	131 Å²	131	85%	0.852	71%	0.714	S	S	*	*			trans	-176.2	65.1	163.8	-111.3	179.6	-178.3	-166.1	0	113	T371	T371-K373 PolarHBondContact O-N 2.82Å
374	S	37.1	Very low	38.6	Very low	114 Å²	114	129 Å²	129	80%	0.797	70%	0.7	S	S	*	*	S	Bend	trans	-165.9	43.7	168.6	66.5	0	0	0	0	113.3
375	A	36.4	Very low	39.9	Very low	76 Å²	76	122.8 Å²	122.8	63%	0.628	67%	0.671	S	S	*	*	S	Bend	trans	-134.5	7.5	175.1	0	0	0	0	0	112.6
376	D	32.6	Very low	41.3	Very low	142 Å²	142	123.8 Å²	123.8	76%	0.759	67%	0.669	S	S	*	*	S	Bend	trans	-117.2	12.2	-162.9	-135	22.9	0	0	0	111.3
377	R	41.1	Very low	42.9	Very low	209 Å²	209	123.7 Å²	123.7	79%	0.789	66%	0.658	S	S	*	*	S	Bend	trans	-127	-27.2	-177.5	-84.1	-169.8	165.1	-162.4	-8.1	113.9	L379 N381	R377-L379 VanDerWaalsContact C-N 3.28Å; R377-L379 PolarHBondContact O-N 3.22Å; R377-N381 WeakPolarHBondContact O-CB 3.43Å; R377-N381 PolarHBondContact O-N 3.23Å
378	D	45.7	Very low	44.6	Very low	84 Å²	84	119.8 Å²	119.8	45%	0.449	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-19.5	174.5	-62.6	-90.2	0	0	0	112.6	T382 K453	D378-T382 PolarHBondContact O-OG1 3.21Å; D378-K453 IonicContact OD1-NZ 3.95Å; D378-K453 PolarHBondContact OD1-NZ 3.44Å
379	L	44.6	Very low	47	Very low	119 Å²	119	114.9 Å²	114.9	62%	0.623	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-53.5	175.7	-60.2	178.5	0	0	0	111.2	R377 N381 T382 E383	R377-L379 VanDerWaalsContact C-N 3.28Å; R377-L379 PolarHBondContact O-N 3.22Å; L379-N381 VanDerWaalsContact C-N 3.33Å; L379-N381 PolarHBondContact O-N 3.26Å; L379-T382 WeakPolarHBondContact O-CA 3.5Å; L379-T382 WeakPolarHBondContact O-CB 3.26Å; L379-T382 PolarHBondContact O-N 2.64Å; L379-E383 PolarHBondContact O-N 3.06Å
380	D	43.7	Very low	49.4	Very low	123 Å²	123	111.2 Å²	111.2	66%	0.658	61%	0.607	S	S	*	*	H	α-helix	trans	-50.9	-50	177.4	-160.4	34.5	0	0	0	111.3	T382 E383	D380-T382 PolarHBondContact O-N 3.32Å; D380-E383 PolarHBondContact O-N 2.97Å
381	N	49.7	Very low	52.3	Low	74 Å²	74	108.5 Å²	108.5	40%	0.396	58%	0.575	S	S	.	*	H	α-helix	trans	-70.3	-10.5	177.1	-165.8	98.4	0	0	0	114.4	R377 L379 F385	R377-N381 WeakPolarHBondContact O-CB 3.43Å; R377-N381 PolarHBondContact O-N 3.23Å; L379-N381 VanDerWaalsContact C-N 3.33Å; L379-N381 PolarHBondContact O-N 3.26Å; N381-F385 WeakPolarHBondContact O-CD2 3.43Å; N381-F385 WeakPolarHBondContact O-CE2 3.36Å
382	T	52	Low	55.3	Low	67 Å²	67	106.2 Å²	106.2	41%	0.411	56%	0.556	S	S	.	*	H	α-helix	trans	-87.1	-32.8	174.6	-62.6	0	0	0	0	111.5	D378 L379 D380 F385	D378-T382 PolarHBondContact O-OG1 3.21Å; L379-T382 WeakPolarHBondContact O-CA 3.5Å; L379-T382 WeakPolarHBondContact O-CB 3.26Å; L379-T382 PolarHBondContact O-N 2.64Å; D380-T382 PolarHBondContact O-N 3.32Å; T382-F385 PolarHBondContact O-N 2.75Å
383	E	53.5	Low	57.8	Low	135 Å²	135	102.2 Å²	102.2	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-69.9	-34.9	-178.9	-62.7	-171.4	156.3	0	0	112	L379 D380 F385 L386 E387	L379-E383 PolarHBondContact O-N 3.06Å; D380-E383 PolarHBondContact O-N 2.97Å; E383-F385 PolarHBondContact O-N 3.41Å; E383-F385 VanDerWaalsContact O-N 3.15Å; E383-L386 PolarHBondContact O-N 3.28Å; E383-E387 PolarHBondContact O-N 3.35Å
384	E	58.1	Low	60.4	Low	112 Å²	112	95 Å²	95	52%	0.523	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.1	176.1	-151.3	-149.6	123.3	0	0	113.8	R479	E384-R479 VanDerWaalsContact O-CZ 3.26Å; E384-R479 PolarHBondContact O-NE 3.19Å; E384-R479 PolarHBondContact O-NH2 2.87Å; E384-R479 IonicContact OE1-CZ 3.57Å; E384-R479 IonicContact OE1-NH1 2.68Å; E384-R479 IonicContact OE1-NH2 2.66Å; E384-R479 PolarHBondContact OE1-NH2 3.28Å
385	F	56.9	Low	63.2	Low	21 Å²	21	90 Å²	90	9%	0.092	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-8.5	174.6	-71	-60.3	0	0	0	114	N381 T382 E383 P460 R479 P480 L481	N381-F385 WeakPolarHBondContact O-CD2 3.43Å; N381-F385 WeakPolarHBondContact O-CE2 3.36Å; T382-F385 PolarHBondContact O-N 2.75Å; E383-F385 PolarHBondContact O-N 3.41Å; E383-F385 VanDerWaalsContact O-N 3.15Å; F385-P460 HydrophobicContact CE1-CB 4.12Å; F385-R479 WeakPolarHBondContact O-CB 3.43Å; F385-P480 HydrophobicContact CD1-CG 4.47Å; F385-L481 HydrophobicContact CB-CD1 3.85Å; F385-L481 HydrophobicContact CB-CG 4.24Å
386	L	57.2	Low	65.9	Low	107 Å²	107	87.4 Å²	87.4	56%	0.56	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-23.4	-179.8	-63.1	175.2	0	0	0	112.9	E383 L481	E383-L386 PolarHBondContact O-N 3.28Å; L386-L481 HydrophobicContact CD2-CB 4.21Å; L386-L481 HydrophobicContact CD2-CD1 4.25Å
387	E	62.8	Low	68.8	Low	145 Å²	145	83.4 Å²	83.4	68%	0.678	42%	0.418	S	S	*	.	S	Bend	trans	-68	128.9	171.8	-65.8	-155.2	142	0	0	111.3	E383 V389	E383-E387 PolarHBondContact O-N 3.35Å; E387-V389 PolarHBondContact O-N 2.82Å
388	P	64.9	Low	71.1	Confident	101 Å²	101	77 Å²	77	66%	0.656	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-63.1	120.4	177.4	-23.3	34.2	0	0	0	111.9
389	V	78.1	Confident	72.9	Confident	25 Å²	25	77.1 Å²	77.1	15%	0.152	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-73.8	150.8	176.2	165.4	0	0	0	0	110.7	E387 R391 R479	E387-V389 PolarHBondContact O-N 2.82Å; V389-R391 VanDerWaalsContact O-CD 3.24Å; V389-R391 WeakPolarHBondContact O-CD 3.32Å; V389-R391 PolarHBondContact O-N 2.68Å; V389-R391 PolarHBondContact O-NE 3.19Å; V389-R479 HydrophobicContact CB-CG 4.46Å; V389-R479 HydrophobicContact CG2-CG 3.67Å
390	D	85.1	Confident	74.4	Confident	115 Å²	115	73.3 Å²	73.3	62%	0.615	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-56	125.9	169	-173.8	-3.2	0	0	0	109.3	E392	D390-E392 HydrophobicContact CB-CG 4.42Å; D390-E392 PolarHBondContact O-N 2.97Å; D390-E392 PolarHBondContact OD1-N 2.59Å
391	R	90.9	Very high	75.5	Confident	44 Å²	44	71.5 Å²	71.5	17%	0.166	38%	0.376	C	S	.	.			trans	-76.6	-15.2	-170.3	-53.8	-56.2	178.5	77.3	-1.2	112.3	V389 P393 G476 F477 E482 F490	V389-R391 VanDerWaalsContact O-CD 3.24Å; V389-R391 WeakPolarHBondContact O-CD 3.32Å; V389-R391 PolarHBondContact O-N 2.68Å; V389-R391 PolarHBondContact O-NE 3.19Å; R391-P393 VanDerWaalsContact C-N 3.33Å; R391-G476 CarbonylContact O-C 3.57Å; R391-G476 VanDerWaalsContact O-CA 3.26Å; R391-G476 WeakPolarHBondContact O-CA 3.48Å; R391-F477 WeakPolarHBondContact CD-O 3.26Å; R391-F477 PolarHBondContact O-N 3.15Å; R391-E482 IonicContact CZ-OE2 3.83Å; R391-E482 VanDerWaalsContact CZ-OE2 3.23Å; R391-E482 IonicContact NE-OE2 2.42Å; R391-E482 IonicContact NH1-OE2 3.78Å; R391-E482 IonicContact NH2-OE2 3.36Å; R391-E482 PolarHBondContact NH2-OE2 2.98Å; R391-F490 HydrophobicContact CB-CD2 3.83Å; R391-F490 HydrophobicContact CB-CE2 3.49Å; R391-F490 VanDerWaalsContact CB-CE2 3.49Å; R391-F490 HydrophobicContact CB-CZ 4.34Å; R391-F490 HydrophobicContact CG-CD2 3.84Å; R391-F490 HydrophobicContact CG-CE2 4.05Å
392	E	90.9	Very high	75.9	Confident	77 Å²	77	72.4 Å²	72.4	36%	0.36	39%	0.388	S	S	.	.			trans	40.3	56.6	179.2	-62	167	-140.6	0	0	111.4	D390 L394 K461 F477	D390-E392 HydrophobicContact CB-CG 4.42Å; D390-E392 PolarHBondContact O-N 2.97Å; D390-E392 PolarHBondContact OD1-N 2.59Å; E392-L394 PolarHBondContact O-N 3.34Å; E392-K461 IonicContact OE1-NZ 3.29Å; E392-K461 PolarHBondContact OE1-NZ 2.91Å; E392-K461 IonicContact OE2-NZ 2.8Å; E392-F477 HydrophobicContact CB-CD2 3.81Å; E392-F477 HydrophobicContact CB-CE2 4.12Å
393	P	93.4	Very high	75.8	Confident	60 Å²	60	81 Å²	81	39%	0.39	41%	0.412	S	S	.	.			trans	-67.5	124.7	-166.5	26.6	-34.4	0	0	0	111.9	R391 L474 Q475 F490 H494	R391-P393 VanDerWaalsContact C-N 3.33Å; P393-L474 HydrophobicContact CB-CD1 4.24Å; P393-Q475 WeakPolarHBondContact CA-O 3.35Å; P393-F490 HydrophobicContact CB-CE2 4.06Å; P393-F490 HydrophobicContact CB-CZ 4.06Å; P393-H494 WeakPolarHBondContact CB-NE2 3.29Å
394	L	94.3	Very high	75.7	Confident	45 Å²	45	81 Å²	81	24%	0.236	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.1	176.3	-65.6	178.3	0	0	0	110	E392 Q475 V552 S560	E392-L394 PolarHBondContact O-N 3.34Å; L394-Q475 HydrophobicContact CB-CB 4.38Å; L394-Q475 PolarHBondContact N-O 3.14Å; L394-Q475 VanDerWaalsContact N-O 3.07Å; L394-Q475 PolarHBondContact O-N 3.25Å; L394-V552 HydrophobicContact CB-CG2 4.16Å; L394-V552 HydrophobicContact CD2-CG1 4.28Å; L394-V552 HydrophobicContact CD2-CG2 4.38Å; L394-S560 WeakPolarHBondContact CD1-OG 3.47Å
395	I	95	Very high	75.2	Confident	10 Å²	10	81.3 Å²	81.3	5%	0.051	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.7	176.2	-70.7	150.3	0	0	0	109.3	V473 L474 I543 L547 L548 S551 V552	I395-V473 WeakPolarHBondContact CA-O 3.13Å; I395-L474 HydrophobicContact CD1-CD1 4Å; I395-L474 HydrophobicContact CG1-CB 4.24Å; I395-L474 HydrophobicContact CG1-CD1 3.58Å; I395-I543 HydrophobicContact CD1-CG2 3.71Å; I395-I543 HydrophobicContact CG1-CD1 4.47Å; I395-I543 HydrophobicContact CG2-CD1 4.12Å; I395-L547 HydrophobicContact CD1-CB 3.53Å; I395-L547 HydrophobicContact CD1-CD1 4.02Å; I395-L547 HydrophobicContact CD1-CG 4.4Å; I395-L548 HydrophobicContact CG2-CD2 4.08Å; I395-S551 CarbonylContact O-C 3.55Å; I395-S551 VanDerWaalsContact O-CA 3.26Å; I395-S551 WeakPolarHBondContact O-CA 3.42Å; I395-S551 WeakPolarHBondContact O-CB 3.49Å; I395-V552 PolarHBondContact O-N 3.16Å
396	Y	94.1	Very high	74.9	Confident	20 Å²	20	85.4 Å²	85.4	8%	0.078	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	153.2	171.9	67.3	-89.2	0	0	0	110.6	R465 V473 V552 A554 A557	Y396-R465 WeakPolarHBondContact OH-CD 3.44Å; Y396-V473 HydrophobicContact CD1-CB 4.23Å; Y396-V473 HydrophobicContact CD2-CB 4.38Å; Y396-V473 HydrophobicContact CE1-CB 3.82Å; Y396-V473 HydrophobicContact CE1-CG1 3.78Å; Y396-V473 HydrophobicContact CE2-CB 3.98Å; Y396-V473 HydrophobicContact CE2-CG2 3.98Å; Y396-V473 HydrophobicContact CG-CB 4.5Å; Y396-V473 PolarHBondContact N-O 3.37Å; Y396-V473 VanDerWaalsContact N-O 3.08Å; Y396-V473 PolarHBondContact O-N 2.92Å; Y396-V552 WeakPolarHBondContact CA-O 2.82Å; Y396-V552 WeakPolarHBondContact CB-O 3.33Å; Y396-A554 HydrophobicContact CD2-CB 3.61Å; Y396-A554 HydrophobicContact CE2-CB 3.74Å; Y396-A554 HydrophobicContact CG-CB 4.28Å; Y396-A557 HydrophobicContact CD1-CB 3.48Å; Y396-A557 VanDerWaalsContact CD1-CB 3.48Å; Y396-A557 HydrophobicContact CE1-CB 3.65Å; Y396-A557 HydrophobicContact CG-CB 4.3Å
397	H	93.1	Very high	74.7	Confident	58 Å²	58	87.5 Å²	87.5	27%	0.269	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	143.5	172.2	-171.5	-95.2	0	0	0	110.7	D399 S400 D470 H472	H397-D399 WeakPolarHBondContact CE1-CB 3.4Å; H397-D399 IonicContact CE1-OD2 3.19Å; H397-D399 PolarHBondContact CE1-OD2 2.82Å; H397-D399 WeakPolarHBondContact ND1-CB 3.48Å; H397-D399 PolarHBondContact ND1-N 3.28Å; H397-D399 IonicContact ND1-OD2 3.04Å; H397-D399 PolarHBondContact O-N 3.36Å; H397-S400 VanDerWaalsContact O-CB 3.31Å; H397-S400 WeakPolarHBondContact O-CB 3.42Å; H397-S400 PolarHBondContact O-N 3.24Å; H397-S400 PolarHBondContact O-OG 2.64Å; H397-D470 PolarHBondContact NE2-O 2.91Å; H397-H472 AromaticContact CD2-CD2 3.54Å; H397-H472 AromaticContact CD2-CE1 3.92Å; H397-H472 AromaticContact CD2-CG 3.97Å; H397-H472 AromaticContact CD2-NE2 3.48Å; H397-H472 PolarHBondContact CD2-NE2 3.13Å
398	M	88.9	Confident	74.6	Confident	75 Å²	75	89.2 Å²	89.2	37%	0.369	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.6	-175.8	-153.6	174.1	78.7	0	0	113.7	R471	M398-R471 HydrophobicContact CB-CB 4.16Å; M398-R471 WeakPolarHBondContact CB-O 3.27Å; M398-R471 PolarHBondContact N-O 2.99Å
399	D	83.9	Confident	75.1	Confident	86 Å²	86	87.8 Å²	87.8	46%	0.46	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-5.2	170.1	-61.8	-37.1	0	0	0	113.6	H397 V401 R471	H397-D399 WeakPolarHBondContact CE1-CB 3.4Å; H397-D399 IonicContact CE1-OD2 3.19Å; H397-D399 PolarHBondContact CE1-OD2 2.82Å; H397-D399 WeakPolarHBondContact ND1-CB 3.48Å; H397-D399 PolarHBondContact ND1-N 3.28Å; H397-D399 IonicContact ND1-OD2 3.04Å; H397-D399 PolarHBondContact O-N 3.36Å; D399-V401 PolarHBondContact O-N 3.08Å; D399-R471 VanDerWaalsContact CG-NH1 3.29Å; D399-R471 IonicContact OD1-CZ 2.67Å; D399-R471 IonicContact OD1-NH1 2.73Å; D399-R471 PolarHBondContact OD1-NH1 3.05Å; D399-R471 VanDerWaalsContact OD1-NH1 3.14Å; D399-R471 IonicContact OD1-NH2 2.67Å; D399-R471 PolarHBondContact OD1-NH2 2.96Å; D399-R471 IonicContact OD2-CZ 2.76Å; D399-R471 VanDerWaalsContact OD2-CZ 3.29Å; D399-R471 IonicContact OD2-NH1 2.6Å; D399-R471 PolarHBondContact OD2-NH1 3.18Å; D399-R471 IonicContact OD2-NH2 3.63Å
400	S	75.3	Confident	75.4	Confident	40 Å²	40	94.2 Å²	94.2	28%	0.28	49%	0.49	S	S	.	.			trans	-71.8	-4.3	167.9	76.8	0	0	0	0	112.9	H397 S402	H397-S400 VanDerWaalsContact O-CB 3.31Å; H397-S400 WeakPolarHBondContact O-CB 3.42Å; H397-S400 PolarHBondContact O-N 3.24Å; H397-S400 PolarHBondContact O-OG 2.64Å; S400-S402 PolarHBondContact O-N 3.09Å
401	V	67.4	Low	75.6	Confident	85 Å²	85	92.9 Å²	92.9	52%	0.515	48%	0.483	S	S	.	.	S	Bend	trans	-65.2	89	157.5	-176.1	0	0	0	0	107.2	D399 R403 A554	D399-V401 PolarHBondContact O-N 3.08Å; V401-R403 PolarHBondContact O-N 3.02Å; V401-R403 VanDerWaalsContact O-N 3.15Å; V401-A554 HydrophobicContact CG2-CB 3.63Å
402	S	57.2	Low	75.7	Confident	93 Å²	93	94.9 Å²	94.9	65%	0.65	50%	0.501	S	S	*	.			trans	-43.5	125.9	167.7	-67.5	0	0	0	0	108.8	S400 R404	S400-S402 PolarHBondContact O-N 3.09Å; S402-R404 PolarHBondContact O-N 3.38Å
403	R	51.2	Low	75.8	Confident	246 Å²	246	97.6 Å²	97.6	93%	0.928	52%	0.518	S	S	*	.			trans	-62.7	87.1	169.8	-75.3	-172.5	179.3	-172.8	1.4	108	V401 S405	V401-R403 PolarHBondContact O-N 3.02Å; V401-R403 VanDerWaalsContact O-N 3.15Å; R403-S405 PolarHBondContact O-N 3.48Å
404	R	50.4	Low	75.9	Confident	135 Å²	135	102.2 Å²	102.2	51%	0.509	54%	0.535	S	S	.	.			trans	-61.1	110.9	171.4	-69.8	-165.6	175	-173.3	-8.1	106.5	S402 E406	S402-R404 PolarHBondContact O-N 3.38Å; R404-E406 HydrophobicContact CB-CB 4.15Å; R404-E406 HydrophobicContact CB-CG 4.13Å; R404-E406 VanDerWaalsContact CD-CD 3.41Å; R404-E406 WeakPolarHBondContact CD-OE2 3.27Å; R404-E406 IonicContact CZ-OE1 3.14Å; R404-E406 IonicContact CZ-OE2 3.67Å; R404-E406 IonicContact NE-OE2 2.82Å; R404-E406 IonicContact NH1-OE1 3.72Å; R404-E406 PolarHBondContact NH1-OE1 3.11Å; R404-E406 IonicContact NH1-OE2 3.93Å; R404-E406 PolarHBondContact NH1-OE2 2.91Å; R404-E406 PolarHBondContact O-N 2.96Å
405	S	47.6	Very low	75.9	Confident	119 Å²	119	106.6 Å²	106.6	83%	0.832	55%	0.552	S	S	*	*			trans	-73.8	49	148.7	61.8	0	0	0	0	109.1	R403 D407	R403-S405 PolarHBondContact O-N 3.48Å; S405-D407 PolarHBondContact O-N 3.25Å
406	E	50.3	Low	76	Confident	107 Å²	107	112.5 Å²	112.5	50%	0.5	58%	0.578	S	S	.	*			trans	-66.9	119.7	143.9	-79.3	175.1	156.7	0	0	103.6	R404 H408	R404-E406 HydrophobicContact CB-CB 4.15Å; R404-E406 HydrophobicContact CB-CG 4.13Å; R404-E406 VanDerWaalsContact CD-CD 3.41Å; R404-E406 WeakPolarHBondContact CD-OE2 3.27Å; R404-E406 IonicContact CZ-OE1 3.14Å; R404-E406 IonicContact CZ-OE2 3.67Å; R404-E406 IonicContact NE-OE2 2.82Å; R404-E406 IonicContact NH1-OE1 3.72Å; R404-E406 PolarHBondContact NH1-OE1 3.11Å; R404-E406 IonicContact NH1-OE2 3.93Å; R404-E406 PolarHBondContact NH1-OE2 2.91Å; R404-E406 PolarHBondContact O-N 2.96Å; E406-H408 VanDerWaalsContact C-N 3.28Å; E406-H408 PolarHBondContact O-N 3.01Å
407	D	54	Low	76.1	Confident	152 Å²	152	118.3 Å²	118.3	81%	0.813	61%	0.605	S	S	*	*			trans	-59	102.9	163.9	-74.4	-52.8	0	0	0	106.5	S405 A409	S405-D407 PolarHBondContact O-N 3.25Å; D407-A409 PolarHBondContact O-N 3.48Å
408	H	60	Low	76.2	Confident	181 Å²	181	120.9 Å²	120.9	84%	0.838	63%	0.625	S	S	*	*			trans	-61.7	74.9	144.8	-72.6	-58.9	0	0	0	106.1	E406 D410	E406-H408 VanDerWaalsContact C-N 3.28Å; E406-H408 PolarHBondContact O-N 3.01Å; H408-D410 PolarHBondContact O-N 3.41Å
409	A	75.8	Confident	76.6	Confident	70 Å²	70	120.5 Å²	120.5	58%	0.579	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-53	125.9	177	0	0	0	0	0	106.8	D407 L411	D407-A409 PolarHBondContact O-N 3.48Å; A409-L411 PolarHBondContact O-N 2.94Å
410	D	83.7	Confident	77.3	Confident	160 Å²	160	121.8 Å²	121.8	86%	0.856	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-55	120.2	-170.9	-153.3	3	0	0	0	108.4	H408	H408-D410 PolarHBondContact O-N 3.41Å
411	L	90.1	Very high	78.4	Confident	87 Å²	87	123.5 Å²	123.5	46%	0.455	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-65.6	129.3	-168.1	-67.8	177.1	0	0	0	107.7	A409 F415 F416	A409-L411 PolarHBondContact O-N 2.94Å; L411-F415 HydrophobicContact CB-CB 4.46Å; L411-F415 HydrophobicContact CB-CD1 4.18Å; L411-F415 HydrophobicContact CB-CG 4.43Å; L411-F415 HydrophobicContact CD1-CD1 3.8Å; L411-F415 HydrophobicContact CD1-CE1 3.7Å; L411-F415 HydrophobicContact CD1-CG 4.41Å; L411-F415 HydrophobicContact CD1-CZ 4.22Å; L411-F416 HydrophobicContact CB-CE2 3.82Å; L411-F416 HydrophobicContact CB-CZ 4.06Å; L411-F416 HydrophobicContact CD1-CZ 4.3Å
412	P	93.9	Very high	79.9	Confident	86 Å²	86	122.2 Å²	122.2	56%	0.558	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-59.9	145.2	-174	25.8	-35	0	0	0	110.1	E414 F415	P412-E414 PolarHBondContact O-N 2.91Å; P412-F415 VanDerWaalsContact O-CB 3.28Å; P412-F415 WeakPolarHBondContact O-CB 3.46Å; P412-F415 PolarHBondContact O-N 3.43Å
413	D	92.2	Very high	81.8	Confident	134 Å²	134	122 Å²	122	72%	0.717	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-49.6	-34.4	-177.5	-68.6	-22.6	0	0	0	112.7	F415 F416 E417	D413-F415 PolarHBondContact O-N 3.23Å; D413-F416 CarbonylContact O-C 3.56Å; D413-F416 WeakPolarHBondContact O-CA 3.48Å; D413-F416 WeakPolarHBondContact O-CB 3.43Å; D413-F416 PolarHBondContact O-N 2.82Å; D413-E417 PolarHBondContact O-N 2.96Å; D413-E417 VanDerWaalsContact O-N 3.13Å
414	E	95.7	Very high	84	Confident	157 Å²	157	117.7 Å²	117.7	73%	0.734	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-55.8	-29.1	174.8	-171.7	174.9	-170.2	0	0	114.1	P412 F416 E417	P412-E414 PolarHBondContact O-N 2.91Å; E414-F416 PolarHBondContact O-N 3.36Å; E414-E417 PolarHBondContact O-N 2.3Å
415	F	94.8	Very high	86.3	Confident	137 Å²	137	117.3 Å²	117.3	60%	0.601	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-66.5	-26.5	172.6	175.1	-94.8	0	0	0	112.6	L411 P412 D413	L411-F415 HydrophobicContact CB-CB 4.46Å; L411-F415 HydrophobicContact CB-CD1 4.18Å; L411-F415 HydrophobicContact CB-CG 4.43Å; L411-F415 HydrophobicContact CD1-CD1 3.8Å; L411-F415 HydrophobicContact CD1-CE1 3.7Å; L411-F415 HydrophobicContact CD1-CG 4.41Å; L411-F415 HydrophobicContact CD1-CZ 4.22Å; P412-F415 VanDerWaalsContact O-CB 3.28Å; P412-F415 WeakPolarHBondContact O-CB 3.46Å; P412-F415 PolarHBondContact O-N 3.43Å; D413-F415 PolarHBondContact O-N 3.23Å
416	F	95.3	Very high	88.7	Confident	135 Å²	135	117.5 Å²	117.5	59%	0.592	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-9	177.5	-56.4	-78	0	0	0	112.9	L411 D413 E414	L411-F416 HydrophobicContact CB-CE2 3.82Å; L411-F416 HydrophobicContact CB-CZ 4.06Å; L411-F416 HydrophobicContact CD1-CZ 4.3Å; D413-F416 CarbonylContact O-C 3.56Å; D413-F416 WeakPolarHBondContact O-CA 3.48Å; D413-F416 WeakPolarHBondContact O-CB 3.43Å; D413-F416 PolarHBondContact O-N 2.82Å; E414-F416 PolarHBondContact O-N 3.36Å
417	E	96.2	Very high	91	Very high	141 Å²	141	118.9 Å²	118.9	66%	0.659	60%	0.601	S	S	*	*	S	Bend	trans	-73.5	133.2	173	-68.1	-158.7	171.6	0	0	111.4	D413 E414 T419	D413-E417 PolarHBondContact O-N 2.96Å; D413-E417 VanDerWaalsContact O-N 3.13Å; E414-E417 PolarHBondContact O-N 2.3Å; E417-T419 PolarHBondContact O-N 2.42Å
418	V	97.1	Very high	93.1	Very high	113 Å²	113	114.2 Å²	114.2	69%	0.685	58%	0.584	S	S	*	*			trans	-79.8	110.3	-174.2	-176.6	0	0	0	0	110.3	D422 V423	V418-D422 HydrophobicContact CG1-CB 4.05Å; V418-V423 HydrophobicContact CG1-CG2 3.94Å
419	T	97.3	Very high	94.9	Very high	67 Å²	67	110.3 Å²	110.3	41%	0.411	57%	0.566	S	S	.	*			trans	-69.6	159.6	-178.7	80	0	0	0	0	112.8	E417 D421 D422 V423	E417-T419 PolarHBondContact O-N 2.42Å; T419-D421 PolarHBondContact O-N 3.04Å; T419-D421 PolarHBondContact OG1-N 2.66Å; T419-D422 WeakPolarHBondContact CB-OD2 3.5Å; T419-D422 WeakPolarHBondContact CG2-OD2 3.46Å; T419-D422 PolarHBondContact O-N 3.48Å; T419-D422 VanDerWaalsContact OG1-CG 3.27Å; T419-D422 PolarHBondContact OG1-N 2.93Å; T419-D422 VanDerWaalsContact OG1-N 3.13Å; T419-D422 PolarHBondContact OG1-OD2 3.21Å; T419-V423 PolarHBondContact O-N 2.95Å
420	V	98.1	Very high	96	Very high	112 Å²	112	110.8 Å²	110.8	68%	0.679	56%	0.559	S	S	*	*	H	α-helix	trans	-58.3	-32.7	173.7	177.3	0	0	0	0	111.9	R424	V420-R424 WeakPolarHBondContact O-CB 3.42Å; V420-R424 PolarHBondContact O-N 3.25Å
421	D	97.9	Very high	96.7	Very high	76 Å²	76	109.9 Å²	109.9	41%	0.406	55%	0.547	S	S	.	.	H	α-helix	trans	-74.6	-29.8	176.7	-74.8	-30.5	0	0	0	112.1	T419 R424 K425	T419-D421 PolarHBondContact O-N 3.04Å; T419-D421 PolarHBondContact OG1-N 2.66Å; D421-R424 WeakPolarHBondContact O-CB 3.3Å; D421-R424 PolarHBondContact O-N 2.88Å; D421-R424 IonicContact OD1-CZ 3.42Å; D421-R424 IonicContact OD1-NE 2.62Å; D421-R424 IonicContact OD1-NH1 3.19Å; D421-R424 PolarHBondContact OD1-NH1 2.94Å; D421-R424 IonicContact OD1-NH2 3.23Å; D421-R424 PolarHBondContact OD1-NH2 2.8Å; D421-K425 WeakPolarHBondContact O-CB 3.3Å; D421-K425 WeakPolarHBondContact O-CG 3.4Å; D421-K425 PolarHBondContact O-N 2.83Å
422	D	97.9	Very high	97	Very high	59 Å²	59	109 Å²	109	32%	0.316	55%	0.549	S	S	.	.	H	α-helix	trans	-72.4	-37.1	172.5	-59.9	-50.2	0	0	0	111.9	V418 T419 R424 K425 R426	V418-D422 HydrophobicContact CG1-CB 4.05Å; T419-D422 WeakPolarHBondContact CB-OD2 3.5Å; T419-D422 WeakPolarHBondContact CG2-OD2 3.46Å; T419-D422 PolarHBondContact O-N 3.48Å; T419-D422 VanDerWaalsContact OG1-CG 3.27Å; T419-D422 PolarHBondContact OG1-N 2.93Å; T419-D422 VanDerWaalsContact OG1-N 3.13Å; T419-D422 PolarHBondContact OG1-OD2 3.21Å; D422-R424 VanDerWaalsContact C-N 3.31Å; D422-R424 PolarHBondContact O-N 3.21Å; D422-K425 PolarHBondContact O-N 3.15Å; D422-K425 IonicContact OD1-NZ 2.61Å; D422-K425 PolarHBondContact OD1-NZ 3.26Å; D422-R426 VanDerWaalsContact O-CB 3.26Å; D422-R426 WeakPolarHBondContact O-CB 3.4Å; D422-R426 PolarHBondContact O-N 3.21Å
423	V	98.1	Very high	97.2	Very high	87 Å²	87	109.2 Å²	109.2	53%	0.527	54%	0.542	S	S	.	.	H	α-helix	trans	-59.9	-42.2	167	179.2	0	0	0	0	110.7	V418 T419 R426 F427	V418-V423 HydrophobicContact CG1-CG2 3.94Å; T419-V423 PolarHBondContact O-N 2.95Å; V423-R426 PolarHBondContact O-N 3.5Å; V423-F427 VanDerWaalsContact O-CB 3.32Å; V423-F427 WeakPolarHBondContact O-CB 3.34Å; V423-F427 PolarHBondContact O-N 2.85Å
424	R	98.3	Very high	97.4	Very high	157 Å²	157	109.9 Å²	109.9	59%	0.592	53%	0.534	S	S	*	.	H	α-helix	trans	-64.2	-46.9	177	-166.9	-174.4	-62.3	137.8	14.1	112	V420 D421 D422 F427 A428	V420-R424 WeakPolarHBondContact O-CB 3.42Å; V420-R424 PolarHBondContact O-N 3.25Å; D421-R424 WeakPolarHBondContact O-CB 3.3Å; D421-R424 PolarHBondContact O-N 2.88Å; D421-R424 IonicContact OD1-CZ 3.42Å; D421-R424 IonicContact OD1-NE 2.62Å; D421-R424 IonicContact OD1-NH1 3.19Å; D421-R424 PolarHBondContact OD1-NH1 2.94Å; D421-R424 IonicContact OD1-NH2 3.23Å; D421-R424 PolarHBondContact OD1-NH2 2.8Å; D422-R424 VanDerWaalsContact C-N 3.31Å; D422-R424 PolarHBondContact O-N 3.21Å; R424-F427 PolarHBondContact O-N 3.41Å; R424-A428 WeakPolarHBondContact O-CB 3.25Å; R424-A428 PolarHBondContact O-N 3.41Å
425	K	98.3	Very high	97.5	Very high	127 Å²	127	107.5 Å²	107.5	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-58.3	-48.5	174.6	-69.6	163.5	-148.9	163.9	0	110.8	D421 D422 A428 Q429	D421-K425 WeakPolarHBondContact O-CB 3.3Å; D421-K425 WeakPolarHBondContact O-CG 3.4Å; D421-K425 PolarHBondContact O-N 2.83Å; D422-K425 PolarHBondContact O-N 3.15Å; D422-K425 IonicContact OD1-NZ 2.61Å; D422-K425 PolarHBondContact OD1-NZ 3.26Å; K425-A428 PolarHBondContact O-N 3.04Å; K425-Q429 WeakPolarHBondContact O-CB 3.49Å; K425-Q429 PolarHBondContact O-N 3.13Å
426	R	98.3	Very high	97.5	Very high	122 Å²	122	105.9 Å²	105.9	46%	0.46	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-37.6	-178.9	-172.1	60.3	177.6	146.5	7.2	112.3	D422 V423 Q429 L430	D422-R426 VanDerWaalsContact O-CB 3.26Å; D422-R426 WeakPolarHBondContact O-CB 3.4Å; D422-R426 PolarHBondContact O-N 3.21Å; V423-R426 PolarHBondContact O-N 3.5Å; R426-Q429 PolarHBondContact O-N 3.3Å; R426-L430 HydrophobicContact CG-CD1 4.29Å; R426-L430 WeakPolarHBondContact O-CB 3.28Å; R426-L430 VanDerWaalsContact O-CG 3.3Å; R426-L430 WeakPolarHBondContact O-CG 3.47Å; R426-L430 PolarHBondContact O-N 2.92Å
427	F	98.3	Very high	97.5	Very high	136 Å²	136	105.9 Å²	105.9	60%	0.596	52%	0.524	S	S	*	.	H	α-helix	trans	-65.3	-41.5	172.3	-179.1	-99.5	0	0	0	112.1	V423 R424 L430 K431	V423-F427 VanDerWaalsContact O-CB 3.32Å; V423-F427 WeakPolarHBondContact O-CB 3.34Å; V423-F427 PolarHBondContact O-N 2.85Å; R424-F427 PolarHBondContact O-N 3.41Å; F427-L430 PolarHBondContact O-N 2.85Å; F427-K431 WeakPolarHBondContact O-CB 3.49Å; F427-K431 PolarHBondContact O-N 2.77Å
428	A	98.3	Very high	97.6	Very high	55 Å²	55	105.6 Å²	105.6	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-42.5	174.6	0	0	0	0	0	111.8	R424 K425 K431 S432	R424-A428 WeakPolarHBondContact O-CB 3.25Å; R424-A428 PolarHBondContact O-N 3.41Å; K425-A428 PolarHBondContact O-N 3.04Å; A428-K431 PolarHBondContact O-N 3.22Å; A428-S432 PolarHBondContact O-N 3.22Å; A428-S432 PolarHBondContact O-OG 2.87Å
429	Q	98	Very high	97.5	Very high	99 Å²	99	106 Å²	106	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-48.1	174.3	-172	-172.8	14.5	0	0	112.1	K425 R426 K431 S432 E433	K425-Q429 WeakPolarHBondContact O-CB 3.49Å; K425-Q429 PolarHBondContact O-N 3.13Å; R426-Q429 PolarHBondContact O-N 3.3Å; Q429-K431 PolarHBondContact O-N 3.29Å; Q429-S432 PolarHBondContact O-N 3.34Å; Q429-S432 PolarHBondContact O-OG 2.66Å; Q429-E433 VanDerWaalsContact O-CB 3.23Å; Q429-E433 WeakPolarHBondContact O-CB 3.15Å; Q429-E433 PolarHBondContact O-N 3.24Å
430	L	98.3	Very high	97.2	Very high	80 Å²	80	106.1 Å²	106.1	42%	0.419	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-29.6	177.4	-71.7	169.6	0	0	0	112.2	R426 F427 R434	R426-L430 HydrophobicContact CG-CD1 4.29Å; R426-L430 WeakPolarHBondContact O-CB 3.28Å; R426-L430 VanDerWaalsContact O-CG 3.3Å; R426-L430 WeakPolarHBondContact O-CG 3.47Å; R426-L430 PolarHBondContact O-N 2.92Å; F427-L430 PolarHBondContact O-N 2.85Å; L430-R434 VanDerWaalsContact O-CB 3.3Å; L430-R434 WeakPolarHBondContact O-CB 3.41Å; L430-R434 PolarHBondContact O-N 3.47Å
431	K	97.9	Very high	96.9	Very high	140 Å²	140	104.5 Å²	104.5	61%	0.609	52%	0.517	S	S	*	.	H	α-helix	trans	-72.3	-40.6	173.9	-173.6	-179.3	177.1	-175	0	112	F427 A428 Q429 K435	F427-K431 WeakPolarHBondContact O-CB 3.49Å; F427-K431 PolarHBondContact O-N 2.77Å; A428-K431 PolarHBondContact O-N 3.22Å; Q429-K431 PolarHBondContact O-N 3.29Å; K431-K435 VanDerWaalsContact O-CB 3.32Å; K431-K435 WeakPolarHBondContact O-CB 2.72Å; K431-K435 PolarHBondContact O-N 3.5Å; K431-K435 VanDerWaalsContact O-N 3.09Å
432	S	97.1	Very high	96.7	Very high	70 Å²	70	108 Å²	108	49%	0.49	54%	0.535	S	S	.	.	H	α-helix	trans	-74.4	-36.3	176.3	60	0	0	0	0	112.6	A428 Q429 K435 L436	A428-S432 PolarHBondContact O-N 3.22Å; A428-S432 PolarHBondContact O-OG 2.87Å; Q429-S432 PolarHBondContact O-N 3.34Å; Q429-S432 PolarHBondContact O-OG 2.66Å; S432-K435 PolarHBondContact O-N 2.96Å; S432-L436 WeakPolarHBondContact O-CB 3.17Å; S432-L436 PolarHBondContact O-N 3.01Å
433	E	97.3	Very high	96.6	Very high	89 Å²	89	110.1 Å²	110.1	42%	0.416	55%	0.546	S	S	.	.	H	α-helix	trans	-63.7	-45.7	173.9	-175.9	174.4	-170.5	0	0	111.5	Q429 K435 L436 L437	Q429-E433 VanDerWaalsContact O-CB 3.23Å; Q429-E433 WeakPolarHBondContact O-CB 3.15Å; Q429-E433 PolarHBondContact O-N 3.24Å; E433-K435 PolarHBondContact O-N 3.24Å; E433-L436 WeakPolarHBondContact O-CB 3.46Å; E433-L436 PolarHBondContact O-N 3.3Å; E433-L437 WeakPolarHBondContact O-CG 3.26Å; E433-L437 PolarHBondContact O-N 3.35Å; E433-L437 VanDerWaalsContact O-N 3.12Å
434	R	97.6	Very high	96.5	Very high	149 Å²	149	109.4 Å²	109.4	56%	0.562	54%	0.542	S	S	*	.	H	α-helix	trans	-58.1	-49	171.2	-169.9	-156.1	-54.8	-178.4	-2.4	111.2	L430 L436 L437 E438	L430-R434 VanDerWaalsContact O-CB 3.3Å; L430-R434 WeakPolarHBondContact O-CB 3.41Å; L430-R434 PolarHBondContact O-N 3.47Å; R434-L436 VanDerWaalsContact C-N 3.27Å; R434-L436 PolarHBondContact O-N 2.79Å; R434-L437 PolarHBondContact O-N 3.43Å; R434-L437 VanDerWaalsContact O-N 3.08Å; R434-E438 WeakPolarHBondContact CD-OE1 3.48Å; R434-E438 HydrophobicContact CG-CG 4.24Å; R434-E438 WeakPolarHBondContact CG-OE1 3.46Å; R434-E438 WeakPolarHBondContact O-CG 3.44Å; R434-E438 PolarHBondContact O-N 3.46Å
435	K	96.9	Very high	96.3	Very high	107 Å²	107	108.6 Å²	108.6	47%	0.465	54%	0.542	S	S	.	.	H	α-helix	trans	-58.6	-39.8	179.4	-172.6	-175.4	177.7	-153.4	0	111.8	K431 S432 E433 L437 E438 E439	K431-K435 VanDerWaalsContact O-CB 3.32Å; K431-K435 WeakPolarHBondContact O-CB 2.72Å; K431-K435 PolarHBondContact O-N 3.5Å; K431-K435 VanDerWaalsContact O-N 3.09Å; S432-K435 PolarHBondContact O-N 2.96Å; E433-K435 PolarHBondContact O-N 3.24Å; K435-L437 VanDerWaalsContact C-N 3.33Å; K435-L437 PolarHBondContact O-N 3.04Å; K435-E438 PolarHBondContact O-N 3.49Å; K435-E439 WeakPolarHBondContact CE-OE1 3.47Å; K435-E439 WeakPolarHBondContact CE-OE2 3.42Å; K435-E439 HydrophobicContact CG-CG 4.29Å; K435-E439 IonicContact NZ-OE1 3.23Å; K435-E439 PolarHBondContact NZ-OE1 3Å; K435-E439 IonicContact NZ-OE2 3.64Å; K435-E439 PolarHBondContact NZ-OE2 3.5Å; K435-E439 WeakPolarHBondContact O-CB 3.42Å; K435-E439 PolarHBondContact O-N 2.9Å
436	L	96.1	Very high	96.2	Very high	103 Å²	103	105.7 Å²	105.7	54%	0.539	54%	0.542	S	S	.	.	H	α-helix	trans	-62	-39.6	176.1	-173	74	0	0	0	112	S432 E433 R434 A440 P441	S432-L436 WeakPolarHBondContact O-CB 3.17Å; S432-L436 PolarHBondContact O-N 3.01Å; E433-L436 WeakPolarHBondContact O-CB 3.46Å; E433-L436 PolarHBondContact O-N 3.3Å; R434-L436 VanDerWaalsContact C-N 3.27Å; R434-L436 PolarHBondContact O-N 2.79Å; L436-A440 WeakPolarHBondContact O-CA 3.48Å; L436-A440 PolarHBondContact O-N 2.95Å; L436-P441 HydrophobicContact CD1-CG 3.53Å; L436-P441 VanDerWaalsContact O-CD 3.26Å; L436-P441 WeakPolarHBondContact O-CD 3.37Å
437	L	95.2	Very high	96.1	Very high	134 Å²	134	103.6 Å²	103.6	70%	0.702	54%	0.539	S	S	*	.	H	α-helix	trans	-75.8	-31.2	176.9	-64.8	170.7	0	0	0	112.9	E433 R434 K435	E433-L437 WeakPolarHBondContact O-CG 3.26Å; E433-L437 PolarHBondContact O-N 3.35Å; E433-L437 VanDerWaalsContact O-N 3.12Å; R434-L437 PolarHBondContact O-N 3.43Å; R434-L437 VanDerWaalsContact O-N 3.08Å; K435-L437 VanDerWaalsContact C-N 3.33Å; K435-L437 PolarHBondContact O-N 3.04Å
438	E	96.7	Very high	96	Very high	136 Å²	136	103.9 Å²	103.9	64%	0.636	54%	0.536	S	S	*	.	H	α-helix	trans	-74.6	-40.4	175.8	-72.8	169.7	165.6	0	0	112.5	R434 K435	R434-E438 WeakPolarHBondContact CD-OE1 3.48Å; R434-E438 HydrophobicContact CG-CG 4.24Å; R434-E438 WeakPolarHBondContact CG-OE1 3.46Å; R434-E438 WeakPolarHBondContact O-CG 3.44Å; R434-E438 PolarHBondContact O-N 3.46Å; K435-E438 PolarHBondContact O-N 3.49Å
439	E	95.3	Very high	95.7	Very high	120 Å²	120	106 Å²	106	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-86.2	-19.4	178.9	-68.7	-175.7	160	0	0	113.5	K435	K435-E439 WeakPolarHBondContact CE-OE1 3.47Å; K435-E439 WeakPolarHBondContact CE-OE2 3.42Å; K435-E439 HydrophobicContact CG-CG 4.29Å; K435-E439 IonicContact NZ-OE1 3.23Å; K435-E439 PolarHBondContact NZ-OE1 3Å; K435-E439 IonicContact NZ-OE2 3.64Å; K435-E439 PolarHBondContact NZ-OE2 3.5Å; K435-E439 WeakPolarHBondContact O-CB 3.42Å; K435-E439 PolarHBondContact O-N 2.9Å
440	A	91.6	Very high	95.6	Very high	70 Å²	70	104 Å²	104	58%	0.579	54%	0.537	S	S	*	.			trans	42.7	52.1	179.3	0	0	0	0	0	115.2	L436	L436-A440 WeakPolarHBondContact O-CA 3.48Å; L436-A440 PolarHBondContact O-N 2.95Å
441	P	92.7	Very high	95.3	Very high	78 Å²	78	104.9 Å²	104.9	51%	0.506	54%	0.539	S	S	.	.			trans	-67.1	140	-171.7	28.4	-34.5	0	0	0	112.7	L436 L443	L436-P441 HydrophobicContact CD1-CG 3.53Å; L436-P441 VanDerWaalsContact O-CD 3.26Å; L436-P441 WeakPolarHBondContact O-CD 3.37Å; P441-L443 PolarHBondContact O-N 3.14Å
442	L	93.7	Very high	95	Very high	151 Å²	151	102.9 Å²	102.9	79%	0.791	53%	0.533	S	S	*	.			trans	-76.2	122.5	-173.4	-59	178.1	0	0	0	112.3	T444	L442-T444 VanDerWaalsContact C-N 3.28Å; L442-T444 PolarHBondContact O-N 3.29Å
443	L	94.1	Very high	94.7	Very high	103 Å²	103	103.8 Å²	103.8	54%	0.539	53%	0.528	S	S	.	.			trans	-73	80.7	170.1	-176.6	55.6	0	0	0	110.7	P441 L447 R448	P441-L443 PolarHBondContact O-N 3.14Å; L443-L447 HydrophobicContact CD1-CB 4.46Å; L443-L447 HydrophobicContact CD1-CD2 3.88Å; L443-L447 HydrophobicContact CD1-CG 4.08Å; L443-R448 HydrophobicContact CD1-CG 3.64Å; L443-R448 HydrophobicContact CD2-CG 4.08Å; L443-R448 HydrophobicContact CG-CG 3.71Å
444	T	95.9	Very high	94.6	Very high	72 Å²	72	105.9 Å²	105.9	44%	0.442	54%	0.538	S	S	.	.			trans	-62.7	160.1	-176.4	72.8	0	0	0	0	112.5	L442 L447 R448	L442-T444 VanDerWaalsContact C-N 3.28Å; L442-T444 PolarHBondContact O-N 3.29Å; T444-L447 PolarHBondContact O-N 3.19Å; T444-L447 WeakPolarHBondContact OG1-CB 3.26Å; T444-L447 PolarHBondContact OG1-N 3.13Å; T444-L447 VanDerWaalsContact OG1-N 3.08Å; T444-R448 PolarHBondContact O-N 2.68Å
445	K	95.9	Very high	94.3	Very high	140 Å²	140	103 Å²	103	61%	0.609	53%	0.529	S	S	*	.	H	α-helix	trans	-57	-49.8	173.1	-177.6	-176.8	161.1	177	0	110.9	L447 R448 E449	K445-L447 VanDerWaalsContact C-N 3.31Å; K445-L447 PolarHBondContact O-N 2.94Å; K445-R448 PolarHBondContact O-N 3.4Å; K445-R448 VanDerWaalsContact O-N 3.16Å; K445-E449 WeakPolarHBondContact CE-OE1 3.41Å; K445-E449 WeakPolarHBondContact CE-OE2 3.4Å; K445-E449 HydrophobicContact CG-CG 4.45Å; K445-E449 IonicContact NZ-OE1 3.6Å; K445-E449 PolarHBondContact NZ-OE1 3.02Å; K445-E449 PolarHBondContact O-N 3.04Å
446	A	96.1	Very high	94	Very high	65 Å²	65	99.3 Å²	99.3	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-35.8	-179.9	0	0	0	0	0	113.3	E449 A450	A446-E449 PolarHBondContact O-N 3.27Å; A446-A450 VanDerWaalsContact O-CB 3.27Å; A446-A450 WeakPolarHBondContact O-CB 3.49Å; A446-A450 PolarHBondContact O-N 2.83Å
447	L	95.4	Very high	93.8	Very high	78 Å²	78	99.5 Å²	99.5	41%	0.408	51%	0.512	S	S	.	.	H	α-helix	trans	-65.6	-42.1	175.8	-179.8	57.3	0	0	0	111.7	L443 T444 K445 A450 Q451	L443-L447 HydrophobicContact CD1-CB 4.46Å; L443-L447 HydrophobicContact CD1-CD2 3.88Å; L443-L447 HydrophobicContact CD1-CG 4.08Å; T444-L447 PolarHBondContact O-N 3.19Å; T444-L447 WeakPolarHBondContact OG1-CB 3.26Å; T444-L447 PolarHBondContact OG1-N 3.13Å; T444-L447 VanDerWaalsContact OG1-N 3.08Å; K445-L447 VanDerWaalsContact C-N 3.31Å; K445-L447 PolarHBondContact O-N 2.94Å; L447-A450 PolarHBondContact O-N 3.48Å; L447-Q451 HydrophobicContact CD1-CG 4.28Å; L447-Q451 WeakPolarHBondContact O-CB 3.49Å; L447-Q451 VanDerWaalsContact O-CG 3.25Å; L447-Q451 WeakPolarHBondContact O-CG 3.05Å; L447-Q451 PolarHBondContact O-N 2.86Å
448	R	95.3	Very high	93.6	Very high	143 Å²	143	101.6 Å²	101.6	54%	0.54	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-42.8	175.4	-71.6	-173.5	-75.7	147.1	-5.2	112.4	L443 T444 K445 Q451 M452	L443-R448 HydrophobicContact CD1-CG 3.64Å; L443-R448 HydrophobicContact CD2-CG 4.08Å; L443-R448 HydrophobicContact CG-CG 3.71Å; T444-R448 PolarHBondContact O-N 2.68Å; K445-R448 PolarHBondContact O-N 3.4Å; K445-R448 VanDerWaalsContact O-N 3.16Å; R448-Q451 PolarHBondContact O-N 2.94Å; R448-M452 VanDerWaalsContact O-CB 3.26Å; R448-M452 WeakPolarHBondContact O-CB 3.47Å; R448-M452 PolarHBondContact O-N 3.39Å
449	E	93.5	Very high	93.3	Very high	100 Å²	100	99 Å²	99	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-39.9	177.4	-71.4	173.8	141.3	0	0	111.8	K445 A446 M452 K453	K445-E449 WeakPolarHBondContact CE-OE1 3.41Å; K445-E449 WeakPolarHBondContact CE-OE2 3.4Å; K445-E449 HydrophobicContact CG-CG 4.45Å; K445-E449 IonicContact NZ-OE1 3.6Å; K445-E449 PolarHBondContact NZ-OE1 3.02Å; K445-E449 PolarHBondContact O-N 3.04Å; A446-E449 PolarHBondContact O-N 3.27Å; E449-M452 PolarHBondContact O-N 3.26Å; E449-K453 WeakPolarHBondContact O-CB 3.44Å; E449-K453 PolarHBondContact O-N 2.94Å
450	A	94.9	Very high	93	Very high	55 Å²	55	96 Å²	96	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-48.4	174.5	0	0	0	0	0	112.2	A446 L447 M452 K453 E454	A446-A450 VanDerWaalsContact O-CB 3.27Å; A446-A450 WeakPolarHBondContact O-CB 3.49Å; A446-A450 PolarHBondContact O-N 2.83Å; L447-A450 PolarHBondContact O-N 3.48Å; A450-M452 VanDerWaalsContact C-N 3.27Å; A450-M452 PolarHBondContact O-N 3.44Å; A450-K453 PolarHBondContact O-N 3.33Å; A450-E454 WeakPolarHBondContact O-CB 3.36Å; A450-E454 PolarHBondContact O-N 3.28Å
451	Q	93.3	Very high	93	Very high	100 Å²	100	95 Å²	95	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-60.5	-36.1	176.4	-73.9	172.5	-32	0	0	112.5	L447 R448 K455	L447-Q451 HydrophobicContact CD1-CG 4.28Å; L447-Q451 WeakPolarHBondContact O-CB 3.49Å; L447-Q451 VanDerWaalsContact O-CG 3.25Å; L447-Q451 WeakPolarHBondContact O-CG 3.05Å; L447-Q451 PolarHBondContact O-N 2.86Å; R448-Q451 PolarHBondContact O-N 2.94Å; Q451-K455 WeakPolarHBondContact O-CB 3.44Å; Q451-K455 PolarHBondContact O-N 3.49Å
452	M	90.6	Very high	93.1	Very high	97 Å²	97	91.3 Å²	91.3	48%	0.478	45%	0.445	S	S	.	.	H	α-helix	trans	-70.3	-44.5	176.9	-169.4	175.5	-174.5	0	0	111.5	R448 E449 A450 K455 M456 V521	R448-M452 VanDerWaalsContact O-CB 3.26Å; R448-M452 WeakPolarHBondContact O-CB 3.47Å; R448-M452 PolarHBondContact O-N 3.39Å; E449-M452 PolarHBondContact O-N 3.26Å; A450-M452 VanDerWaalsContact C-N 3.27Å; A450-M452 PolarHBondContact O-N 3.44Å; M452-K455 PolarHBondContact O-N 3.03Å; M452-M456 HydrophobicContact CG-SD 4.41Å; M452-M456 WeakPolarHBondContact O-CG 3.32Å; M452-M456 PolarHBondContact O-N 2.95Å; M452-V521 HydrophobicContact CE-CB 4.42Å; M452-V521 HydrophobicContact CE-CG1 3.49Å; M452-V521 VanDerWaalsContact CE-CG1 3.49Å
453	K	91.4	Very high	93.2	Very high	90 Å²	90	84.9 Å²	84.9	39%	0.391	41%	0.412	S	S	.	.	H	α-helix	trans	-62	-47.4	174.5	-179.8	165.7	177.2	168.5	0	111.6	D378 E449 A450 K455 M456 E457	D378-K453 IonicContact OD1-NZ 3.95Å; D378-K453 PolarHBondContact OD1-NZ 3.44Å; E449-K453 WeakPolarHBondContact O-CB 3.44Å; E449-K453 PolarHBondContact O-N 2.94Å; A450-K453 PolarHBondContact O-N 3.33Å; K453-K455 VanDerWaalsContact C-N 3.33Å; K453-K455 PolarHBondContact O-N 3.29Å; K453-M456 PolarHBondContact O-N 3.08Å; K453-M456 VanDerWaalsContact O-N 3.08Å; K453-E457 WeakPolarHBondContact CE-OE1 3.43Å; K453-E457 HydrophobicContact CG-CG 4.4Å; K453-E457 WeakPolarHBondContact CG-OE1 3.39Å; K453-E457 IonicContact NZ-OE1 2.66Å; K453-E457 WeakPolarHBondContact O-CG 3.41Å; K453-E457 PolarHBondContact O-N 3.24Å
454	E	94.3	Very high	93.3	Very high	133 Å²	133	80 Å²	80	62%	0.621	39%	0.387	S	S	*	.	H	α-helix	trans	-57.3	-43.6	175.3	-176	-175.8	175.9	0	0	111.7	A450 M456 E457 R458	A450-E454 WeakPolarHBondContact O-CB 3.36Å; A450-E454 PolarHBondContact O-N 3.28Å; E454-M456 PolarHBondContact O-N 2.64Å; E454-E457 PolarHBondContact O-N 3.47Å; E454-R458 VanDerWaalsContact O-CB 3.27Å; E454-R458 WeakPolarHBondContact O-CB 3.48Å; E454-R458 PolarHBondContact O-N 3.18Å
455	K	92.6	Very high	93.4	Very high	87 Å²	87	78.7 Å²	78.7	38%	0.378	37%	0.374	S	S	.	.	H	α-helix	trans	-64.8	-38.1	175.5	-166.1	-170.8	166.6	-168.8	0	111.9	Q451 M452 K453 R458 Y459 F526	Q451-K455 WeakPolarHBondContact O-CB 3.44Å; Q451-K455 PolarHBondContact O-N 3.49Å; M452-K455 PolarHBondContact O-N 3.03Å; K453-K455 VanDerWaalsContact C-N 3.33Å; K453-K455 PolarHBondContact O-N 3.29Å; K455-R458 PolarHBondContact O-N 3.44Å; K455-Y459 HydrophobicContact CG-CD2 4.08Å; K455-Y459 HydrophobicContact CG-CE2 4.37Å; K455-Y459 WeakPolarHBondContact O-CD2 3.5Å; K455-Y459 PolarHBondContact O-N 3.18Å; K455-Y459 VanDerWaalsContact O-N 3.16Å; K455-F526 HydrophobicContact CB-CE1 4.22Å; K455-F526 HydrophobicContact CD-CD1 3.99Å; K455-F526 HydrophobicContact CD-CE1 3.59Å; K455-F526 HydrophobicContact CG-CD1 4.49Å; K455-F526 HydrophobicContact CG-CE1 3.61Å; K455-F526 HydrophobicContact CG-CZ 4.21Å; K455-F526 PolarHBondContact NZ-O 3.17Å; K455-F526 WeakPolarHBondContact O-CZ 3.26Å
456	M	90.6	Very high	93.5	Very high	30 Å²	30	72.1 Å²	72.1	15%	0.148	35%	0.345	C	S	.	.	H	α-helix	trans	-68.2	-43.3	176.2	-72.4	171	63	0	0	112.5	M452 K453 E454 R458 Y459 P480 L481 F526	M452-M456 HydrophobicContact CG-SD 4.41Å; M452-M456 WeakPolarHBondContact O-CG 3.32Å; M452-M456 PolarHBondContact O-N 2.95Å; K453-M456 PolarHBondContact O-N 3.08Å; K453-M456 VanDerWaalsContact O-N 3.08Å; E454-M456 PolarHBondContact O-N 2.64Å; M456-R458 VanDerWaalsContact C-N 3.28Å; M456-R458 PolarHBondContact O-N 2.94Å; M456-Y459 CarbonylContact O-C 3.55Å; M456-Y459 VanDerWaalsContact O-C 3.32Å; M456-Y459 PolarHBondContact O-N 2.9Å; M456-P480 HydrophobicContact CE-CB 4.4Å; M456-P480 HydrophobicContact CG-CB 4.46Å; M456-L481 HydrophobicContact CE-CD1 4.38Å; M456-L481 HydrophobicContact CE-CD2 3.79Å; M456-L481 HydrophobicContact CE-CG 4.03Å; M456-F526 HydrophobicContact CG-CE1 4.15Å; M456-F526 HydrophobicContact CG-CZ 4.13Å
457	E	90.5	Very high	93.5	Very high	108 Å²	108	70.5 Å²	70.5	51%	0.505	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-34.9	173.4	-70.8	171.8	-177.9	0	0	111.7	K453 E454	K453-E457 WeakPolarHBondContact CE-OE1 3.43Å; K453-E457 HydrophobicContact CG-CG 4.4Å; K453-E457 WeakPolarHBondContact CG-OE1 3.39Å; K453-E457 IonicContact NZ-OE1 2.66Å; K453-E457 WeakPolarHBondContact O-CG 3.41Å; K453-E457 PolarHBondContact O-N 3.24Å; E454-E457 PolarHBondContact O-N 3.47Å
458	R	91.1	Very high	93.5	Very high	177 Å²	177	67 Å²	67	67%	0.668	31%	0.308	S	S	*	.	H	α-helix	trans	-73.6	-23.4	177.1	-173.5	56.8	-177.7	168.8	5.1	114.2	E454 K455 M456	E454-R458 VanDerWaalsContact O-CB 3.27Å; E454-R458 WeakPolarHBondContact O-CB 3.48Å; E454-R458 PolarHBondContact O-N 3.18Å; K455-R458 PolarHBondContact O-N 3.44Å; M456-R458 VanDerWaalsContact C-N 3.28Å; M456-R458 PolarHBondContact O-N 2.94Å
459	Y	91.1	Very high	93.5	Very high	82 Å²	82	64.2 Å²	64.2	32%	0.322	31%	0.308	S	S	.	.			trans	-135.9	73.9	-176.7	-59.1	-75.7	0	0	0	111.6	K455 M456 K461 F526 P527 L565	K455-Y459 HydrophobicContact CG-CD2 4.08Å; K455-Y459 HydrophobicContact CG-CE2 4.37Å; K455-Y459 WeakPolarHBondContact O-CD2 3.5Å; K455-Y459 PolarHBondContact O-N 3.18Å; K455-Y459 VanDerWaalsContact O-N 3.16Å; M456-Y459 CarbonylContact O-C 3.55Å; M456-Y459 VanDerWaalsContact O-C 3.32Å; M456-Y459 PolarHBondContact O-N 2.9Å; Y459-K461 VanDerWaalsContact C-N 3.27Å; Y459-K461 PolarHBondContact O-N 3.33Å; Y459-F526 WeakPolarHBondContact O-CE2 3.37Å; Y459-P527 HydrophobicContact CD1-CB 3.8Å; Y459-P527 HydrophobicContact CD1-CG 4.02Å; Y459-P527 HydrophobicContact CD2-CB 3.9Å; Y459-P527 HydrophobicContact CD2-CG 4.01Å; Y459-P527 HydrophobicContact CE1-CB 4.48Å; Y459-P527 HydrophobicContact CE1-CG 4.21Å; Y459-P527 HydrophobicContact CE2-CG 4.21Å; Y459-P527 HydrophobicContact CG-CB 3.46Å; Y459-P527 VanDerWaalsContact CG-CB 3.46Å; Y459-P527 HydrophobicContact CG-CG 3.92Å; Y459-L565 HydrophobicContact CD1-CD2 3.89Å; Y459-L565 HydrophobicContact CE1-CD2 3.91Å
460	P	89.4	Confident	93.4	Very high	56 Å²	56	61 Å²	61	36%	0.364	29%	0.294	S	S	.	.	S	Bend	trans	-76.6	-7.5	-174	31.1	-37.2	0	0	0	115	F385 R479	F385-P460 HydrophobicContact CE1-CB 4.12Å; P460-R479 WeakPolarHBondContact O-CD 3.25Å; P460-R479 PolarHBondContact O-NH1 3.01Å
461	K	91.5	Very high	93.2	Very high	50 Å²	50	62.7 Å²	62.7	22%	0.217	29%	0.289	C	S	.	.	S	Bend	trans	-120	146	166.1	-81.8	-170.1	170.7	-163.5	0	109.2	E392 Y459 F477 C564	E392-K461 IonicContact OE1-NZ 3.29Å; E392-K461 PolarHBondContact OE1-NZ 2.91Å; E392-K461 IonicContact OE2-NZ 2.8Å; Y459-K461 VanDerWaalsContact C-N 3.27Å; Y459-K461 PolarHBondContact O-N 3.33Å; K461-F477 HydrophobicContact CB-CD1 4.42Å; K461-F477 HydrophobicContact CD-CB 4.41Å; K461-F477 HydrophobicContact CD-CD1 3.87Å; K461-F477 HydrophobicContact CD-CG 4.39Å; K461-C564 HydrophobicContact CD-CB 4.28Å
462	V	94.4	Very high	93.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133.4	176.3	-170.9	0	0	0	0	109.1	L464 F477 F478 P480 L520 L525 F526 P527	V462-L464 HydrophobicContact CG1-CD2 4.07Å; V462-F477 CarbonylContact O-C 3.53Å; V462-F477 WeakPolarHBondContact O-CA 3.29Å; V462-F478 HydrophobicContact CB-CB 4.38Å; V462-F478 PolarHBondContact N-O 2.91Å; V462-F478 PolarHBondContact O-N 3.42Å; V462-P480 HydrophobicContact CG2-CB 4.21Å; V462-P480 HydrophobicContact CG2-CG 3.89Å; V462-L520 HydrophobicContact CB-CD1 4.07Å; V462-L520 HydrophobicContact CG1-CD1 3.9Å; V462-L520 HydrophobicContact CG2-CD1 4.38Å; V462-L525 VanDerWaalsContact CG1-O 3.27Å; V462-L525 WeakPolarHBondContact CG1-O 3.42Å; V462-F526 HydrophobicContact CG1-CD2 4.48Å; V462-F526 HydrophobicContact CG2-CD2 3.64Å; V462-F526 HydrophobicContact CG2-CE2 4.06Å; V462-P527 VanDerWaalsContact CA-O 3.31Å; V462-P527 WeakPolarHBondContact CA-O 3.27Å
463	V	95.5	Very high	93.5	Very high	16 Å²	16	54.9 Å²	54.9	10%	0.097	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.8	178.7	-166	0	0	0	0	110.6	Q475 F477 P527 G528 A529 I561	V463-Q475 HydrophobicContact CG1-CG 3.78Å; V463-F477 HydrophobicContact CG1-CE1 4.39Å; V463-F477 HydrophobicContact CG2-CD1 3.76Å; V463-F477 HydrophobicContact CG2-CE1 3.53Å; V463-F477 HydrophobicContact CG2-CZ 4.43Å; V463-P527 PolarHBondContact N-O 3.01Å; V463-P527 VanDerWaalsContact N-O 3.15Å; V463-G528 CarbonylContact O-C 3.59Å; V463-G528 WeakPolarHBondContact O-CA 3.38Å; V463-A529 PolarHBondContact O-N 2.95Å; V463-I561 HydrophobicContact CB-CD1 4.41Å; V463-I561 HydrophobicContact CG1-CD1 3.84Å; V463-I561 HydrophobicContact CG1-CG1 3.98Å; V463-I561 HydrophobicContact CG2-CD1 4.49Å; V463-I561 HydrophobicContact CG2-CG1 4.18Å; V463-I561 HydrophobicContact CG2-CG2 4.09Å
464	L	97.1	Very high	93.8	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.1	173.9	-57.5	-174.1	0	0	0	110.1	V462 Q475 G476 F478 V487 L520 L525 A529	V462-L464 HydrophobicContact CG1-CD2 4.07Å; L464-Q475 WeakPolarHBondContact O-CA 3.38Å; L464-G476 PolarHBondContact N-O 2.85Å; L464-G476 PolarHBondContact O-N 2.8Å; L464-F478 HydrophobicContact CB-CD2 4.11Å; L464-F478 HydrophobicContact CB-CE2 3.9Å; L464-F478 HydrophobicContact CD1-CD2 3.74Å; L464-F478 HydrophobicContact CD1-CE2 3.73Å; L464-F478 HydrophobicContact CD1-CG 4.25Å; L464-F478 HydrophobicContact CD1-CZ 4.18Å; L464-F478 HydrophobicContact CG-CD2 3.76Å; L464-F478 HydrophobicContact CG-CE2 3.96Å; L464-V487 HydrophobicContact CD1-CB 4.34Å; L464-V487 HydrophobicContact CD1-CG1 3.85Å; L464-V487 HydrophobicContact CD1-CG2 3.45Å; L464-V487 VanDerWaalsContact CD1-CG2 3.45Å; L464-L520 HydrophobicContact CD1-CD1 3.96Å; L464-L520 HydrophobicContact CD1-CD2 4.08Å; L464-L520 HydrophobicContact CD2-CD1 4.5Å; L464-L520 HydrophobicContact CG-CD1 4.35Å; L464-L525 HydrophobicContact CD2-CB 3.91Å; L464-A529 HydrophobicContact CD2-CB 4.13Å
465	R	97.3	Very high	93.9	Very high	45 Å²	45	44.2 Å²	44.2	17%	0.17	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.9	171.1	-75.8	179.2	171.1	-177.6	-5.3	108.3	Y396 V473 Q475 A529 L530 V531 A557 N558	Y396-R465 WeakPolarHBondContact OH-CD 3.44Å; R465-V473 HydrophobicContact CB-CG1 3.76Å; R465-V473 HydrophobicContact CG-CG1 4.13Å; R465-Q475 HydrophobicContact CG-CB 4.25Å; R465-Q475 HydrophobicContact CG-CG 4.3Å; R465-A529 PolarHBondContact N-O 3.12Å; R465-L530 HydrophobicContact CB-CD1 3.94Å; R465-L530 WeakPolarHBondContact O-CA 3.06Å; R465-V531 PolarHBondContact O-N 3.42Å; R465-A557 VanDerWaalsContact NH2-C 3.3Å; R465-A557 PolarHBondContact NH2-O 3.41Å; R465-N558 VanDerWaalsContact CZ-OD1 3.3Å; R465-N558 PolarHBondContact NH1-OD1 3.38Å; R465-N558 PolarHBondContact NH2-OD1 3.47Å
466	I	97.8	Very high	94	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	102.8	179.9	-56.4	173.7	0	0	0	107.8	F468 V473 L474 V487 F490 L491 L504 V531 F533	I466-F468 HydrophobicContact CG2-CE2 4.28Å; I466-F468 WeakPolarHBondContact O-CD2 3.46Å; I466-V473 WeakPolarHBondContact O-CA 3.49Å; I466-L474 HydrophobicContact CB-CB 4.47Å; I466-L474 PolarHBondContact N-O 2.9Å; I466-L474 PolarHBondContact O-N 2.78Å; I466-V487 HydrophobicContact CD1-CG1 3.87Å; I466-F490 HydrophobicContact CD1-CD1 4.49Å; I466-L491 HydrophobicContact CD1-CB 4.45Å; I466-L491 HydrophobicContact CD1-CD1 3.95Å; I466-L491 HydrophobicContact CD1-CD2 4.31Å; I466-L491 HydrophobicContact CD1-CG 4.5Å; I466-L491 HydrophobicContact CG2-CD1 4.02Å; I466-L491 HydrophobicContact CG2-CD2 4.09Å; I466-L504 HydrophobicContact CG2-CD2 4.33Å; I466-V531 CarbonylContact C-O 3.55Å; I466-V531 VanDerWaalsContact CA-O 3.3Å; I466-V531 WeakPolarHBondContact CA-O 3.38Å; I466-F533 HydrophobicContact CG2-CB 4.31Å
467	Q	96.7	Very high	94.2	Very high	32 Å²	32	38.7 Å²	38.7	15%	0.15	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.4	178.5	179.8	173.6	-4.2	0	0	111.2	V473 L530 V531 Y532 F533	Q467-V473 HydrophobicContact CB-CG2 4.22Å; Q467-V473 HydrophobicContact CG-CG2 4.25Å; Q467-L530 HydrophobicContact CB-CD1 3.97Å; Q467-V531 PolarHBondContact N-O 3.31Å; Q467-Y532 HydrophobicContact CB-CD1 4.08Å; Q467-Y532 HydrophobicContact CB-CE1 4.25Å; Q467-Y532 HydrophobicContact CG-CD1 4.27Å; Q467-Y532 HydrophobicContact CG-CE1 4.28Å; Q467-Y532 VanDerWaalsContact OE1-CE1 3.24Å; Q467-F533 PolarHBondContact O-N 2.91Å
468	F	95.7	Very high	94.4	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.018	15%	0.154	C	C	.	.			trans	-98.4	160.7	179.5	-72.2	-97.3	0	0	0	112.7	I466 D470 R471 H472 L474 L491 L495 F533 Y542 I543	I466-F468 HydrophobicContact CG2-CE2 4.28Å; I466-F468 WeakPolarHBondContact O-CD2 3.46Å; F468-D470 WeakPolarHBondContact CB-OD1 3.39Å; F468-D470 PolarHBondContact O-N 3.31Å; F468-R471 PolarHBondContact O-N 2.99Å; F468-H472 PolarHBondContact N-O 2.71Å; F468-L474 HydrophobicContact CE2-CB 3.98Å; F468-L491 HydrophobicContact CE1-CD1 4.45Å; F468-L491 HydrophobicContact CE2-CD1 4.26Å; F468-L491 HydrophobicContact CZ-CD1 3.62Å; F468-L495 HydrophobicContact CE1-CD2 3.68Å; F468-L495 HydrophobicContact CZ-CD2 4.01Å; F468-F533 HydrophobicContact CD1-CB 3.93Å; F468-F533 AromaticContact CD1-CD1 3.69Å; F468-F533 HydrophobicContact CD1-CD1 3.69Å; F468-F533 HydrophobicContact CD1-CD2 4.29Å; F468-F533 HydrophobicContact CD1-CE1 4.2Å; F468-F533 AromaticContact CD1-CG 3.72Å; F468-F533 HydrophobicContact CD1-CG 3.72Å; F468-F533 HydrophobicContact CE1-CB 4.28Å; F468-F533 HydrophobicContact CE1-CD1 4.1Å; F468-F533 AromaticContact CE1-CD2 3.94Å; F468-F533 HydrophobicContact CE1-CD2 3.94Å; F468-F533 HydrophobicContact CE1-CE1 4.36Å; F468-F533 HydrophobicContact CE1-CE2 4.18Å; F468-F533 AromaticContact CE1-CG 3.86Å; F468-F533 HydrophobicContact CE1-CG 3.86Å; F468-F533 HydrophobicContact CE1-CZ 4.38Å; F468-F533 HydrophobicContact CG-CB 4.31Å; F468-Y542 HydrophobicContact CD1-CD2 4.43Å; F468-Y542 HydrophobicContact CD1-CG 4.16Å; F468-I543 HydrophobicContact CD1-CG1 4.43Å; F468-I543 HydrophobicContact CD2-CD1 3.73Å; F468-I543 HydrophobicContact CD2-CG1 3.99Å; F468-I543 HydrophobicContact CE1-CG1 4.05Å; F468-I543 HydrophobicContact CE2-CD1 3.55Å; F468-I543 HydrophobicContact CE2-CG1 3.57Å; F468-I543 HydrophobicContact CG-CD1 4.42Å; F468-I543 HydrophobicContact CG-CG1 4.37Å; F468-I543 HydrophobicContact CZ-CD1 4.11Å; F468-I543 HydrophobicContact CZ-CG1 3.57Å
469	P	93.4	Very high	94.5	Very high	84 Å²	84	26.4 Å²	26.4	55%	0.545	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.8	178.2	-25.1	34.9	0	0	0	114.9	R471 F533 Y542	P469-R471 PolarHBondContact O-N 3.48Å; P469-F533 HydrophobicContact CG-CD1 4.39Å; P469-Y542 HydrophobicContact CB-CE2 4.48Å; P469-Y542 HydrophobicContact CG-CE2 4.3Å
470	D	91.3	Very high	94.6	Very high	32 Å²	32	22.5 Å²	22.5	17%	0.171	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.6	176.2	63.7	1.5	0	0	0	113.6	H397 F468 H472	H397-D470 PolarHBondContact NE2-O 2.91Å; F468-D470 WeakPolarHBondContact CB-OD1 3.39Å; F468-D470 PolarHBondContact O-N 3.31Å; D470-H472 VanDerWaalsContact C-N 3.33Å; D470-H472 WeakPolarHBondContact OD1-CB 3.04Å; D470-H472 IonicContact OD1-CG 2.68Å; D470-H472 PolarHBondContact OD1-N 3.48Å; D470-H472 IonicContact OD1-ND1 3.14Å; D470-H472 PolarHBondContact OD1-ND1 2.77Å; D470-H472 IonicContact OD2-CE1 3.95Å; D470-H472 IonicContact OD2-CG 4Å; D470-H472 IonicContact OD2-ND1 3.72Å; D470-H472 PolarHBondContact OD2-ND1 3.28Å
471	R	92.3	Very high	94.8	Very high	92 Å²	92	22.3 Å²	22.3	35%	0.347	11%	0.107	S	C	.	.	S	Bend	trans	72.4	15.7	-178.5	-45.9	167.3	63.4	-158.2	-4.6	114.9	M398 D399 F468 P469	M398-R471 HydrophobicContact CB-CB 4.16Å; M398-R471 WeakPolarHBondContact CB-O 3.27Å; M398-R471 PolarHBondContact N-O 2.99Å; D399-R471 VanDerWaalsContact CG-NH1 3.29Å; D399-R471 IonicContact OD1-CZ 2.67Å; D399-R471 IonicContact OD1-NH1 2.73Å; D399-R471 PolarHBondContact OD1-NH1 3.05Å; D399-R471 VanDerWaalsContact OD1-NH1 3.14Å; D399-R471 IonicContact OD1-NH2 2.67Å; D399-R471 PolarHBondContact OD1-NH2 2.96Å; D399-R471 IonicContact OD2-CZ 2.76Å; D399-R471 VanDerWaalsContact OD2-CZ 3.29Å; D399-R471 IonicContact OD2-NH1 2.6Å; D399-R471 PolarHBondContact OD2-NH1 3.18Å; D399-R471 IonicContact OD2-NH2 3.63Å; F468-R471 PolarHBondContact O-N 2.99Å; P469-R471 PolarHBondContact O-N 3.48Å
472	H	94	Very high	94.9	Very high	29 Å²	29	20.6 Å²	20.6	13%	0.134	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	153.2	158.6	-65.8	107.7	0	0	0	111.1	H397 F468 D470 I543	H397-H472 AromaticContact CD2-CD2 3.54Å; H397-H472 AromaticContact CD2-CE1 3.92Å; H397-H472 AromaticContact CD2-CG 3.97Å; H397-H472 AromaticContact CD2-NE2 3.48Å; H397-H472 PolarHBondContact CD2-NE2 3.13Å; F468-H472 PolarHBondContact N-O 2.71Å; D470-H472 VanDerWaalsContact C-N 3.33Å; D470-H472 WeakPolarHBondContact OD1-CB 3.04Å; D470-H472 IonicContact OD1-CG 2.68Å; D470-H472 PolarHBondContact OD1-N 3.48Å; D470-H472 IonicContact OD1-ND1 3.14Å; D470-H472 PolarHBondContact OD1-ND1 2.77Å; D470-H472 IonicContact OD2-CE1 3.95Å; D470-H472 IonicContact OD2-CG 4Å; D470-H472 IonicContact OD2-ND1 3.72Å; D470-H472 PolarHBondContact OD2-ND1 3.28Å; H472-I543 HydrophobicContact CB-CD1 3.5Å
473	V	96.1	Very high	95	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.018	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	121.2	174	-175.9	0	0	0	0	108.8	I395 Y396 R465 I466 Q467	I395-V473 WeakPolarHBondContact CA-O 3.13Å; Y396-V473 HydrophobicContact CD1-CB 4.23Å; Y396-V473 HydrophobicContact CD2-CB 4.38Å; Y396-V473 HydrophobicContact CE1-CB 3.82Å; Y396-V473 HydrophobicContact CE1-CG1 3.78Å; Y396-V473 HydrophobicContact CE2-CB 3.98Å; Y396-V473 HydrophobicContact CE2-CG2 3.98Å; Y396-V473 HydrophobicContact CG-CB 4.5Å; Y396-V473 PolarHBondContact N-O 3.37Å; Y396-V473 VanDerWaalsContact N-O 3.08Å; Y396-V473 PolarHBondContact O-N 2.92Å; R465-V473 HydrophobicContact CB-CG1 3.76Å; R465-V473 HydrophobicContact CG-CG1 4.13Å; I466-V473 WeakPolarHBondContact O-CA 3.49Å; Q467-V473 HydrophobicContact CB-CG2 4.22Å; Q467-V473 HydrophobicContact CG-CG2 4.25Å
474	L	96.6	Very high	95	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	113.3	168.1	172.1	63.2	0	0	0	108.7	P393 I395 I466 F468 F490 L491 H494	P393-L474 HydrophobicContact CB-CD1 4.24Å; I395-L474 HydrophobicContact CD1-CD1 4Å; I395-L474 HydrophobicContact CG1-CB 4.24Å; I395-L474 HydrophobicContact CG1-CD1 3.58Å; I466-L474 HydrophobicContact CB-CB 4.47Å; I466-L474 PolarHBondContact N-O 2.9Å; I466-L474 PolarHBondContact O-N 2.78Å; F468-L474 HydrophobicContact CE2-CB 3.98Å; L474-F490 HydrophobicContact CD1-CE1 4.32Å; L474-F490 HydrophobicContact CD1-CZ 4.03Å; L474-F490 HydrophobicContact CD2-CD1 4.35Å; L474-F490 HydrophobicContact CD2-CE1 3.63Å; L474-F490 HydrophobicContact CD2-CZ 4.06Å; L474-F490 HydrophobicContact CG-CE1 3.86Å; L474-F490 HydrophobicContact CG-CZ 4.09Å; L474-L491 HydrophobicContact CD2-CD1 3.76Å; L474-H494 HydrophobicContact CD2-CB 3.82Å
475	Q	96.2	Very high	94.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	142.4	169.3	179.7	170.6	-63.6	0	0	110.3	P393 L394 V463 L464 R465 A557 S560	P393-Q475 WeakPolarHBondContact CA-O 3.35Å; L394-Q475 HydrophobicContact CB-CB 4.38Å; L394-Q475 PolarHBondContact N-O 3.14Å; L394-Q475 VanDerWaalsContact N-O 3.07Å; L394-Q475 PolarHBondContact O-N 3.25Å; V463-Q475 HydrophobicContact CG1-CG 3.78Å; L464-Q475 WeakPolarHBondContact O-CA 3.38Å; R465-Q475 HydrophobicContact CG-CB 4.25Å; R465-Q475 HydrophobicContact CG-CG 4.3Å; Q475-A557 PolarHBondContact NE2-O 3.1Å; Q475-A557 PolarHBondContact OE1-O 2.8Å; Q475-A557 VanDerWaalsContact OE1-O 3.05Å; Q475-S560 PolarHBondContact NE2-OG 3.18Å; Q475-S560 VanDerWaalsContact NE2-OG 3.14Å
476	G	95.2	Very high	94.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	157.3	168.1	0	0	0	0	0	112.6	R391 L464 F478	R391-G476 CarbonylContact O-C 3.57Å; R391-G476 VanDerWaalsContact O-CA 3.26Å; R391-G476 WeakPolarHBondContact O-CA 3.48Å; L464-G476 PolarHBondContact N-O 2.85Å; L464-G476 PolarHBondContact O-N 2.8Å; G476-F478 WeakPolarHBondContact O-CD2 3.27Å
477	F	95.2	Very high	94.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	146.4	179.2	-63.9	-95.9	0	0	0	111.9	R391 E392 K461 V462 V463 S560 C564	R391-F477 WeakPolarHBondContact CD-O 3.26Å; R391-F477 PolarHBondContact O-N 3.15Å; E392-F477 HydrophobicContact CB-CD2 3.81Å; E392-F477 HydrophobicContact CB-CE2 4.12Å; K461-F477 HydrophobicContact CB-CD1 4.42Å; K461-F477 HydrophobicContact CD-CB 4.41Å; K461-F477 HydrophobicContact CD-CD1 3.87Å; K461-F477 HydrophobicContact CD-CG 4.39Å; V462-F477 CarbonylContact O-C 3.53Å; V462-F477 WeakPolarHBondContact O-CA 3.29Å; V463-F477 HydrophobicContact CG1-CE1 4.39Å; V463-F477 HydrophobicContact CG2-CD1 3.76Å; V463-F477 HydrophobicContact CG2-CE1 3.53Å; V463-F477 HydrophobicContact CG2-CZ 4.43Å; F477-S560 WeakPolarHBondContact CZ-O 3.14Å; F477-C564 HydrophobicContact CE1-CB 4.18Å; F477-C564 WeakPolarHBondContact CE1-SG 3.38Å
478	F	95.1	Very high	94.6	Very high	1 Å²	1	24 Å²	24	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	166	-176.2	-62.8	-100.9	0	0	0	110.5	V462 L464 G476 E482 V487 F490 L520	V462-F478 HydrophobicContact CB-CB 4.38Å; V462-F478 PolarHBondContact N-O 2.91Å; V462-F478 PolarHBondContact O-N 3.42Å; L464-F478 HydrophobicContact CB-CD2 4.11Å; L464-F478 HydrophobicContact CB-CE2 3.9Å; L464-F478 HydrophobicContact CD1-CD2 3.74Å; L464-F478 HydrophobicContact CD1-CE2 3.73Å; L464-F478 HydrophobicContact CD1-CG 4.25Å; L464-F478 HydrophobicContact CD1-CZ 4.18Å; L464-F478 HydrophobicContact CG-CD2 3.76Å; L464-F478 HydrophobicContact CG-CE2 3.96Å; G476-F478 WeakPolarHBondContact O-CD2 3.27Å; F478-E482 VanDerWaalsContact CA-OE1 3.29Å; F478-E482 WeakPolarHBondContact CA-OE1 3.42Å; F478-V487 HydrophobicContact CD1-CG2 4.19Å; F478-V487 HydrophobicContact CE1-CB 4.22Å; F478-V487 HydrophobicContact CE1-CG2 3.78Å; F478-V487 HydrophobicContact CZ-CB 4.36Å; F478-V487 HydrophobicContact CZ-CG1 4.18Å; F478-V487 HydrophobicContact CZ-CG2 4.13Å; F478-F490 HydrophobicContact CE1-CB 4.35Å; F478-F490 HydrophobicContact CE2-CD1 4.43Å; F478-F490 HydrophobicContact CZ-CB 4.23Å; F478-F490 AromaticContact CZ-CD1 3.67Å; F478-F490 HydrophobicContact CZ-CD1 3.67Å; F478-F490 HydrophobicContact CZ-CE1 4.16Å; F478-F490 AromaticContact CZ-CG 3.99Å; F478-F490 HydrophobicContact CZ-CG 3.99Å; F478-L520 HydrophobicContact CB-CD1 3.51Å; F478-L520 HydrophobicContact CG-CD1 4.03Å
479	R	93.1	Very high	94.5	Very high	27 Å²	27	30.1 Å²	30.1	10%	0.102	16%	0.156	C	C	.	.			trans	-84.2	156.5	164.7	-67.2	-62.3	-155.3	-169.7	-0.3	112.2	E384 F385 V389 P460 L481 E482	E384-R479 VanDerWaalsContact O-CZ 3.26Å; E384-R479 PolarHBondContact O-NE 3.19Å; E384-R479 PolarHBondContact O-NH2 2.87Å; E384-R479 IonicContact OE1-CZ 3.57Å; E384-R479 IonicContact OE1-NH1 2.68Å; E384-R479 IonicContact OE1-NH2 2.66Å; E384-R479 PolarHBondContact OE1-NH2 3.28Å; F385-R479 WeakPolarHBondContact O-CB 3.43Å; V389-R479 HydrophobicContact CB-CG 4.46Å; V389-R479 HydrophobicContact CG2-CG 3.67Å; P460-R479 WeakPolarHBondContact O-CD 3.25Å; P460-R479 PolarHBondContact O-NH1 3.01Å; R479-L481 VanDerWaalsContact C-N 3.25Å; R479-L481 PolarHBondContact O-N 3.08Å; R479-E482 HydrophobicContact CB-CG 4.14Å; R479-E482 PolarHBondContact N-OE1 3.16Å; R479-E482 PolarHBondContact O-N 2.98Å
480	P	93.4	Very high	94.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.4	175.9	-23.8	34.4	0	0	0	113.8	F385 M456 V462 L520 V521 F526	F385-P480 HydrophobicContact CD1-CG 4.47Å; M456-P480 HydrophobicContact CE-CB 4.4Å; M456-P480 HydrophobicContact CG-CB 4.46Å; V462-P480 HydrophobicContact CG2-CB 4.21Å; V462-P480 HydrophobicContact CG2-CG 3.89Å; P480-L520 PolarHBondContact O-N 2.85Å; P480-V521 HydrophobicContact CB-CG2 3.65Å; P480-V521 WeakPolarHBondContact O-CG2 3.39Å; P480-V521 PolarHBondContact O-N 3.07Å; P480-F526 HydrophobicContact CB-CD2 4.07Å; P480-F526 HydrophobicContact CB-CE2 3.95Å; P480-F526 HydrophobicContact CG-CD2 4.22Å; P480-F526 HydrophobicContact CG-CE2 3.71Å; P480-F526 HydrophobicContact CG-CZ 4.39Å
481	L	93.1	Very high	94.8	Very high	51 Å²	51	25 Å²	25	27%	0.267	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	1.6	-178.6	-59.2	-176.4	0	0	0	114.1	F385 L386 M456 R479	F385-L481 HydrophobicContact CB-CD1 3.85Å; F385-L481 HydrophobicContact CB-CG 4.24Å; L386-L481 HydrophobicContact CD2-CB 4.21Å; L386-L481 HydrophobicContact CD2-CD1 4.25Å; M456-L481 HydrophobicContact CE-CD1 4.38Å; M456-L481 HydrophobicContact CE-CD2 3.79Å; M456-L481 HydrophobicContact CE-CG 4.03Å; R479-L481 VanDerWaalsContact C-N 3.25Å; R479-L481 PolarHBondContact O-N 3.08Å
482	E	94.3	Very high	94.9	Very high	15 Å²	15	24.8 Å²	24.8	7%	0.07	12%	0.123	C	C	.	.			trans	-67.4	155.4	169.3	-79.9	-174.3	-104	0	0	111.3	R391 F478 R479 A486 T519 L520	R391-E482 IonicContact CZ-OE2 3.83Å; R391-E482 VanDerWaalsContact CZ-OE2 3.23Å; R391-E482 IonicContact NE-OE2 2.42Å; R391-E482 IonicContact NH1-OE2 3.78Å; R391-E482 IonicContact NH2-OE2 3.36Å; R391-E482 PolarHBondContact NH2-OE2 2.98Å; F478-E482 VanDerWaalsContact CA-OE1 3.29Å; F478-E482 WeakPolarHBondContact CA-OE1 3.42Å; R479-E482 HydrophobicContact CB-CG 4.14Å; R479-E482 PolarHBondContact N-OE1 3.16Å; R479-E482 PolarHBondContact O-N 2.98Å; E482-A486 HydrophobicContact CB-CB 4.43Å; E482-T519 CarbonylContact O-C 3.56Å; E482-T519 VanDerWaalsContact O-CA 3.24Å; E482-T519 WeakPolarHBondContact O-CA 3.35Å; E482-L520 WeakPolarHBondContact O-CG 3.36Å; E482-L520 PolarHBondContact O-N 3.49Å
483	T	95.8	Very high	94.9	Very high	48 Å²	48	26.1 Å²	26.1	29%	0.294	14%	0.136	S	C	.	.	B	Isolated β-bridge	trans	-98.1	158.9	-174.9	66.8	0	0	0	0	112.8	G485 A486 V487 P516 S517 A518	T483-G485 PolarHBondContact O-N 2.86Å; T483-G485 VanDerWaalsContact O-N 3.13Å; T483-G485 PolarHBondContact OG1-N 2.86Å; T483-A486 WeakPolarHBondContact O-CB 3.47Å; T483-A486 PolarHBondContact O-N 3.27Å; T483-A486 PolarHBondContact OG1-N 2.93Å; T483-V487 PolarHBondContact O-N 3.36Å; T483-P516 WeakPolarHBondContact CB-O 3.34Å; T483-P516 PolarHBondContact OG1-O 3.12Å; T483-S517 VanDerWaalsContact CG2-O 3.29Å; T483-S517 WeakPolarHBondContact CG2-O 3.42Å; T483-A518 CarbonylContact C-O 3.55Å; T483-A518 VanDerWaalsContact CA-O 3.27Å; T483-A518 WeakPolarHBondContact CA-O 3.27Å
484	V	95.9	Very high	94.8	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.018	14%	0.14	C	C	.	.	H	α-helix	trans	-54.1	-30.7	168.2	175.6	0	0	0	0	111.2	V487 R488 L513 D515 A518 A523	V484-V487 WeakPolarHBondContact O-CB 3.32Å; V484-V487 PolarHBondContact O-N 3.44Å; V484-R488 WeakPolarHBondContact O-CG 3.28Å; V484-R488 PolarHBondContact O-N 2.91Å; V484-L513 HydrophobicContact CG1-CB 4.1Å; V484-D515 WeakPolarHBondContact CB-O 3.45Å; V484-A518 PolarHBondContact N-O 2.79Å; V484-A523 HydrophobicContact CG2-CB 3.95Å
485	G	95.1	Very high	94.6	Very high	24 Å²	24	27.2 Å²	27.2	25%	0.247	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-42.4	171.3	0	0	0	0	0	113.6	T483 V487 R488 H489 P516	T483-G485 PolarHBondContact O-N 2.86Å; T483-G485 VanDerWaalsContact O-N 3.13Å; T483-G485 PolarHBondContact OG1-N 2.86Å; G485-V487 VanDerWaalsContact C-N 3.33Å; G485-V487 PolarHBondContact O-N 3.38Å; G485-R488 PolarHBondContact O-N 3.46Å; G485-H489 PolarHBondContact O-N 3.38Å; G485-P516 WeakPolarHBondContact CA-O 3.35Å; G485-P516 PolarHBondContact N-O 3.31Å
486	A	94.7	Very high	94.4	Very high	22 Å²	22	30.7 Å²	30.7	18%	0.182	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-34.6	175.8	0	0	0	0	0	112.4	E482 T483 H489 F490	E482-A486 HydrophobicContact CB-CB 4.43Å; T483-A486 WeakPolarHBondContact O-CB 3.47Å; T483-A486 PolarHBondContact O-N 3.27Å; T483-A486 PolarHBondContact OG1-N 2.93Å; A486-H489 PolarHBondContact O-N 3.3Å; A486-F490 WeakPolarHBondContact O-CB 3.4Å; A486-F490 PolarHBondContact O-N 3.05Å
487	V	95.3	Very high	94.2	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.012	18%	0.178	C	C	.	.	H	α-helix	trans	-65.8	-45.3	171.5	-170.7	0	0	0	0	111	L464 I466 F478 T483 V484 G485 H489 F490 L491 L504 L520	L464-V487 HydrophobicContact CD1-CB 4.34Å; L464-V487 HydrophobicContact CD1-CG1 3.85Å; L464-V487 HydrophobicContact CD1-CG2 3.45Å; L464-V487 VanDerWaalsContact CD1-CG2 3.45Å; I466-V487 HydrophobicContact CD1-CG1 3.87Å; F478-V487 HydrophobicContact CD1-CG2 4.19Å; F478-V487 HydrophobicContact CE1-CB 4.22Å; F478-V487 HydrophobicContact CE1-CG2 3.78Å; F478-V487 HydrophobicContact CZ-CB 4.36Å; F478-V487 HydrophobicContact CZ-CG1 4.18Å; F478-V487 HydrophobicContact CZ-CG2 4.13Å; T483-V487 PolarHBondContact O-N 3.36Å; V484-V487 WeakPolarHBondContact O-CB 3.32Å; V484-V487 PolarHBondContact O-N 3.44Å; G485-V487 VanDerWaalsContact C-N 3.33Å; G485-V487 PolarHBondContact O-N 3.38Å; V487-H489 VanDerWaalsContact C-N 3.3Å; V487-H489 PolarHBondContact O-N 3.5Å; V487-F490 PolarHBondContact O-N 3.05Å; V487-L491 WeakPolarHBondContact O-CB 3.4Å; V487-L491 PolarHBondContact O-N 3.09Å; V487-L504 HydrophobicContact CG1-CD1 4.09Å; V487-L520 HydrophobicContact CG2-CD2 3.61Å
488	R	94.9	Very high	94	Very high	67 Å²	67	37.2 Å²	37.2	25%	0.253	20%	0.195	S	C	.	.	H	α-helix	trans	-68.2	-25.5	177.2	-67.9	-175.6	75.1	-152.8	8	113.4	V484 G485 R492 F502 L504	V484-R488 WeakPolarHBondContact O-CG 3.28Å; V484-R488 PolarHBondContact O-N 2.91Å; G485-R488 PolarHBondContact O-N 3.46Å; R488-R492 WeakPolarHBondContact O-CG 3.46Å; R488-R492 PolarHBondContact O-N 3.18Å; R488-R492 PolarHBondContact O-NH1 2.92Å; R488-F502 HydrophobicContact CB-CE2 4.33Å; R488-F502 HydrophobicContact CB-CZ 4.17Å; R488-F502 HydrophobicContact CG-CE2 4.08Å; R488-F502 HydrophobicContact CG-CZ 4.41Å; R488-F502 PolarHBondContact NH2-O 2.93Å; R488-L504 HydrophobicContact CG-CD1 3.87Å; R488-L504 HydrophobicContact CG-CG 4.49Å
489	H	94.4	Very high	93.7	Very high	133 Å²	133	45.1 Å²	45.1	62%	0.616	23%	0.232	S	C	*	.	H	α-helix	trans	-75.4	-48.7	172.5	-178.9	72.3	0	0	0	111.2	G485 A486 V487 L491 R492 S493	G485-H489 PolarHBondContact O-N 3.38Å; A486-H489 PolarHBondContact O-N 3.3Å; V487-H489 VanDerWaalsContact C-N 3.3Å; V487-H489 PolarHBondContact O-N 3.5Å; H489-L491 VanDerWaalsContact C-N 3.27Å; H489-L491 PolarHBondContact O-N 3.22Å; H489-R492 PolarHBondContact O-N 3.3Å; H489-S493 PolarHBondContact O-N 3.07Å
490	F	95.2	Very high	93.6	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.035	23%	0.231	C	C	.	.	H	α-helix	trans	-54	-43.4	172.8	167	-102.7	0	0	0	112.3	R391 P393 I466 L474 F478 A486 V487 R492 S493 H494	R391-F490 HydrophobicContact CB-CD2 3.83Å; R391-F490 HydrophobicContact CB-CE2 3.49Å; R391-F490 VanDerWaalsContact CB-CE2 3.49Å; R391-F490 HydrophobicContact CB-CZ 4.34Å; R391-F490 HydrophobicContact CG-CD2 3.84Å; R391-F490 HydrophobicContact CG-CE2 4.05Å; P393-F490 HydrophobicContact CB-CE2 4.06Å; P393-F490 HydrophobicContact CB-CZ 4.06Å; I466-F490 HydrophobicContact CD1-CD1 4.49Å; L474-F490 HydrophobicContact CD1-CE1 4.32Å; L474-F490 HydrophobicContact CD1-CZ 4.03Å; L474-F490 HydrophobicContact CD2-CD1 4.35Å; L474-F490 HydrophobicContact CD2-CE1 3.63Å; L474-F490 HydrophobicContact CD2-CZ 4.06Å; L474-F490 HydrophobicContact CG-CE1 3.86Å; L474-F490 HydrophobicContact CG-CZ 4.09Å; F478-F490 HydrophobicContact CE1-CB 4.35Å; F478-F490 HydrophobicContact CE2-CD1 4.43Å; F478-F490 HydrophobicContact CZ-CB 4.23Å; F478-F490 AromaticContact CZ-CD1 3.67Å; F478-F490 HydrophobicContact CZ-CD1 3.67Å; F478-F490 HydrophobicContact CZ-CE1 4.16Å; F478-F490 AromaticContact CZ-CG 3.99Å; F478-F490 HydrophobicContact CZ-CG 3.99Å; A486-F490 WeakPolarHBondContact O-CB 3.4Å; A486-F490 PolarHBondContact O-N 3.05Å; V487-F490 PolarHBondContact O-N 3.05Å; F490-R492 PolarHBondContact O-N 3.47Å; F490-S493 PolarHBondContact O-N 3.22Å; F490-S493 PolarHBondContact O-OG 3.3Å; F490-H494 AromaticContact CD2-CE1 3.53Å; F490-H494 AromaticContact CD2-ND1 3.95Å; F490-H494 AromaticContact CE2-CE1 3.28Å; F490-H494 WeakPolarHBondContact CE2-CE1 3.21Å; F490-H494 AromaticContact CE2-ND1 3.91Å; F490-H494 AromaticContact CE2-NE2 3.75Å; F490-H494 AromaticContact CZ-CE1 4Å; F490-H494 PolarHBondContact O-ND1 3.38Å
491	L	95	Very high	93.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-47	178.7	-169.1	56.1	0	0	0	111.7	I466 F468 L474 V487 H489 S493 H494 L495 F502 L504 F533	I466-L491 HydrophobicContact CD1-CB 4.45Å; I466-L491 HydrophobicContact CD1-CD1 3.95Å; I466-L491 HydrophobicContact CD1-CD2 4.31Å; I466-L491 HydrophobicContact CD1-CG 4.5Å; I466-L491 HydrophobicContact CG2-CD1 4.02Å; I466-L491 HydrophobicContact CG2-CD2 4.09Å; F468-L491 HydrophobicContact CE1-CD1 4.45Å; F468-L491 HydrophobicContact CE2-CD1 4.26Å; F468-L491 HydrophobicContact CZ-CD1 3.62Å; L474-L491 HydrophobicContact CD2-CD1 3.76Å; V487-L491 WeakPolarHBondContact O-CB 3.4Å; V487-L491 PolarHBondContact O-N 3.09Å; H489-L491 VanDerWaalsContact C-N 3.27Å; H489-L491 PolarHBondContact O-N 3.22Å; L491-S493 VanDerWaalsContact C-N 3.27Å; L491-S493 PolarHBondContact O-N 3.42Å; L491-H494 PolarHBondContact O-N 3.01Å; L491-L495 HydrophobicContact CG-CD2 4.45Å; L491-L495 HydrophobicContact CG-CG 4.47Å; L491-L495 WeakPolarHBondContact O-CG 3.34Å; L491-L495 PolarHBondContact O-N 3.01Å; L491-F502 HydrophobicContact CB-CZ 4.37Å; L491-F502 HydrophobicContact CD2-CD2 4.05Å; L491-F502 HydrophobicContact CD2-CE2 3.64Å; L491-F502 HydrophobicContact CD2-CZ 4.11Å; L491-F502 HydrophobicContact CG-CE2 4.45Å; L491-F502 HydrophobicContact CG-CZ 4.46Å; L491-L504 HydrophobicContact CD2-CD2 3.76Å; L491-F533 HydrophobicContact CD2-CD2 3.75Å; L491-F533 HydrophobicContact CD2-CE2 4.2Å
492	R	94.9	Very high	93.7	Very high	87 Å²	87	46.4 Å²	46.4	33%	0.328	25%	0.247	S	C	.	.	H	α-helix	trans	-57.3	-35.2	178.6	-78.1	-173.4	-174.2	97	-15.6	114	R488 H489 F490 H494 L495 P498 F502	R488-R492 WeakPolarHBondContact O-CG 3.46Å; R488-R492 PolarHBondContact O-N 3.18Å; R488-R492 PolarHBondContact O-NH1 2.92Å; H489-R492 PolarHBondContact O-N 3.3Å; F490-R492 PolarHBondContact O-N 3.47Å; R492-H494 PolarHBondContact O-N 3.27Å; R492-L495 PolarHBondContact O-N 3.33Å; R492-P498 WeakPolarHBondContact CD-O 3.31Å; R492-F502 HydrophobicContact CG-CE1 3.68Å; R492-F502 HydrophobicContact CG-CZ 4.1Å
493	S	93.4	Very high	93.8	Very high	58 Å²	58	48.5 Å²	48.5	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-71.2	-13	177.8	60.5	0	0	0	0	113.6	H489 F490 L491 K544	H489-S493 PolarHBondContact O-N 3.07Å; F490-S493 PolarHBondContact O-N 3.22Å; F490-S493 PolarHBondContact O-OG 3.3Å; L491-S493 VanDerWaalsContact C-N 3.27Å; L491-S493 PolarHBondContact O-N 3.42Å; S493-K544 WeakPolarHBondContact O-CE 3.41Å; S493-K544 PolarHBondContact O-NZ 3.01Å
494	H	93.3	Very high	93.8	Very high	24 Å²	24	46.3 Å²	46.3	11%	0.111	24%	0.241	C	C	.	.	H	α-helix	trans	-108.8	-4.1	178.9	-61.9	71.4	0	0	0	113.7	P393 L474 F490 L491 R492 K544 L547	P393-H494 WeakPolarHBondContact CB-NE2 3.29Å; L474-H494 HydrophobicContact CD2-CB 3.82Å; F490-H494 AromaticContact CD2-CE1 3.53Å; F490-H494 AromaticContact CD2-ND1 3.95Å; F490-H494 AromaticContact CE2-CE1 3.28Å; F490-H494 WeakPolarHBondContact CE2-CE1 3.21Å; F490-H494 AromaticContact CE2-ND1 3.91Å; F490-H494 AromaticContact CE2-NE2 3.75Å; F490-H494 AromaticContact CZ-CE1 4Å; F490-H494 PolarHBondContact O-ND1 3.38Å; L491-H494 PolarHBondContact O-N 3.01Å; R492-H494 PolarHBondContact O-N 3.27Å; H494-K544 PolarHBondContact O-N 3.26Å; H494-L547 HydrophobicContact CB-CD1 4.13Å
495	L	93.5	Very high	93.9	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-80.1	146	173.6	-64.2	174.9	0	0	0	111.7	F468 L491 R492 D497 I500 F502 F533 Y542 K544	F468-L495 HydrophobicContact CE1-CD2 3.68Å; F468-L495 HydrophobicContact CZ-CD2 4.01Å; L491-L495 HydrophobicContact CG-CD2 4.45Å; L491-L495 HydrophobicContact CG-CG 4.47Å; L491-L495 WeakPolarHBondContact O-CG 3.34Å; L491-L495 PolarHBondContact O-N 3.01Å; R492-L495 PolarHBondContact O-N 3.33Å; L495-D497 VanDerWaalsContact C-N 3.34Å; L495-D497 WeakPolarHBondContact CB-O 3.47Å; L495-I500 HydrophobicContact CD1-CG2 3.7Å; L495-F502 HydrophobicContact CD1-CD1 3.96Å; L495-F502 HydrophobicContact CD1-CE1 3.95Å; L495-F533 HydrophobicContact CD1-CE2 4.32Å; L495-F533 HydrophobicContact CD2-CE2 4.06Å; L495-F533 HydrophobicContact CD2-CZ 4.28Å; L495-Y542 CarbonylContact C-O 3.55Å; L495-Y542 WeakPolarHBondContact CA-O 3.26Å; L495-Y542 VanDerWaalsContact CD2-O 3.29Å; L495-Y542 WeakPolarHBondContact CD2-O 3.4Å; L495-K544 WeakPolarHBondContact O-CE 3.27Å; L495-K544 VanDerWaalsContact O-CG 3.27Å; L495-K544 WeakPolarHBondContact O-CG 3.1Å
496	E	91.6	Very high	94	Very high	74 Å²	74	48.6 Å²	48.6	35%	0.346	25%	0.246	S	C	.	.	S	Bend	trans	-62.9	-41.9	172.6	-176.2	91.3	171.2	0	0	110.7	Y542 K544 R545	E496-Y542 PolarHBondContact N-O 3.43Å; E496-K544 VanDerWaalsContact OE2-CA 3.28Å; E496-K544 WeakPolarHBondContact OE2-CA 3.47Å; E496-R545 IonicContact OE1-CZ 2.64Å; E496-R545 IonicContact OE1-NE 2.66Å; E496-R545 PolarHBondContact OE1-NE 2.77Å; E496-R545 IonicContact OE1-NH2 3.18Å; E496-R545 PolarHBondContact OE1-NH2 2.94Å; E496-R545 PolarHBondContact OE2-N 3.37Å; E496-R545 IonicContact OE2-NE 3.53Å
497	D	90.7	Very high	94	Very high	81 Å²	81	50.4 Å²	50.4	43%	0.433	25%	0.254	S	S	.	.	S	Bend	trans	-110.3	109.3	168.7	177.1	6.9	0	0	0	110.1	L495 E499 I500	L495-D497 VanDerWaalsContact C-N 3.34Å; L495-D497 WeakPolarHBondContact CB-O 3.47Å; D497-E499 VanDerWaalsContact C-N 3.3Å; D497-E499 PolarHBondContact O-N 3.37Å; D497-E499 PolarHBondContact OD1-N 3.04Å; D497-I500 HydrophobicContact CB-CB 4.35Å; D497-I500 VanDerWaalsContact O-CG2 3.26Å; D497-I500 WeakPolarHBondContact O-CG2 3.43Å
498	P	90.7	Very high	93.8	Very high	55 Å²	55	56.3 Å²	56.3	36%	0.357	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.2	177.8	-22.2	34.9	0	0	0	115.4	R492	R492-P498 WeakPolarHBondContact CD-O 3.31Å
499	E	88.8	Confident	93.7	Very high	167 Å²	167	58.1 Å²	58.1	78%	0.78	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-3.8	-174.9	-64.9	-59.1	137.6	0	0	113.1	D497 S501	D497-E499 VanDerWaalsContact C-N 3.3Å; D497-E499 PolarHBondContact O-N 3.37Å; D497-E499 PolarHBondContact OD1-N 3.04Å; E499-S501 PolarHBondContact O-N 2.71Å
500	I	92.3	Very high	93.7	Very high	16 Å²	16	57 Å²	57	8%	0.082	31%	0.307	C	S	.	.			trans	-57.4	135.9	178.4	-163.3	174.3	0	0	0	112.1	L495 D497 F502 V537 Y542	L495-I500 HydrophobicContact CD1-CG2 3.7Å; D497-I500 HydrophobicContact CB-CB 4.35Å; D497-I500 VanDerWaalsContact O-CG2 3.26Å; D497-I500 WeakPolarHBondContact O-CG2 3.43Å; I500-F502 HydrophobicContact CG2-CD1 4.38Å; I500-F502 WeakPolarHBondContact O-CD1 3.41Å; I500-F502 PolarHBondContact O-N 3.18Å; I500-V537 HydrophobicContact CD1-CB 4.29Å; I500-V537 HydrophobicContact CD1-CG1 4.46Å; I500-V537 HydrophobicContact CG1-CB 4.26Å; I500-Y542 HydrophobicContact CD1-CD1 4.17Å; I500-Y542 HydrophobicContact CD1-CE1 4.16Å
501	S	92.9	Very high	93.8	Very high	81 Å²	81	60.1 Å²	60.1	57%	0.566	33%	0.326	S	S	*	.			trans	-77.2	107.6	178	-179.4	0	0	0	0	111.4	E499 S535	E499-S501 PolarHBondContact O-N 2.71Å; S501-S535 PolarHBondContact O-OG 3.41Å
502	F	95.1	Very high	93.8	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.035	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155	178.4	75.3	-90.3	0	0	0	114.3	R488 L491 R492 L495 I500 L504 F533 G534	R488-F502 HydrophobicContact CB-CE2 4.33Å; R488-F502 HydrophobicContact CB-CZ 4.17Å; R488-F502 HydrophobicContact CG-CE2 4.08Å; R488-F502 HydrophobicContact CG-CZ 4.41Å; R488-F502 PolarHBondContact NH2-O 2.93Å; L491-F502 HydrophobicContact CB-CZ 4.37Å; L491-F502 HydrophobicContact CD2-CD2 4.05Å; L491-F502 HydrophobicContact CD2-CE2 3.64Å; L491-F502 HydrophobicContact CD2-CZ 4.11Å; L491-F502 HydrophobicContact CG-CE2 4.45Å; L491-F502 HydrophobicContact CG-CZ 4.46Å; R492-F502 HydrophobicContact CG-CE1 3.68Å; R492-F502 HydrophobicContact CG-CZ 4.1Å; L495-F502 HydrophobicContact CD1-CD1 3.96Å; L495-F502 HydrophobicContact CD1-CE1 3.95Å; I500-F502 HydrophobicContact CG2-CD1 4.38Å; I500-F502 WeakPolarHBondContact O-CD1 3.41Å; I500-F502 PolarHBondContact O-N 3.18Å; F502-L504 HydrophobicContact CD2-CD2 4.43Å; F502-L504 HydrophobicContact CD2-CG 4.48Å; F502-L504 HydrophobicContact CE2-CD2 4.47Å; F502-L504 HydrophobicContact CE2-CG 4.31Å; F502-F533 HydrophobicContact CB-CD2 4.03Å; F502-F533 HydrophobicContact CB-CE2 3.29Å; F502-F533 HydrophobicContact CB-CZ 3.6Å; F502-F533 HydrophobicContact CD1-CE2 4.09Å; F502-F533 HydrophobicContact CD2-CD2 4.03Å; F502-F533 AromaticContact CD2-CE2 3.82Å; F502-F533 HydrophobicContact CD2-CE2 3.82Å; F502-F533 HydrophobicContact CG-CD2 4.13Å; F502-F533 AromaticContact CG-CE2 3.46Å; F502-F533 HydrophobicContact CG-CE2 3.46Å; F502-F533 VanDerWaalsContact CG-CE2 3.46Å; F502-F533 HydrophobicContact CG-CZ 4.21Å; F502-G534 CarbonylContact C-O 3.54Å; F502-G534 VanDerWaalsContact CA-O 3.27Å; F502-G534 WeakPolarHBondContact CA-O 3.33Å; F502-G534 WeakPolarHBondContact CB-O 3.49Å
503	Y	95.7	Very high	93.8	Very high	60 Å²	60	60.6 Å²	60.6	24%	0.235	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	156.2	171	62.1	-93.9	0	0	0	111.1	F505 K510 I512 G534	Y503-F505 AromaticContact CD2-CD1 3.86Å; Y503-F505 HydrophobicContact CD2-CD1 3.86Å; Y503-F505 AromaticContact CE2-CD1 3.54Å; Y503-F505 HydrophobicContact CE2-CD1 3.54Å; Y503-F505 AromaticContact CE2-CE1 3.95Å; Y503-F505 HydrophobicContact CE2-CE1 3.95Å; Y503-F505 HydrophobicContact CE2-CG 4.43Å; Y503-K510 PolarHBondContact OH-NZ 3.32Å; Y503-I512 HydrophobicContact CD2-CD1 4.3Å; Y503-I512 HydrophobicContact CD2-CG1 4.27Å; Y503-I512 HydrophobicContact CD2-CG2 4.26Å; Y503-I512 HydrophobicContact CE2-CD1 4.35Å; Y503-I512 HydrophobicContact CE2-CG1 4.49Å; Y503-G534 WeakPolarHBondContact CD1-O 3.36Å; Y503-G534 PolarHBondContact N-O 2.94Å; Y503-G534 PolarHBondContact O-N 3.33Å
504	L	96.9	Very high	93.7	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	144.4	175.2	-65.4	-179.9	0	0	0	109.9	I466 V487 R488 L491 F502 L513 V531 Y532	I466-L504 HydrophobicContact CG2-CD2 4.33Å; V487-L504 HydrophobicContact CG1-CD1 4.09Å; R488-L504 HydrophobicContact CG-CD1 3.87Å; R488-L504 HydrophobicContact CG-CG 4.49Å; L491-L504 HydrophobicContact CD2-CD2 3.76Å; F502-L504 HydrophobicContact CD2-CD2 4.43Å; F502-L504 HydrophobicContact CD2-CG 4.48Å; F502-L504 HydrophobicContact CE2-CD2 4.47Å; F502-L504 HydrophobicContact CE2-CG 4.31Å; L504-L513 HydrophobicContact CB-CB 4.36Å; L504-L513 HydrophobicContact CB-CD1 4.05Å; L504-L513 PolarHBondContact O-N 3.28Å; L504-V531 HydrophobicContact CB-CG1 3.89Å; L504-V531 HydrophobicContact CD1-CG1 4.47Å; L504-V531 HydrophobicContact CD2-CG1 4.22Å; L504-V531 HydrophobicContact CG-CG1 4.42Å; L504-Y532 WeakPolarHBondContact CA-O 3.28Å
505	F	96.8	Very high	93.7	Very high	28 Å²	28	69.2 Å²	69.2	12%	0.123	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.9	178.8	68.3	-86.7	0	0	0	113.1	Y503 T507 K510 T511 I512 Y532	Y503-F505 AromaticContact CD2-CD1 3.86Å; Y503-F505 HydrophobicContact CD2-CD1 3.86Å; Y503-F505 AromaticContact CE2-CD1 3.54Å; Y503-F505 HydrophobicContact CE2-CD1 3.54Å; Y503-F505 AromaticContact CE2-CE1 3.95Å; Y503-F505 HydrophobicContact CE2-CE1 3.95Å; Y503-F505 HydrophobicContact CE2-CG 4.43Å; F505-T507 HydrophobicContact CD2-CG2 4.03Å; F505-T507 HydrophobicContact CE2-CG2 3.98Å; F505-K510 HydrophobicContact CB-CG 4.33Å; F505-K510 HydrophobicContact CD2-CD 4.04Å; F505-K510 HydrophobicContact CD2-CG 3.7Å; F505-K510 HydrophobicContact CE2-CD 4.15Å; F505-K510 HydrophobicContact CE2-CG 4.23Å; F505-K510 HydrophobicContact CG-CD 4.41Å; F505-K510 HydrophobicContact CG-CG 4.15Å; F505-T511 CarbonylContact C-O 3.53Å; F505-T511 WeakPolarHBondContact CA-O 3.31Å; F505-T511 VanDerWaalsContact CB-O 3.3Å; F505-T511 WeakPolarHBondContact CB-O 3.49Å; F505-I512 HydrophobicContact CB-CG1 4.09Å; F505-Y532 WeakPolarHBondContact CD1-O 3.36Å; F505-Y532 HydrophobicContact CD2-CD2 4.43Å; F505-Y532 HydrophobicContact CD2-CG 4.45Å; F505-Y532 HydrophobicContact CE2-CD2 4.23Å; F505-Y532 AromaticContact CE2-CG 3.96Å; F505-Y532 HydrophobicContact CE2-CG 3.96Å; F505-Y532 HydrophobicContact CZ-CG 4.15Å; F505-Y532 PolarHBondContact N-O 3.4Å; F505-Y532 PolarHBondContact O-N 2.88Å
506	I	97	Very high	93.7	Very high	48 Å²	48	72.4 Å²	72.4	25%	0.246	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	155.7	170.8	59.4	175.7	0	0	0	109.8	K510 T511 L525 V531	I506-K510 WeakPolarHBondContact O-CA 3.33Å; I506-T511 PolarHBondContact N-O 2.91Å; I506-T511 PolarHBondContact O-N 3.49Å; I506-L525 HydrophobicContact CG2-CD2 4Å; I506-V531 HydrophobicContact CG2-CG2 4.35Å
507	T	94.8	Very high	93.9	Very high	59 Å²	59	72.9 Å²	72.9	36%	0.362	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.2	151.4	178.2	35.2	0	0	0	0	111.7	F505 P509 K510 Y532	F505-T507 HydrophobicContact CD2-CG2 4.03Å; F505-T507 HydrophobicContact CE2-CG2 3.98Å; T507-P509 WeakPolarHBondContact CA-O 3.24Å; T507-K510 HydrophobicContact CG2-CB 3.77Å; T507-K510 HydrophobicContact CG2-CG 4.31Å; T507-Y532 WeakPolarHBondContact OG1-CD2 3.45Å; T507-Y532 WeakPolarHBondContact OG1-CE2 2.94Å
508	P	91.2	Very high	94.1	Very high	127 Å²	127	70 Å²	70	83%	0.825	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	cis	-99.6	150.3	-4.1	36.4	-31.1	0	0	0	113
509	P	93.6	Very high	94.4	Very high	105 Å²	105	68.5 Å²	68.5	68%	0.682	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	cis	-75.6	172.3	-6.5	34.4	-37.4	0	0	0	112.4	T507 T511	T507-P509 WeakPolarHBondContact CA-O 3.24Å; P509-T511 PolarHBondContact O-N 3.22Å
510	K	95.3	Very high	94.7	Very high	109 Å²	109	60.6 Å²	60.6	47%	0.474	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	99.3	-178.3	-176.5	170.5	-179.7	178.1	0	111.8	Y503 F505 I506 T507	Y503-K510 PolarHBondContact OH-NZ 3.32Å; F505-K510 HydrophobicContact CB-CG 4.33Å; F505-K510 HydrophobicContact CD2-CD 4.04Å; F505-K510 HydrophobicContact CD2-CG 3.7Å; F505-K510 HydrophobicContact CE2-CD 4.15Å; F505-K510 HydrophobicContact CE2-CG 4.23Å; F505-K510 HydrophobicContact CG-CD 4.41Å; F505-K510 HydrophobicContact CG-CG 4.15Å; I506-K510 WeakPolarHBondContact O-CA 3.33Å; T507-K510 HydrophobicContact CG2-CB 3.77Å; T507-K510 HydrophobicContact CG2-CG 4.31Å
511	T	95.8	Very high	94.8	Very high	73 Å²	73	60.8 Å²	60.8	45%	0.448	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.3	174.9	-60.5	0	0	0	0	109.6	F505 I506 P509	F505-T511 CarbonylContact C-O 3.53Å; F505-T511 WeakPolarHBondContact CA-O 3.31Å; F505-T511 VanDerWaalsContact CB-O 3.3Å; F505-T511 WeakPolarHBondContact CB-O 3.49Å; I506-T511 PolarHBondContact N-O 2.91Å; I506-T511 PolarHBondContact O-N 3.49Å; P509-T511 PolarHBondContact O-N 3.22Å
512	I	95.8	Very high	94.8	Very high	71 Å²	71	63.4 Å²	63.4	36%	0.364	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	129.9	179.8	-61.4	172.8	0	0	0	109.7	Y503 F505 K514	Y503-I512 HydrophobicContact CD2-CD1 4.3Å; Y503-I512 HydrophobicContact CD2-CG1 4.27Å; Y503-I512 HydrophobicContact CD2-CG2 4.26Å; Y503-I512 HydrophobicContact CE2-CD1 4.35Å; Y503-I512 HydrophobicContact CE2-CG1 4.49Å; F505-I512 HydrophobicContact CB-CG1 4.09Å; I512-K514 HydrophobicContact CG2-CG 4.18Å; I512-K514 PolarHBondContact O-N 2.69Å
513	L	94.3	Very high	94.8	Very high	26 Å²	26	63.8 Å²	63.8	14%	0.136	35%	0.351	C	S	.	.			trans	-76.4	88.4	176.2	-57.2	178.8	0	0	0	109.4	V484 L504 A523 L525 V531	V484-L513 HydrophobicContact CG1-CB 4.1Å; L504-L513 HydrophobicContact CB-CB 4.36Å; L504-L513 HydrophobicContact CB-CD1 4.05Å; L504-L513 PolarHBondContact O-N 3.28Å; L513-A523 HydrophobicContact CD2-CB 4.48Å; L513-L525 HydrophobicContact CD1-CD1 3.97Å; L513-L525 HydrophobicContact CD1-CD2 4.48Å; L513-V531 HydrophobicContact CD1-CG1 4.1Å
514	K	92.2	Very high	94.7	Very high	182 Å²	182	67.8 Å²	67.8	79%	0.791	38%	0.376	S	S	*	.			trans	-82.3	-37.3	-174.3	-68	179.1	-177.8	178.5	0	114	I512 P516	I512-K514 HydrophobicContact CG2-CG 4.18Å; I512-K514 PolarHBondContact O-N 2.69Å; K514-P516 WeakPolarHBondContact O-CD 3.42Å
515	D	93.5	Very high	94.6	Very high	82 Å²	82	67.9 Å²	67.9	44%	0.439	38%	0.377	S	S	.	.			trans	-84.4	119.6	-174.6	-165.3	-31.7	0	0	0	110	V484 S517 A518	V484-D515 WeakPolarHBondContact CB-O 3.45Å; D515-S517 VanDerWaalsContact C-N 3.35Å; D515-S517 WeakPolarHBondContact OD1-CA 3.45Å; D515-S517 WeakPolarHBondContact OD1-CB 3.36Å; D515-S517 PolarHBondContact OD1-N 3.01Å; D515-S517 PolarHBondContact OD1-OG 2.9Å; D515-A518 HydrophobicContact CB-CB 4.14Å; D515-A518 PolarHBondContact OD1-N 3.39Å
516	P	93.9	Very high	94.5	Very high	68 Å²	68	67.2 Å²	67.2	44%	0.442	37%	0.374	S	S	.	.	S	Bend	trans	-82.3	-11	175.8	35.3	-36.1	0	0	0	113.4	T483 G485 K514	T483-P516 WeakPolarHBondContact CB-O 3.34Å; T483-P516 PolarHBondContact OG1-O 3.12Å; G485-P516 WeakPolarHBondContact CA-O 3.35Å; G485-P516 PolarHBondContact N-O 3.31Å; K514-P516 WeakPolarHBondContact O-CD 3.42Å
517	S	95.6	Very high	94.4	Very high	83 Å²	83	66.9 Å²	66.9	58%	0.58	38%	0.375	S	S	*	.	S	Bend	trans	-95.7	-22.9	-177	68.9	0	0	0	0	113.9	T483 D515	T483-S517 VanDerWaalsContact CG2-O 3.29Å; T483-S517 WeakPolarHBondContact CG2-O 3.42Å; D515-S517 VanDerWaalsContact C-N 3.35Å; D515-S517 WeakPolarHBondContact OD1-CA 3.45Å; D515-S517 WeakPolarHBondContact OD1-CB 3.36Å; D515-S517 PolarHBondContact OD1-N 3.01Å; D515-S517 PolarHBondContact OD1-OG 2.9Å
518	A	95	Very high	94.4	Very high	22 Å²	22	66.2 Å²	66.2	18%	0.182	38%	0.379	C	S	.	.	S	Bend	trans	-58.5	139.3	173.6	0	0	0	0	0	112.2	T483 V484 D515	T483-A518 CarbonylContact C-O 3.55Å; T483-A518 VanDerWaalsContact CA-O 3.27Å; T483-A518 WeakPolarHBondContact CA-O 3.27Å; V484-A518 PolarHBondContact N-O 2.79Å; D515-A518 HydrophobicContact CB-CB 4.14Å; D515-A518 PolarHBondContact OD1-N 3.39Å
519	T	95.6	Very high	94.6	Very high	23 Å²	23	61.1 Å²	61.1	14%	0.141	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-74.1	163.6	176.6	61	0	0	0	0	112.6	E482 V521 E522 A523	E482-T519 CarbonylContact O-C 3.56Å; E482-T519 VanDerWaalsContact O-CA 3.24Å; E482-T519 WeakPolarHBondContact O-CA 3.35Å; T519-V521 PolarHBondContact O-N 3.32Å; T519-E522 WeakPolarHBondContact CB-OE2 3.33Å; T519-E522 WeakPolarHBondContact CG2-OE2 3.35Å; T519-E522 PolarHBondContact N-OE2 3.19Å; T519-E522 PolarHBondContact O-N 2.69Å; T519-E522 WeakPolarHBondContact OG1-CB 3.47Å; T519-E522 VanDerWaalsContact OG1-CD 3.26Å; T519-E522 VanDerWaalsContact OG1-CG 3.25Å; T519-E522 WeakPolarHBondContact OG1-CG 3.27Å; T519-E522 PolarHBondContact OG1-N 3.09Å; T519-E522 PolarHBondContact OG1-OE2 3.1Å; T519-A523 WeakPolarHBondContact O-CB 3.46Å; T519-A523 PolarHBondContact O-N 3.3Å
520	L	95.1	Very high	94.8	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-30.4	175.3	-58.2	-166.6	0	0	0	112.6	V462 L464 F478 P480 E482 V487 L525	V462-L520 HydrophobicContact CB-CD1 4.07Å; V462-L520 HydrophobicContact CG1-CD1 3.9Å; V462-L520 HydrophobicContact CG2-CD1 4.38Å; L464-L520 HydrophobicContact CD1-CD1 3.96Å; L464-L520 HydrophobicContact CD1-CD2 4.08Å; L464-L520 HydrophobicContact CD2-CD1 4.5Å; L464-L520 HydrophobicContact CG-CD1 4.35Å; F478-L520 HydrophobicContact CB-CD1 3.51Å; F478-L520 HydrophobicContact CG-CD1 4.03Å; P480-L520 PolarHBondContact O-N 2.85Å; E482-L520 WeakPolarHBondContact O-CG 3.36Å; E482-L520 PolarHBondContact O-N 3.49Å; V487-L520 HydrophobicContact CG2-CD2 3.61Å; L520-L525 HydrophobicContact CB-CB 4.31Å; L520-L525 HydrophobicContact CD2-CD1 4.03Å; L520-L525 WeakPolarHBondContact O-CA 3.46Å; L520-L525 WeakPolarHBondContact O-CB 3.4Å; L520-L525 PolarHBondContact O-N 3.14Å
521	V	94.3	Very high	94.9	Very high	21 Å²	21	54.5 Å²	54.5	13%	0.127	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-42.8	175.1	-173.2	0	0	0	0	111.5	M452 P480 T519 A523 D524 F526	M452-V521 HydrophobicContact CE-CB 4.42Å; M452-V521 HydrophobicContact CE-CG1 3.49Å; M452-V521 VanDerWaalsContact CE-CG1 3.49Å; P480-V521 HydrophobicContact CB-CG2 3.65Å; P480-V521 WeakPolarHBondContact O-CG2 3.39Å; P480-V521 PolarHBondContact O-N 3.07Å; T519-V521 PolarHBondContact O-N 3.32Å; V521-A523 VanDerWaalsContact C-N 3.26Å; V521-A523 PolarHBondContact O-N 2.61Å; V521-D524 PolarHBondContact O-N 2.93Å; V521-F526 HydrophobicContact CB-CB 4.44Å; V521-F526 HydrophobicContact CB-CD1 4.5Å; V521-F526 HydrophobicContact CG1-CD1 4.1Å; V521-F526 HydrophobicContact CG2-CB 4.05Å; V521-F526 HydrophobicContact CG2-CD1 3.83Å; V521-F526 HydrophobicContact CG2-CD2 4.19Å; V521-F526 HydrophobicContact CG2-CE1 4.4Å; V521-F526 HydrophobicContact CG2-CG 3.75Å
522	E	93.8	Very high	95	Very high	135 Å²	135	53.9 Å²	53.9	63%	0.631	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-24.4	177.4	-69.2	163.6	133.6	0	0	113.2	T519 D524	T519-E522 WeakPolarHBondContact CB-OE2 3.33Å; T519-E522 WeakPolarHBondContact CG2-OE2 3.35Å; T519-E522 PolarHBondContact N-OE2 3.19Å; T519-E522 PolarHBondContact O-N 2.69Å; T519-E522 WeakPolarHBondContact OG1-CB 3.47Å; T519-E522 VanDerWaalsContact OG1-CD 3.26Å; T519-E522 VanDerWaalsContact OG1-CG 3.25Å; T519-E522 WeakPolarHBondContact OG1-CG 3.27Å; T519-E522 PolarHBondContact OG1-N 3.09Å; T519-E522 PolarHBondContact OG1-OE2 3.1Å; E522-D524 VanDerWaalsContact C-N 3.32Å
523	A	94	Very high	95	Very high	16 Å²	16	50.8 Å²	50.8	13%	0.132	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	8.8	176.1	0	0	0	0	0	114.1	V484 L513 T519 V521 L525	V484-A523 HydrophobicContact CG2-CB 3.95Å; L513-A523 HydrophobicContact CD2-CB 4.48Å; T519-A523 WeakPolarHBondContact O-CB 3.46Å; T519-A523 PolarHBondContact O-N 3.3Å; V521-A523 VanDerWaalsContact C-N 3.26Å; V521-A523 PolarHBondContact O-N 2.61Å; A523-L525 HydrophobicContact CB-CD1 4.09Å; A523-L525 HydrophobicContact CB-CG 3.93Å; A523-L525 WeakPolarHBondContact O-CG 3.22Å; A523-L525 PolarHBondContact O-N 3.2Å
524	D	93.7	Very high	95	Very high	145 Å²	145	49.8 Å²	49.8	78%	0.775	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	23.5	-175	-74.3	-50	0	0	0	114.8	V521 E522 F526	V521-D524 PolarHBondContact O-N 2.93Å; E522-D524 VanDerWaalsContact C-N 3.32Å; D524-F526 VanDerWaalsContact C-N 3.28Å; D524-F526 PolarHBondContact O-N 3.03Å
525	L	95.8	Very high	95.1	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	25%	0.252	C	S	.	.			trans	-89.5	18.7	-178.4	-56.3	-178.6	0	0	0	113.7	V462 L464 I506 L513 L520 A523 A529 V531	V462-L525 VanDerWaalsContact CG1-O 3.27Å; V462-L525 WeakPolarHBondContact CG1-O 3.42Å; L464-L525 HydrophobicContact CD2-CB 3.91Å; I506-L525 HydrophobicContact CG2-CD2 4Å; L513-L525 HydrophobicContact CD1-CD1 3.97Å; L513-L525 HydrophobicContact CD1-CD2 4.48Å; L520-L525 HydrophobicContact CB-CB 4.31Å; L520-L525 HydrophobicContact CD2-CD1 4.03Å; L520-L525 WeakPolarHBondContact O-CA 3.46Å; L520-L525 WeakPolarHBondContact O-CB 3.4Å; L520-L525 PolarHBondContact O-N 3.14Å; A523-L525 HydrophobicContact CB-CD1 4.09Å; A523-L525 HydrophobicContact CB-CG 3.93Å; A523-L525 WeakPolarHBondContact O-CG 3.22Å; A523-L525 PolarHBondContact O-N 3.2Å; L525-A529 HydrophobicContact CB-CB 4.03Å; L525-A529 HydrophobicContact CD2-CB 3.8Å; L525-V531 HydrophobicContact CD1-CG2 4.4Å; L525-V531 HydrophobicContact CD2-CG2 3.78Å
526	F	94.9	Very high	94.9	Very high	14 Å²	14	44.6 Å²	44.6	6%	0.061	26%	0.264	C	S	.	.			trans	-126.7	127.6	-162.8	175.6	-112.4	0	0	0	113.3	K455 M456 Y459 V462 P480 V521 D524	K455-F526 HydrophobicContact CB-CE1 4.22Å; K455-F526 HydrophobicContact CD-CD1 3.99Å; K455-F526 HydrophobicContact CD-CE1 3.59Å; K455-F526 HydrophobicContact CG-CD1 4.49Å; K455-F526 HydrophobicContact CG-CE1 3.61Å; K455-F526 HydrophobicContact CG-CZ 4.21Å; K455-F526 PolarHBondContact NZ-O 3.17Å; K455-F526 WeakPolarHBondContact O-CZ 3.26Å; M456-F526 HydrophobicContact CG-CE1 4.15Å; M456-F526 HydrophobicContact CG-CZ 4.13Å; Y459-F526 WeakPolarHBondContact O-CE2 3.37Å; V462-F526 HydrophobicContact CG1-CD2 4.48Å; V462-F526 HydrophobicContact CG2-CD2 3.64Å; V462-F526 HydrophobicContact CG2-CE2 4.06Å; P480-F526 HydrophobicContact CB-CD2 4.07Å; P480-F526 HydrophobicContact CB-CE2 3.95Å; P480-F526 HydrophobicContact CG-CD2 4.22Å; P480-F526 HydrophobicContact CG-CE2 3.71Å; P480-F526 HydrophobicContact CG-CZ 4.39Å; V521-F526 HydrophobicContact CB-CB 4.44Å; V521-F526 HydrophobicContact CB-CD1 4.5Å; V521-F526 HydrophobicContact CG1-CD1 4.1Å; V521-F526 HydrophobicContact CG2-CB 4.05Å; V521-F526 HydrophobicContact CG2-CD1 3.83Å; V521-F526 HydrophobicContact CG2-CD2 4.19Å; V521-F526 HydrophobicContact CG2-CE1 4.4Å; V521-F526 HydrophobicContact CG2-CG 3.75Å; D524-F526 VanDerWaalsContact C-N 3.28Å; D524-F526 PolarHBondContact O-N 3.03Å
527	P	93.9	Very high	94.6	Very high	41 Å²	41	45.3 Å²	45.3	27%	0.266	27%	0.267	S	S	.	.	S	Bend	cis	-93.2	0.1	12.4	38.2	-37	0	0	0	115.5	Y459 V462 V463	Y459-P527 HydrophobicContact CD1-CB 3.8Å; Y459-P527 HydrophobicContact CD1-CG 4.02Å; Y459-P527 HydrophobicContact CD2-CB 3.9Å; Y459-P527 HydrophobicContact CD2-CG 4.01Å; Y459-P527 HydrophobicContact CE1-CB 4.48Å; Y459-P527 HydrophobicContact CE1-CG 4.21Å; Y459-P527 HydrophobicContact CE2-CG 4.21Å; Y459-P527 HydrophobicContact CG-CB 3.46Å; Y459-P527 VanDerWaalsContact CG-CB 3.46Å; Y459-P527 HydrophobicContact CG-CG 3.92Å; V462-P527 VanDerWaalsContact CA-O 3.31Å; V462-P527 WeakPolarHBondContact CA-O 3.27Å; V463-P527 PolarHBondContact N-O 3.01Å; V463-P527 VanDerWaalsContact N-O 3.15Å
528	G	94.8	Very high	94	Very high	44 Å²	44	50.8 Å²	50.8	45%	0.454	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	148.6	168.8	0	0	0	0	0	110.4	V463	V463-G528 CarbonylContact O-C 3.59Å; V463-G528 WeakPolarHBondContact O-CA 3.38Å
529	A	96.6	Very high	93.5	Very high	21 Å²	21	51.7 Å²	51.7	17%	0.174	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.5	-170.4	0	0	0	0	0	112.9	V463 L464 R465 L525 V531	V463-A529 PolarHBondContact O-N 2.95Å; L464-A529 HydrophobicContact CD2-CB 4.13Å; R465-A529 PolarHBondContact N-O 3.12Å; L525-A529 HydrophobicContact CB-CB 4.03Å; L525-A529 HydrophobicContact CD2-CB 3.8Å; A529-V531 HydrophobicContact CB-CG2 4.44Å
530	L	96.8	Very high	92.7	Very high	74 Å²	74	58.8 Å²	58.8	39%	0.387	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	118.2	166.1	-176.6	61.7	0	0	0	108.6	R465 Q467 Y532	R465-L530 HydrophobicContact CB-CD1 3.94Å; R465-L530 WeakPolarHBondContact O-CA 3.06Å; Q467-L530 HydrophobicContact CB-CD1 3.97Å; L530-Y532 HydrophobicContact CD2-CE2 4.38Å; L530-Y532 VanDerWaalsContact CD2-OH 3.3Å; L530-Y532 WeakPolarHBondContact CD2-OH 3.37Å; L530-Y532 HydrophobicContact CG-CE2 4.21Å
531	V	97.6	Very high	92.1	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.006	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.4	179.6	-176.1	0	0	0	0	108	R465 I466 Q467 L504 I506 L513 L525 A529	R465-V531 PolarHBondContact O-N 3.42Å; I466-V531 CarbonylContact C-O 3.55Å; I466-V531 VanDerWaalsContact CA-O 3.3Å; I466-V531 WeakPolarHBondContact CA-O 3.38Å; Q467-V531 PolarHBondContact N-O 3.31Å; L504-V531 HydrophobicContact CB-CG1 3.89Å; L504-V531 HydrophobicContact CD1-CG1 4.47Å; L504-V531 HydrophobicContact CD2-CG1 4.22Å; L504-V531 HydrophobicContact CG-CG1 4.42Å; I506-V531 HydrophobicContact CG2-CG2 4.35Å; L513-V531 HydrophobicContact CD1-CG1 4.1Å; L525-V531 HydrophobicContact CD1-CG2 4.4Å; L525-V531 HydrophobicContact CD2-CG2 3.78Å; A529-V531 HydrophobicContact CB-CG2 4.44Å
532	Y	97.3	Very high	91.9	Very high	60 Å²	60	63.8 Å²	63.8	24%	0.235	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.7	-178.7	-63.2	-89.6	0	0	0	110.9	Q467 L504 F505 T507 L530	Q467-Y532 HydrophobicContact CB-CD1 4.08Å; Q467-Y532 HydrophobicContact CB-CE1 4.25Å; Q467-Y532 HydrophobicContact CG-CD1 4.27Å; Q467-Y532 HydrophobicContact CG-CE1 4.28Å; Q467-Y532 VanDerWaalsContact OE1-CE1 3.24Å; L504-Y532 WeakPolarHBondContact CA-O 3.28Å; F505-Y532 WeakPolarHBondContact CD1-O 3.36Å; F505-Y532 HydrophobicContact CD2-CD2 4.43Å; F505-Y532 HydrophobicContact CD2-CG 4.45Å; F505-Y532 HydrophobicContact CE2-CD2 4.23Å; F505-Y532 AromaticContact CE2-CG 3.96Å; F505-Y532 HydrophobicContact CE2-CG 3.96Å; F505-Y532 HydrophobicContact CZ-CG 4.15Å; F505-Y532 PolarHBondContact N-O 3.4Å; F505-Y532 PolarHBondContact O-N 2.88Å; T507-Y532 WeakPolarHBondContact OG1-CD2 3.45Å; T507-Y532 WeakPolarHBondContact OG1-CE2 2.94Å; L530-Y532 HydrophobicContact CD2-CE2 4.38Å; L530-Y532 VanDerWaalsContact CD2-OH 3.3Å; L530-Y532 WeakPolarHBondContact CD2-OH 3.37Å; L530-Y532 HydrophobicContact CG-CE2 4.21Å
533	F	96.8	Very high	91.8	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	130.6	170	178.3	-93.8	0	0	0	110.5	I466 Q467 F468 P469 L491 L495 F502 Y542	I466-F533 HydrophobicContact CG2-CB 4.31Å; Q467-F533 PolarHBondContact O-N 2.91Å; F468-F533 HydrophobicContact CD1-CB 3.93Å; F468-F533 AromaticContact CD1-CD1 3.69Å; F468-F533 HydrophobicContact CD1-CD1 3.69Å; F468-F533 HydrophobicContact CD1-CD2 4.29Å; F468-F533 HydrophobicContact CD1-CE1 4.2Å; F468-F533 AromaticContact CD1-CG 3.72Å; F468-F533 HydrophobicContact CD1-CG 3.72Å; F468-F533 HydrophobicContact CE1-CB 4.28Å; F468-F533 HydrophobicContact CE1-CD1 4.1Å; F468-F533 AromaticContact CE1-CD2 3.94Å; F468-F533 HydrophobicContact CE1-CD2 3.94Å; F468-F533 HydrophobicContact CE1-CE1 4.36Å; F468-F533 HydrophobicContact CE1-CE2 4.18Å; F468-F533 AromaticContact CE1-CG 3.86Å; F468-F533 HydrophobicContact CE1-CG 3.86Å; F468-F533 HydrophobicContact CE1-CZ 4.38Å; F468-F533 HydrophobicContact CG-CB 4.31Å; P469-F533 HydrophobicContact CG-CD1 4.39Å; L491-F533 HydrophobicContact CD2-CD2 3.75Å; L491-F533 HydrophobicContact CD2-CE2 4.2Å; L495-F533 HydrophobicContact CD1-CE2 4.32Å; L495-F533 HydrophobicContact CD2-CE2 4.06Å; L495-F533 HydrophobicContact CD2-CZ 4.28Å; F502-F533 HydrophobicContact CB-CD2 4.03Å; F502-F533 HydrophobicContact CB-CE2 3.29Å; F502-F533 HydrophobicContact CB-CZ 3.6Å; F502-F533 HydrophobicContact CD1-CE2 4.09Å; F502-F533 HydrophobicContact CD2-CD2 4.03Å; F502-F533 AromaticContact CD2-CE2 3.82Å; F502-F533 HydrophobicContact CD2-CE2 3.82Å; F502-F533 HydrophobicContact CG-CD2 4.13Å; F502-F533 AromaticContact CG-CE2 3.46Å; F502-F533 HydrophobicContact CG-CE2 3.46Å; F502-F533 VanDerWaalsContact CG-CE2 3.46Å; F502-F533 HydrophobicContact CG-CZ 4.21Å; F533-Y542 HydrophobicContact CD1-CD1 4.47Å; F533-Y542 AromaticContact CE1-CD1 3.46Å; F533-Y542 HydrophobicContact CE1-CD1 3.46Å; F533-Y542 VanDerWaalsContact CE1-CD1 3.46Å; F533-Y542 AromaticContact CE1-CE1 3.85Å; F533-Y542 HydrophobicContact CE1-CE1 3.85Å; F533-Y542 AromaticContact CE1-CG 3.9Å; F533-Y542 HydrophobicContact CE1-CG 3.9Å; F533-Y542 AromaticContact CZ-CD1 3.91Å; F533-Y542 HydrophobicContact CZ-CD1 3.91Å; F533-Y542 HydrophobicContact CZ-CG 4.47Å
534	G	94.3	Very high	91.8	Very high	5 Å²	5	59.9 Å²	59.9	5%	0.052	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.2	169.5	0	0	0	0	0	110.9	F502 Y503	F502-G534 CarbonylContact C-O 3.54Å; F502-G534 VanDerWaalsContact CA-O 3.27Å; F502-G534 WeakPolarHBondContact CA-O 3.33Å; F502-G534 WeakPolarHBondContact CB-O 3.49Å; Y503-G534 WeakPolarHBondContact CD1-O 3.36Å; Y503-G534 PolarHBondContact N-O 2.94Å; Y503-G534 PolarHBondContact O-N 3.33Å
535	S	93.1	Very high	91.5	Very high	24 Å²	24	59.7 Å²	59.7	17%	0.168	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	143	171.3	173.7	0	0	0	0	108.5	S501 V537	S501-S535 PolarHBondContact O-OG 3.41Å; S535-V537 WeakPolarHBondContact CB-O 3.47Å; S535-V537 PolarHBondContact OG-N 2.79Å; S535-V537 VanDerWaalsContact OG-N 3.1Å; S535-V537 PolarHBondContact OG-O 2.76Å
536	D	89.3	Confident	91.1	Very high	130 Å²	130	65.1 Å²	65.1	70%	0.695	34%	0.335	S	S	*	.	S	Bend	trans	-84.2	-21.2	172	-57.1	-45.3	0	0	0	111.1
537	V	88.8	Confident	90.7	Very high	83 Å²	83	67.1 Å²	67.1	50%	0.503	35%	0.346	S	S	.	.	S	Bend	trans	-87.2	127.8	170.1	-178.3	0	0	0	0	109.2	I500 S535	I500-V537 HydrophobicContact CD1-CB 4.29Å; I500-V537 HydrophobicContact CD1-CG1 4.46Å; I500-V537 HydrophobicContact CG1-CB 4.26Å; S535-V537 WeakPolarHBondContact CB-O 3.47Å; S535-V537 PolarHBondContact OG-N 2.79Å; S535-V537 VanDerWaalsContact OG-N 3.1Å; S535-V537 PolarHBondContact OG-O 2.76Å
538	K	83.6	Confident	90.3	Very high	199 Å²	199	66.6 Å²	66.6	87%	0.865	34%	0.34	S	S	*	.			trans	-87.2	119.5	173.4	-65.8	-176.3	-179.6	-178.5	0	110.4	Y542	K538-Y542 WeakPolarHBondContact CA-OH 2.94Å
539	A	83.1	Confident	89.8	Confident	40 Å²	40	72.8 Å²	72.8	33%	0.331	36%	0.358	S	S	.	.			trans	-107.3	159	164.5	0	0	0	0	0	110.1	F541 Y542	A539-F541 WeakPolarHBondContact CB-O 3.24Å; A539-Y542 HydrophobicContact CB-CD1 4.01Å; A539-Y542 HydrophobicContact CB-CE1 3.75Å; A539-Y542 PolarHBondContact N-OH 3.17Å; A539-Y542 VanDerWaalsContact N-OH 3.1Å; A539-Y542 PolarHBondContact O-OH 3.22Å
540	E	78.9	Confident	89.3	Confident	172 Å²	172	77 Å²	77	80%	0.804	38%	0.381	S	S	*	.	S	Bend	trans	-74	-38.6	171.6	-62.7	-171.4	154.9	0	0	111.4
541	F	83.7	Confident	88.9	Confident	104 Å²	104	76.5 Å²	76.5	46%	0.456	38%	0.384	S	S	.	.			trans	-131.3	133.6	175	-55.7	-83.8	0	0	0	108.8	A539 L548	A539-F541 WeakPolarHBondContact CB-O 3.24Å; F541-L548 HydrophobicContact CD1-CD1 4.22Å
542	Y	90	Very high	88.6	Confident	22 Å²	22	78.1 Å²	78.1	9%	0.086	39%	0.394	C	S	.	.			trans	-100.5	-35	176.3	-61.9	-83.5	0	0	0	112.3	F468 P469 L495 E496 I500 F533 K538 A539	F468-Y542 HydrophobicContact CD1-CD2 4.43Å; F468-Y542 HydrophobicContact CD1-CG 4.16Å; P469-Y542 HydrophobicContact CB-CE2 4.48Å; P469-Y542 HydrophobicContact CG-CE2 4.3Å; L495-Y542 CarbonylContact C-O 3.55Å; L495-Y542 WeakPolarHBondContact CA-O 3.26Å; L495-Y542 VanDerWaalsContact CD2-O 3.29Å; L495-Y542 WeakPolarHBondContact CD2-O 3.4Å; E496-Y542 PolarHBondContact N-O 3.43Å; I500-Y542 HydrophobicContact CD1-CD1 4.17Å; I500-Y542 HydrophobicContact CD1-CE1 4.16Å; F533-Y542 HydrophobicContact CD1-CD1 4.47Å; F533-Y542 AromaticContact CE1-CD1 3.46Å; F533-Y542 HydrophobicContact CE1-CD1 3.46Å; F533-Y542 VanDerWaalsContact CE1-CD1 3.46Å; F533-Y542 AromaticContact CE1-CE1 3.85Å; F533-Y542 HydrophobicContact CE1-CE1 3.85Å; F533-Y542 AromaticContact CE1-CG 3.9Å; F533-Y542 HydrophobicContact CE1-CG 3.9Å; F533-Y542 AromaticContact CZ-CD1 3.91Å; F533-Y542 HydrophobicContact CZ-CD1 3.91Å; F533-Y542 HydrophobicContact CZ-CG 4.47Å; K538-Y542 WeakPolarHBondContact CA-OH 2.94Å; A539-Y542 HydrophobicContact CB-CD1 4.01Å; A539-Y542 HydrophobicContact CB-CE1 3.75Å; A539-Y542 PolarHBondContact N-OH 3.17Å; A539-Y542 VanDerWaalsContact N-OH 3.1Å; A539-Y542 PolarHBondContact O-OH 3.22Å
543	I	92.3	Very high	88.4	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.005	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-83.7	145.6	177.2	-58.3	178.8	0	0	0	109.6	I395 F468 H472 R545 L547 L548	I395-I543 HydrophobicContact CD1-CG2 3.71Å; I395-I543 HydrophobicContact CG1-CD1 4.47Å; I395-I543 HydrophobicContact CG2-CD1 4.12Å; F468-I543 HydrophobicContact CD1-CG1 4.43Å; F468-I543 HydrophobicContact CD2-CD1 3.73Å; F468-I543 HydrophobicContact CD2-CG1 3.99Å; F468-I543 HydrophobicContact CE1-CG1 4.05Å; F468-I543 HydrophobicContact CE2-CD1 3.55Å; F468-I543 HydrophobicContact CE2-CG1 3.57Å; F468-I543 HydrophobicContact CG-CD1 4.42Å; F468-I543 HydrophobicContact CG-CG1 4.37Å; F468-I543 HydrophobicContact CZ-CD1 4.11Å; F468-I543 HydrophobicContact CZ-CG1 3.57Å; H472-I543 HydrophobicContact CB-CD1 3.5Å; I543-R545 PolarHBondContact O-N 3.48Å; I543-L547 HydrophobicContact CG2-CB 4.3Å; I543-L548 HydrophobicContact CB-CD2 4.09Å; I543-L548 HydrophobicContact CD1-CD2 4.38Å; I543-L548 HydrophobicContact CG2-CD2 3.98Å; I543-L548 HydrophobicContact CG2-CG 4.33Å
544	K	92.1	Very high	88.1	Confident	69 Å²	69	77 Å²	77	30%	0.3	40%	0.396	S	S	.	.			trans	-53.4	129.8	172.7	-71.5	177.9	175	175.1	0	112.6	S493 H494 L495 E496 D546 L547 L548	S493-K544 WeakPolarHBondContact O-CE 3.41Å; S493-K544 PolarHBondContact O-NZ 3.01Å; H494-K544 PolarHBondContact O-N 3.26Å; L495-K544 WeakPolarHBondContact O-CE 3.27Å; L495-K544 VanDerWaalsContact O-CG 3.27Å; L495-K544 WeakPolarHBondContact O-CG 3.1Å; E496-K544 VanDerWaalsContact OE2-CA 3.28Å; E496-K544 WeakPolarHBondContact OE2-CA 3.47Å; K544-D546 VanDerWaalsContact C-N 3.34Å; K544-D546 PolarHBondContact O-N 2.93Å; K544-L547 HydrophobicContact CB-CB 4.5Å; K544-L547 HydrophobicContact CB-CD1 4Å; K544-L547 HydrophobicContact CB-CG 3.98Å; K544-L547 HydrophobicContact CD-CD1 4.36Å; K544-L547 WeakPolarHBondContact O-CB 3.47Å; K544-L547 PolarHBondContact O-N 3.31Å; K544-L548 PolarHBondContact O-N 3.17Å
545	R	88.6	Confident	87.8	Confident	141 Å²	141	80.3 Å²	80.3	53%	0.532	41%	0.412	S	S	.	.	H	α-helix	trans	-57.4	-41.7	-179.5	-74.9	174	-73.5	138.9	-2.4	113.7	E496 I543 L547 L548 E549	E496-R545 IonicContact OE1-CZ 2.64Å; E496-R545 IonicContact OE1-NE 2.66Å; E496-R545 PolarHBondContact OE1-NE 2.77Å; E496-R545 IonicContact OE1-NH2 3.18Å; E496-R545 PolarHBondContact OE1-NH2 2.94Å; E496-R545 PolarHBondContact OE2-N 3.37Å; E496-R545 IonicContact OE2-NE 3.53Å; I543-R545 PolarHBondContact O-N 3.48Å; R545-L547 PolarHBondContact O-N 3Å; R545-L548 WeakPolarHBondContact O-CB 3.29Å; R545-L548 PolarHBondContact O-N 3.27Å; R545-E549 PolarHBondContact O-N 3.11Å
546	D	87.6	Confident	87.7	Confident	117 Å²	117	83.9 Å²	83.9	63%	0.626	43%	0.426	S	S	*	.	H	α-helix	trans	-52.7	-32.2	176	-44.1	-7.2	0	0	0	113	K544 T550	K544-D546 VanDerWaalsContact C-N 3.34Å; K544-D546 PolarHBondContact O-N 2.93Å; D546-T550 PolarHBondContact O-OG1 2.95Å
547	L	85.6	Confident	87.8	Confident	55 Å²	55	77.7 Å²	77.7	29%	0.288	39%	0.393	S	S	.	.	H	α-helix	trans	-86.2	-22.4	-179.8	-55.4	-179.9	0	0	0	112.9	I395 H494 I543 K544 R545 T550	I395-L547 HydrophobicContact CD1-CB 3.53Å; I395-L547 HydrophobicContact CD1-CD1 4.02Å; I395-L547 HydrophobicContact CD1-CG 4.4Å; H494-L547 HydrophobicContact CB-CD1 4.13Å; I543-L547 HydrophobicContact CG2-CB 4.3Å; K544-L547 HydrophobicContact CB-CB 4.5Å; K544-L547 HydrophobicContact CB-CD1 4Å; K544-L547 HydrophobicContact CB-CG 3.98Å; K544-L547 HydrophobicContact CD-CD1 4.36Å; K544-L547 WeakPolarHBondContact O-CB 3.47Å; K544-L547 PolarHBondContact O-N 3.31Å; R545-L547 PolarHBondContact O-N 3Å; L547-T550 PolarHBondContact O-N 3.45Å
548	L	85.8	Confident	88	Confident	30 Å²	30	77.2 Å²	77.2	16%	0.157	39%	0.388	C	S	.	.	H	α-helix	trans	-72.2	-34.1	172.2	-60.5	177.8	0	0	0	111.1	I395 F541 I543 K544 R545 T550 S551	I395-L548 HydrophobicContact CG2-CD2 4.08Å; F541-L548 HydrophobicContact CD1-CD1 4.22Å; I543-L548 HydrophobicContact CB-CD2 4.09Å; I543-L548 HydrophobicContact CD1-CD2 4.38Å; I543-L548 HydrophobicContact CG2-CD2 3.98Å; I543-L548 HydrophobicContact CG2-CG 4.33Å; K544-L548 PolarHBondContact O-N 3.17Å; R545-L548 WeakPolarHBondContact O-CB 3.29Å; R545-L548 PolarHBondContact O-N 3.27Å; L548-T550 PolarHBondContact O-N 3.35Å; L548-S551 VanDerWaalsContact O-CB 3.22Å; L548-S551 WeakPolarHBondContact O-CB 3.34Å; L548-S551 PolarHBondContact O-N 3.22Å; L548-S551 PolarHBondContact O-OG 2.88Å
549	E	83.9	Confident	88.3	Confident	175 Å²	175	73.7 Å²	73.7	82%	0.818	37%	0.374	S	S	*	.	H	α-helix	trans	-64.1	-27.8	172.6	-64.1	-173.1	-179	0	0	112.6	R545 S551	R545-E549 PolarHBondContact O-N 3.11Å; E549-S551 VanDerWaalsContact C-N 3.35Å
550	T	85.9	Confident	88.6	Confident	109 Å²	109	72.9 Å²	72.9	67%	0.669	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	21.4	176.8	-42.5	0	0	0	0	112.2	D546 L547 L548	D546-T550 PolarHBondContact O-OG1 2.95Å; L547-T550 PolarHBondContact O-N 3.45Å; L548-T550 PolarHBondContact O-N 3.35Å
551	S	88.9	Confident	89.1	Confident	63 Å²	63	66.6 Å²	66.6	44%	0.441	34%	0.338	S	S	.	.			trans	-71.2	144.4	-177.5	57.6	0	0	0	0	113.3	I395 L548 E549	I395-S551 CarbonylContact O-C 3.55Å; I395-S551 VanDerWaalsContact O-CA 3.26Å; I395-S551 WeakPolarHBondContact O-CA 3.42Å; I395-S551 WeakPolarHBondContact O-CB 3.49Å; L548-S551 VanDerWaalsContact O-CB 3.22Å; L548-S551 WeakPolarHBondContact O-CB 3.34Å; L548-S551 PolarHBondContact O-N 3.22Å; L548-S551 PolarHBondContact O-OG 2.88Å; E549-S551 VanDerWaalsContact C-N 3.35Å
552	V	91.9	Very high	89.1	Confident	36 Å²	36	63.9 Å²	63.9	22%	0.218	33%	0.334	C	S	.	.			trans	-107.1	169.4	-178.6	-61	0	0	0	0	111.4	L394 I395 Y396 Q556 A557	L394-V552 HydrophobicContact CB-CG2 4.16Å; L394-V552 HydrophobicContact CD2-CG1 4.28Å; L394-V552 HydrophobicContact CD2-CG2 4.38Å; I395-V552 PolarHBondContact O-N 3.16Å; Y396-V552 WeakPolarHBondContact CA-O 2.82Å; Y396-V552 WeakPolarHBondContact CB-O 3.33Å; V552-Q556 HydrophobicContact CB-CB 4.31Å; V552-A557 HydrophobicContact CG2-CB 4.44Å
553	S	91.7	Very high	88.4	Confident	33 Å²	33	66 Å²	66	23%	0.231	35%	0.352	C	S	.	.			trans	-74	152.4	168.5	70.4	0	0	0	0	111.7	L555 Q556 A557	S553-L555 PolarHBondContact O-N 3.43Å; S553-L555 VanDerWaalsContact O-N 3.1Å; S553-Q556 PolarHBondContact O-N 3.26Å; S553-Q556 WeakPolarHBondContact OG-CG 3.37Å; S553-Q556 PolarHBondContact OG-N 2.76Å; S553-Q556 PolarHBondContact OG-OE1 3.49Å; S553-A557 PolarHBondContact O-N 2.7Å; S553-A557 VanDerWaalsContact O-N 3.09Å
554	A	90.7	Very high	87.3	Confident	9 Å²	9	67.5 Å²	67.5	7%	0.074	36%	0.363	C	S	.	.	H	α-helix	trans	-58	-22.4	172.4	0	0	0	0	0	113.7	Y396 V401 N558	Y396-A554 HydrophobicContact CD2-CB 3.61Å; Y396-A554 HydrophobicContact CE2-CB 3.74Å; Y396-A554 HydrophobicContact CG-CB 4.28Å; V401-A554 HydrophobicContact CG2-CB 3.63Å; A554-N558 PolarHBondContact O-N 3.4Å; A554-N558 VanDerWaalsContact O-N 3.14Å; A554-N558 PolarHBondContact O-ND2 3.08Å
555	L	89.3	Confident	86.2	Confident	74 Å²	74	69.2 Å²	69.2	39%	0.387	38%	0.375	S	S	.	.	H	α-helix	trans	-72.8	-48.6	176	-66.5	172.9	0	0	0	111.3	S553 A557 N558 E559	S553-L555 PolarHBondContact O-N 3.43Å; S553-L555 VanDerWaalsContact O-N 3.1Å; L555-A557 PolarHBondContact O-N 3.44Å; L555-N558 CarbonylContact O-C 3.32Å; L555-N558 WeakPolarHBondContact O-CA 3.47Å; L555-N558 WeakPolarHBondContact O-CB 3.47Å; L555-N558 PolarHBondContact O-N 3.07Å; L555-E559 WeakPolarHBondContact O-CG 3.36Å; L555-E559 PolarHBondContact O-N 3.24Å
556	Q	90.4	Very high	84.8	Confident	99 Å²	99	69.2 Å²	69.2	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-60.9	-36.1	173.9	-68.3	157.8	-59	0	0	111.5	V552 S553 N558 E559 S560	V552-Q556 HydrophobicContact CB-CB 4.31Å; S553-Q556 PolarHBondContact O-N 3.26Å; S553-Q556 WeakPolarHBondContact OG-CG 3.37Å; S553-Q556 PolarHBondContact OG-N 2.76Å; S553-Q556 PolarHBondContact OG-OE1 3.49Å; Q556-N558 VanDerWaalsContact C-N 3.28Å; Q556-N558 PolarHBondContact O-N 3.24Å; Q556-E559 PolarHBondContact O-N 3.48Å; Q556-S560 PolarHBondContact O-N 3.37Å; Q556-S560 VanDerWaalsContact O-N 3.12Å; Q556-S560 PolarHBondContact O-OG 3.35Å
557	A	91.7	Very high	83.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-65.5	-26	171.8	0	0	0	0	0	113.4	Y396 R465 Q475 V552 S553 L555 S560	Y396-A557 HydrophobicContact CD1-CB 3.48Å; Y396-A557 VanDerWaalsContact CD1-CB 3.48Å; Y396-A557 HydrophobicContact CE1-CB 3.65Å; Y396-A557 HydrophobicContact CG-CB 4.3Å; R465-A557 VanDerWaalsContact NH2-C 3.3Å; R465-A557 PolarHBondContact NH2-O 3.41Å; Q475-A557 PolarHBondContact NE2-O 3.1Å; Q475-A557 PolarHBondContact OE1-O 2.8Å; Q475-A557 VanDerWaalsContact OE1-O 3.05Å; V552-A557 HydrophobicContact CG2-CB 4.44Å; S553-A557 PolarHBondContact O-N 2.7Å; S553-A557 VanDerWaalsContact O-N 3.09Å; L555-A557 PolarHBondContact O-N 3.44Å; A557-S560 PolarHBondContact O-OG 3.24Å
558	N	91.8	Very high	80.8	Confident	73 Å²	73	74.1 Å²	74.1	39%	0.39	41%	0.405	S	S	.	.	H	α-helix	trans	-81.3	-39	170.6	-66.3	-27	0	0	0	112	R465 A554 L555 Q556 S560 I561 A562	R465-N558 VanDerWaalsContact CZ-OD1 3.3Å; R465-N558 PolarHBondContact NH1-OD1 3.38Å; R465-N558 PolarHBondContact NH2-OD1 3.47Å; A554-N558 PolarHBondContact O-N 3.4Å; A554-N558 VanDerWaalsContact O-N 3.14Å; A554-N558 PolarHBondContact O-ND2 3.08Å; L555-N558 CarbonylContact O-C 3.32Å; L555-N558 WeakPolarHBondContact O-CA 3.47Å; L555-N558 WeakPolarHBondContact O-CB 3.47Å; L555-N558 PolarHBondContact O-N 3.07Å; Q556-N558 VanDerWaalsContact C-N 3.28Å; Q556-N558 PolarHBondContact O-N 3.24Å; N558-S560 VanDerWaalsContact C-N 3.33Å; N558-S560 PolarHBondContact O-N 3.45Å; N558-I561 WeakPolarHBondContact O-CB 2.83Å; N558-I561 PolarHBondContact O-N 2.6Å; N558-A562 PolarHBondContact O-N 2.66Å
559	E	90.9	Very high	78.7	Confident	126 Å²	126	78.7 Å²	78.7	59%	0.589	44%	0.436	S	S	*	.	H	α-helix	trans	-62.2	-38.2	-179.2	-72.1	163.8	176.3	0	0	112.2	L555 Q556 I561 A562 S563	L555-E559 WeakPolarHBondContact O-CG 3.36Å; L555-E559 PolarHBondContact O-N 3.24Å; Q556-E559 PolarHBondContact O-N 3.48Å; E559-I561 PolarHBondContact O-N 3.22Å; E559-A562 WeakPolarHBondContact O-CB 3.38Å; E559-A562 PolarHBondContact O-N 3.19Å; E559-A562 VanDerWaalsContact O-N 3.11Å; E559-S563 PolarHBondContact O-N 3.33Å
560	S	89.4	Confident	76.1	Confident	22 Å²	22	77 Å²	77	15%	0.154	43%	0.428	C	S	.	.	H	α-helix	trans	-62.2	-22	171.7	50.8	0	0	0	0	114.5	L394 Q475 F477 Q556 A557 N558 S563 C564	L394-S560 WeakPolarHBondContact CD1-OG 3.47Å; Q475-S560 PolarHBondContact NE2-OG 3.18Å; Q475-S560 VanDerWaalsContact NE2-OG 3.14Å; F477-S560 WeakPolarHBondContact CZ-O 3.14Å; Q556-S560 PolarHBondContact O-N 3.37Å; Q556-S560 VanDerWaalsContact O-N 3.12Å; Q556-S560 PolarHBondContact O-OG 3.35Å; A557-S560 PolarHBondContact O-OG 3.24Å; N558-S560 VanDerWaalsContact C-N 3.33Å; N558-S560 PolarHBondContact O-N 3.45Å; S560-S563 PolarHBondContact O-OG 3.45Å; S560-C564 PolarHBondContact O-SG 3.26Å
561	I	89.2	Confident	73.6	Confident	40 Å²	40	78.1 Å²	78.1	21%	0.205	44%	0.435	C	S	.	.	H	α-helix	trans	-79.1	-40.4	172.4	-55.6	178.6	0	0	0	110.1	V463 N558 E559 S563 C564 L565	V463-I561 HydrophobicContact CB-CD1 4.41Å; V463-I561 HydrophobicContact CG1-CD1 3.84Å; V463-I561 HydrophobicContact CG1-CG1 3.98Å; V463-I561 HydrophobicContact CG2-CD1 4.49Å; V463-I561 HydrophobicContact CG2-CG1 4.18Å; V463-I561 HydrophobicContact CG2-CG2 4.09Å; N558-I561 WeakPolarHBondContact O-CB 2.83Å; N558-I561 PolarHBondContact O-N 2.6Å; E559-I561 PolarHBondContact O-N 3.22Å; I561-S563 VanDerWaalsContact C-N 3.35Å; I561-S563 PolarHBondContact O-N 3.31Å; I561-C564 PolarHBondContact O-N 3.15Å; I561-L565 HydrophobicContact CG2-CD1 4.3Å; I561-L565 PolarHBondContact O-N 2.92Å
562	A	83.9	Confident	70.8	Confident	47 Å²	47	80.9 Å²	80.9	39%	0.388	45%	0.449	S	S	.	.	H	α-helix	trans	-62.8	-39.4	-178.4	0	0	0	0	0	112.3	N558 E559 C564 L565 L566	N558-A562 PolarHBondContact O-N 2.66Å; E559-A562 WeakPolarHBondContact O-CB 3.38Å; E559-A562 PolarHBondContact O-N 3.19Å; E559-A562 VanDerWaalsContact O-N 3.11Å; A562-C564 VanDerWaalsContact C-N 3.3Å; A562-C564 PolarHBondContact O-N 3.17Å; A562-L565 PolarHBondContact O-N 3.39Å; A562-L566 WeakPolarHBondContact O-CG 3.39Å; A562-L566 PolarHBondContact O-N 3.33Å
563	S	74.9	Confident	68.1	Low	66 Å²	66	85.5 Å²	85.5	46%	0.462	48%	0.48	S	S	.	.	H	α-helix	trans	-59.9	-38.8	174.4	60.9	0	0	0	0	112.5	E559 S560 I561 L565 L566 R567	E559-S563 PolarHBondContact O-N 3.33Å; S560-S563 PolarHBondContact O-OG 3.45Å; I561-S563 VanDerWaalsContact C-N 3.35Å; I561-S563 PolarHBondContact O-N 3.31Å; S563-L565 VanDerWaalsContact C-N 3.33Å; S563-L565 PolarHBondContact O-N 3.31Å; S563-L566 PolarHBondContact O-N 2.89Å; S563-R567 PolarHBondContact O-N 3.35Å
564	C	70.3	Confident	65.3	Low	34 Å²	34	86.9 Å²	86.9	23%	0.23	50%	0.5	C	S	.	.	H	α-helix	trans	-70.2	-25.4	177.4	-66.9	0	0	0	0	113.6	K461 F477 S560 I561 A562	K461-C564 HydrophobicContact CD-CB 4.28Å; F477-C564 HydrophobicContact CE1-CB 4.18Å; F477-C564 WeakPolarHBondContact CE1-SG 3.38Å; S560-C564 PolarHBondContact O-SG 3.26Å; I561-C564 PolarHBondContact O-N 3.15Å; A562-C564 VanDerWaalsContact C-N 3.3Å; A562-C564 PolarHBondContact O-N 3.17Å
565	L	68.4	Low	62.6	Low	105 Å²	105	92.8 Å²	92.8	55%	0.55	54%	0.541	S	S	.	.	H	α-helix	trans	-84.6	-17.6	175.5	-66.9	174.1	0	0	0	113.4	Y459 I561 A562 S563	Y459-L565 HydrophobicContact CD1-CD2 3.89Å; Y459-L565 HydrophobicContact CE1-CD2 3.91Å; I561-L565 HydrophobicContact CG2-CD1 4.3Å; I561-L565 PolarHBondContact O-N 2.92Å; A562-L565 PolarHBondContact O-N 3.39Å; S563-L565 VanDerWaalsContact C-N 3.33Å; S563-L565 PolarHBondContact O-N 3.31Å
566	L	59.6	Low	59.9	Low	141 Å²	141	97.9 Å²	97.9	74%	0.738	56%	0.563	S	S	*	*	H	α-helix	trans	-96.6	-16.7	179.2	-68.8	171.5	0	0	0	113.4	A562 S563 S568	A562-L566 WeakPolarHBondContact O-CG 3.39Å; A562-L566 PolarHBondContact O-N 3.33Å; S563-L566 PolarHBondContact O-N 2.89Å; L566-S568 VanDerWaalsContact C-N 3.25Å; L566-S568 PolarHBondContact O-N 3.18Å
567	R	51	Low	57.3	Low	181 Å²	181	99.4 Å²	99.4	68%	0.683	58%	0.581	S	S	*	*			trans	-77.8	72.3	179.6	-157.7	176.7	-164.6	170.1	3.4	112.1	S563 E570	S563-R567 PolarHBondContact O-N 3.35Å; R567-E570 IonicContact CZ-OE2 3.18Å; R567-E570 IonicContact NE-OE2 2.83Å; R567-E570 PolarHBondContact NE-OE2 3.32Å; R567-E570 IonicContact NH2-OE2 3.71Å; R567-E570 PolarHBondContact NH2-OE2 3.49Å
568	S	37.3	Very low	54.4	Low	94 Å²	94	106 Å²	106	66%	0.657	62%	0.621	S	S	*	*			trans	-48.8	150.2	151.1	-62.2	0	0	0	0	109.8	L566 E570	L566-S568 VanDerWaalsContact C-N 3.25Å; L566-S568 PolarHBondContact O-N 3.18Å; S568-E570 PolarHBondContact O-N 2.95Å
569	P	42.6	Very low	51.7	Low	126 Å²	126	111.8 Å²	111.8	82%	0.818	65%	0.645	S	S	*	*			trans	-58.5	122.8	-175.6	23.1	-33.9	0	0	0	111.3	T571	P569-T571 PolarHBondContact O-N 3.24Å
570	E	28.6	Very low	48.8	Very low	139 Å²	139	114.4 Å²	114.4	65%	0.65	66%	0.658	S	S	*	*			trans	-71.9	109.4	178.5	-76.1	170.3	114.7	0	0	110.1	R567 S568 T572	R567-E570 IonicContact CZ-OE2 3.18Å; R567-E570 IonicContact NE-OE2 2.83Å; R567-E570 PolarHBondContact NE-OE2 3.32Å; R567-E570 IonicContact NH2-OE2 3.71Å; R567-E570 PolarHBondContact NH2-OE2 3.49Å; S568-E570 PolarHBondContact O-N 2.95Å; E570-T572 PolarHBondContact O-N 3.03Å
571	T	32.3	Very low	46.3	Very low	133 Å²	133	118.4 Å²	118.4	82%	0.816	68%	0.683	S	S	*	*			trans	-58.8	131.4	168.7	-50.4	0	0	0	0	109.8	P569	P569-T571 PolarHBondContact O-N 3.24Å
572	T	30	Very low	43.8	Very low	120 Å²	120	122.1 Å²	122.1	74%	0.736	71%	0.71	S	S	*	*			trans	-42.7	134.5	176.2	-46.7	0	0	0	0	112.2	E570 G574	E570-T572 PolarHBondContact O-N 3.03Å; T572-G574 PolarHBondContact O-N 3.11Å
573	P	36.5	Very low	41.6	Very low	133 Å²	133	125.6 Å²	125.6	86%	0.864	73%	0.729	S	S	*	*	S	Bend	trans	-64.1	109.5	-172.2	24.3	-35	0	0	0	112.6
574	G	32.8	Very low	39.6	Very low	62 Å²	62	128.4 Å²	128.4	64%	0.639	75%	0.745	S	S	*	*			trans	174.1	126	172.7	0	0	0	0	0	113.8	T572	T572-G574 PolarHBondContact O-N 3.11Å
575	S	34.8	Very low	37.9	Very low	134 Å²	134	131.5 Å²	131.5	94%	0.937	77%	0.774	S	S	*	*	S	Bend	trans	95.9	143.2	-178.2	-40.9	0	0	0	0	115.3
576	E	32.4	Very low	36.1	Very low	181 Å²	181	135.9 Å²	135.9	85%	0.846	79%	0.791	S	S	*	*			trans	-83.2	160.1	-170.8	-71	-167.2	141.2	0	0	113.4
577	P	34.5	Very low	34.8	Very low	130 Å²	130	133.9 Å²	133.9	84%	0.844	80%	0.795	S	S	*	*			trans	-68.3	136.9	-175.8	27.4	-36	0	0	0	113
578	V	32	Very low	34	Very low	139 Å²	139	134.1 Å²	134.1	84%	0.842	81%	0.806	S	S	*	*			trans	-110.3	129.3	162.6	177.2	0	0	0	0	107.9
579	E	34.9	Very low	33.6	Very low	194 Å²	194	137.7 Å²	137.7	91%	0.907	82%	0.818	S	S	*	*			trans	-76	124	179.9	-170.9	179.9	156.6	0	0	110.5
580	E	29.4	Very low	33	Very low	181 Å²	181	135.9 Å²	135.9	85%	0.846	81%	0.813	S	S	*	*			trans	-110.6	131.1	177.9	-164.5	170.9	-169.6	0	0	110.5
581	P	37.3	Very low	33	Very low	107 Å²	107	137 Å²	137	70%	0.695	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-78.2	161.3	-169	31	-36.8	0	0	0	114.2
582	P	37.1	Very low	33.2	Very low	117 Å²	117	136 Å²	136	76%	0.76	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-65.5	153.3	-178.6	27	-35.9	0	0	0	113.7
583	P	35.8	Very low	33	Very low	121 Å²	121	139.6 Å²	139.6	79%	0.786	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-70.2	149.7	-175.7	29.1	-36	0	0	0	113
584	P	33.5	Very low	32.6	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-72.6	141.9	178.5	30.6	-35	0	0	0	112
585	A	34.3	Very low	32.5	Very low	100 Å²	100	139.8 Å²	139.8	83%	0.826	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.8	135.6	171.5	0	0	0	0	0	111.2	A587	A585-A587 PolarHBondContact O-N 2.66Å
586	E	31.1	Very low	32.3	Very low	196 Å²	196	143.5 Å²	143.5	92%	0.916	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.6	172.3	-65.2	-165.9	137.1	0	0	110.3
587	A	32.3	Very low	32.1	Very low	100 Å²	100	142.8 Å²	142.8	83%	0.826	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.4	137.6	-179.5	0	0	0	0	0	111.5	A585	A585-A587 PolarHBondContact O-N 2.66Å
588	M	34	Very low	31.8	Very low	186 Å²	186	145.5 Å²	145.5	92%	0.916	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.5	138.3	171.7	-66.5	-180	65.7	0	0	110.9
589	D	29.5	Very low	32.2	Very low	169 Å²	169	143.5 Å²	143.5	90%	0.904	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72.2	129.3	-177.4	-147.5	-40.9	0	0	0	111.8
590	A	29.6	Very low	31.8	Very low	87 Å²	87	143.5 Å²	143.5	72%	0.719	81%	0.806	S	S	*	*			trans	-156.2	117.4	179.7	0	0	0	0	0	112.1
591	D	28.3	Very low	31.7	Very low	164 Å²	164	138.4 Å²	138.4	88%	0.877	80%	0.795	S	S	*	*			trans	-66.6	145	178.1	-116.6	-44.4	0	0	0	112.1
592	P	36.6	Very low	31.3	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	80%	0.799	S	S	*	*			trans	-96.7	164.7	-161.2	37.7	-36.1	0	0	0	114.6
593	K	26.7	Very low	30.9	Very low	197 Å²	197	138 Å²	138	86%	0.857	79%	0.794	S	S	*	*			trans	-148.9	126.2	159.2	-131	169.3	-171.8	172.5	0	115.6
594	S	28.8	Very low	30.7	Very low	107 Å²	107	141 Å²	141	75%	0.748	80%	0.797	S	S	*	*			trans	57.6	120.8	154.3	57.1	0	0	0	0	121.6
595	A	30.9	Very low	30.5	Very low	91 Å²	91	138.2 Å²	138.2	75%	0.752	79%	0.785	S	S	*	*			trans	61.9	116.7	141	0	0	0	0	0	119
596	R	28.9	Very low	30.3	Very low	212 Å²	212	142.7 Å²	142.7	80%	0.8	79%	0.788	S	S	*	*				75.7	94.3	57.3	-176.6	-122.5	177.1	136.1	2.7	112.8
597	E	28.3	Very low	30.1	Very low	167 Å²	167	137.3 Å²	137.3	78%	0.78	79%	0.785	S	S	*	*				-158.6	166.7	111.3	-110.9	154.5	-155.1	0	0	112.5
598	E	28.9	Very low	30	Very low	186 Å²	186	137.7 Å²	137.7	87%	0.869	79%	0.788	S	S	*	*			trans	-109.3	170.7	-164.4	-99.2	-98.1	109.1	0	0	111.9
599	P	41	Very low	29.7	Very low	97 Å²	97	138.3 Å²	138.3	63%	0.63	79%	0.786	S	S	*	*			trans	-102.5	-176.5	-160.5	42	-38.8	0	0	0	113.5
600	E	25.8	Very low	30.3	Very low	194 Å²	194	136 Å²	136	91%	0.907	78%	0.78	S	S	*	*			trans	-160.9	154.4	150.8	-90.7	-158.4	171.8	0	0	108.7
601	A	28.2	Very low	30.3	Very low	74 Å²	74	136.4 Å²	136.4	61%	0.612	78%	0.784	S	S	*	*			cis	-168	177.4	-13.9	0	0	0	0	0	111.2
602	S	29	Very low	30.4	Very low	110 Å²	110	140 Å²	140	77%	0.769	79%	0.785	S	S	*	*			trans	81.5	145.7	149.6	84.4	0	0	0	0	118.5
603	T	28.4	Very low	30	Very low	107 Å²	107	139.7 Å²	139.7	66%	0.656	79%	0.791	S	S	*	*			cis	-153.7	147	4.1	-19.3	0	0	0	0	114
604	Q	31.2	Very low	30.3	Very low	182 Å²	182	138 Å²	138	85%	0.85	79%	0.787	S	S	*	*			trans	59.8	156.3	148	-81.3	157.5	3.2	0	0	121.6
605	A	28.8	Very low	31	Very low	67 Å²	67	138.2 Å²	138.2	55%	0.554	79%	0.785	S	S	*	*			cis	-173.1	170.1	-30.5	0	0	0	0	0	111.5
606	H	30.9	Very low	31.2	Very low	194 Å²	194	137.1 Å²	137.1	90%	0.898	78%	0.783	S	S	*	*			trans	72.8	130.1	170.1	-48.5	-83.7	0	0	0	117.5
607	G	25.8	Very low	31.8	Very low	83 Å²	83	136.8 Å²	136.8	86%	0.856	79%	0.787	S	S	*	*			cis	144.2	99.8	-21.8	0	0	0	0	0	116.3
608	A	30	Very low	33	Very low	107 Å²	107	134.3 Å²	134.3	88%	0.884	78%	0.783	S	S	*	*			trans	-158.7	150.7	160.7	0	0	0	0	0	113.2
609	K	29	Very low	33.8	Very low	199 Å²	199	129.3 Å²	129.3	87%	0.865	77%	0.766	S	S	*	*			trans	-152	173.9	171.4	-113.4	-170.9	176.4	174	0	106.5
610	P	41.8	Very low	34.6	Very low	120 Å²	120	134.5 Å²	134.5	78%	0.779	78%	0.779	S	S	*	*			cis	-138.7	172.6	17.7	42.8	-25.6	0	0	0	117.1
611	A	29.7	Very low	36	Very low	97 Å²	97	135.4 Å²	135.4	80%	0.802	78%	0.775	S	S	*	*			trans	-155.2	162.1	131.1	0	0	0	0	0	108.7
612	R	29.3	Very low	37.2	Very low	240 Å²	240	139.4 Å²	139.4	91%	0.906	78%	0.778	S	S	*	*			trans	-143.9	121.3	-170.3	179.3	-172.9	-177.6	-172.5	2.4	112.1
613	A	28.7	Very low	38.7	Very low	102 Å²	102	143 Å²	143	84%	0.843	78%	0.78	S	S	*	*			trans	-148.5	131.1	163.3	0	0	0	0	0	110.5
614	E	32.3	Very low	39.9	Very low	163 Å²	163	146 Å²	146	76%	0.762	79%	0.791	S	S	*	*			trans	-130.1	166.1	177.9	-81.4	-79.7	-172.8	0	0	106.9
615	P	43.7	Very low	40.8	Very low	111 Å²	111	143.1 Å²	143.1	72%	0.721	79%	0.789	S	S	*	*			cis	-131.9	164.8	-11.3	35.2	-18	0	0	0	115
616	G	35.4	Very low	41.7	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	80%	0.8	S	S	*	*			trans	61.1	124	133.8	0	0	0	0	0	122.5
617	K	42.8	Very low	42.5	Very low	206 Å²	206	144.3 Å²	144.3	90%	0.896	80%	0.8	S	S	*	*			trans	-160.9	112.1	140.6	-107.8	147.7	-169.2	165.9	0	111.7
618	V	52.1	Low	43.2	Very low	115 Å²	115	153.6 Å²	153.6	70%	0.697	82%	0.817	S	S	*	*			trans	-71.2	133.7	172.5	-175.5	0	0	0	0	109.6	F622	V618-F622 HydrophobicContact CG1-CB 3.85Å; V618-F622 HydrophobicContact CG1-CG 4.41Å
619	P	47.1	Very low	43.8	Very low	80 Å²	80	156 Å²	156	52%	0.519	81%	0.814	S	S	.	*			trans	-58.6	148.3	177	-28	37.1	0	0	0	114.1	W621 F622	P619-W621 PolarHBondContact O-N 2.8Å; P619-F622 PolarHBondContact O-N 3.19Å
620	K	57	Low	44.6	Very low	207 Å²	207	153.7 Å²	153.7	90%	0.9	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-11.4	-169.8	-69.8	-178.5	178.3	176.8	0	115.9
621	W	55.7	Low	44.8	Very low	213 Å²	213	155.6 Å²	155.6	81%	0.807	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-16.3	178.6	58.2	-93.1	0	0	0	113.5	P619 K623	P619-W621 PolarHBondContact O-N 2.8Å; W621-K623 PolarHBondContact O-N 3.17Å
622	F	53.1	Low	45.7	Very low	158 Å²	158	159 Å²	159	69%	0.693	81%	0.814	S	S	*	*	S	Bend	trans	-82.2	47.1	178.5	-148.9	-95.4	0	0	0	113.2	V618 P619	V618-F622 HydrophobicContact CG1-CB 3.85Å; V618-F622 HydrophobicContact CG1-CG 4.41Å; P619-F622 PolarHBondContact O-N 3.19Å
623	K	59.7	Low	46.7	Very low	186 Å²	186	153.9 Å²	153.9	81%	0.809	81%	0.808	S	S	*	*			trans	-141.2	96.3	175.7	-74.3	-163	174.9	-167.4	0	111.5	W621	W621-K623 PolarHBondContact O-N 3.17Å
624	L	54.8	Low	47.9	Very low	168 Å²	168	157.4 Å²	157.4	88%	0.88	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.6	147.5	167.9	-66.7	173.5	0	0	0	110.9	G626	L624-G626 PolarHBondContact O-N 3.41Å
625	P	49.8	Very low	49	Very low	123 Å²	123	157 Å²	157	80%	0.799	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71.3	127.6	175.6	29.1	-33.7	0	0	0	110.9
626	G	48.4	Very low	49.4	Very low	77 Å²	77	160.5 Å²	160.5	79%	0.794	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72	138.7	174	0	0	0	0	0	111.9	L624 K628	L624-G626 PolarHBondContact O-N 3.41Å; G626-K628 PolarHBondContact O-N 3.03Å
627	K	46.3	Very low	50.6	Low	208 Å²	208	168.3 Å²	168.3	90%	0.904	83%	0.826	S	S	*	*			trans	-75.2	112.3	171.2	-74.7	-179.5	176.4	177.5	0	111
628	K	40.5	Very low	51.3	Low	279 Å²	279	164.9 Å²	164.9	100%	1.213	82%	0.819	S	S	*	*			trans	-168.6	0	133.3	-107.8	171.7	-176.9	-179.1	0	110.6	G626	G626-K628 PolarHBondContact O-N 3.03Å

Retrieved 628 of 628 residues in 94.8 ms (Link to these results)

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