A0A093I6A5_STRCA Loading...

Pre-mRNA-splicing factor SLU7

Involved in pre-mRNA splicing. Required for pre-mRNA splicing as component of the spliceosome. Participates in the second catalytic step of pre-mRNA splicing, when the free hydroxyl group of exon I attacks the 3'-splice site to generate spliced mRNA and the excised lariat intron. Required for holding exon 1 properly in the spliceosome and for correct AG identification when more than one possible AG exists in 3'-splicing site region. May be involved in the activation of proximal AG. Probably also involved in alternative splicing regulation.

AlphaFold DB , UniProt , Accession A0A093I6A5, Species STRCA (Struthio camelus australis), Gene n/a, Length 580 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.4	Very low	35	Very low	247 Å²	247	134.4 Å²	134.4	100%	1.217	85%	0.848	S	S	*	*				0	127.2	0	-72.8	-170.2	-180	0	0	107.7
2	A	35.2	Very low	34.6	Very low	108 Å²	108	133.1 Å²	133.1	89%	0.893	85%	0.846	S	S	*	*			trans	20.6	117.8	175	0	0	0	0	0	120.5
3	S	35.5	Very low	34.8	Very low	121 Å²	121	129.5 Å²	129.5	85%	0.846	85%	0.85	S	S	*	*			trans	-70.4	150.5	175.8	-49.5	0	0	0	0	114.2
4	G	35.8	Very low	34.3	Very low	76 Å²	76	125.4 Å²	125.4	78%	0.784	84%	0.842	S	S	*	*			trans	-78.1	153.6	167.8	0	0	0	0	0	113
5	T	34.5	Very low	34.1	Very low	137 Å²	137	124.7 Å²	124.7	84%	0.84	84%	0.84	S	S	*	*			trans	-139.4	124.6	164.7	-17.1	0	0	0	0	109.8
6	V	35.5	Very low	34.1	Very low	136 Å²	136	123.8 Å²	123.8	82%	0.824	84%	0.835	S	S	*	*			trans	-84.5	140.7	172.5	-179.4	0	0	0	0	107.8
7	I	33.5	Very low	33.9	Very low	170 Å²	170	123.9 Å²	123.9	87%	0.872	83%	0.826	S	S	*	*			trans	-130	121.4	170.9	-23.2	175	0	0	0	108.8
8	N	30.1	Very low	34.2	Very low	151 Å²	151	124.1 Å²	124.1	81%	0.807	82%	0.823	S	S	*	*			trans	-125.6	128.8	-178.8	-145.1	10.4	0	0	0	109
9	A	29.3	Very low	34.2	Very low	75 Å²	75	121.9 Å²	121.9	62%	0.62	81%	0.81	S	S	*	*			trans	41.6	121.2	150.2	0	0	0	0	0	125
10	T	30.4	Very low	34.7	Very low	137 Å²	137	124.2 Å²	124.2	84%	0.84	81%	0.813	S	S	*	*			trans	67.2	162.9	132.9	61.9	0	0	0	0	122.9
11	P	45.8	Very low	35	Very low	120 Å²	120	125.3 Å²	125.3	78%	0.779	81%	0.807	S	S	*	*			cis	-131.1	159.9	-43.7	35.9	-20.1	0	0	0	112.8
12	S	30.2	Very low	35.2	Very low	119 Å²	119	121.6 Å²	121.6	83%	0.832	79%	0.787	S	S	*	*			trans	-148	106.6	158.8	64.7	0	0	0	0	111.3	G14	S12-G14 PolarHBondContact O-N 2.94Å
13	G	37	Very low	35.8	Very low	87 Å²	87	122 Å²	122	90%	0.897	78%	0.78	S	S	*	*			trans	-61.9	123.8	168.3	0	0	0	0	0	110.5
14	G	28.5	Very low	37	Very low	71 Å²	71	124 Å²	124	73%	0.732	77%	0.774	S	S	*	*			trans	-118.5	104.3	159.3	0	0	0	0	0	106.4	S12 S16	S12-G14 PolarHBondContact O-N 2.94Å; G14-S16 PolarHBondContact O-N 2.89Å
15	S	31.5	Very low	38.3	Very low	116 Å²	116	130 Å²	130	81%	0.811	78%	0.778	S	S	*	*			trans	-51.6	107.3	167.8	48.4	0	0	0	0	109.3	D17	S15-D17 PolarHBondContact O-N 3.29Å
16	S	33.2	Very low	39.7	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	77%	0.765	S	S	*	*			trans	-72.6	84.9	160.8	58.2	0	0	0	0	106.9	G14 V18	G14-S16 PolarHBondContact O-N 2.89Å; S16-V18 PolarHBondContact O-N 3.22Å
17	D	30.5	Very low	42.1	Very low	126 Å²	126	125.6 Å²	125.6	67%	0.674	75%	0.745	S	S	*	*			trans	-43.8	105.7	164.1	-176	52	0	0	0	108.5	S15 S19	S15-D17 PolarHBondContact O-N 3.29Å; D17-S19 PolarHBondContact O-N 2.84Å; D17-S19 PolarHBondContact OD2-OG 3.33Å; D17-S19 VanDerWaalsContact OD2-OG 3.05Å
18	V	39.9	Very low	44.5	Very low	127 Å²	127	126.4 Å²	126.4	77%	0.77	74%	0.737	S	S	*	*			trans	-73	84.3	166.1	-176.9	0	0	0	0	104.2	S16 L20	S16-V18 PolarHBondContact O-N 3.22Å; V18-L20 PolarHBondContact O-N 3.01Å
19	S	33.9	Very low	47.3	Very low	83 Å²	83	125.7 Å²	125.7	58%	0.58	73%	0.729	S	S	*	*			trans	-52.7	113.3	176.4	-57.2	0	0	0	0	107.9	D17 E21	D17-S19 PolarHBondContact O-N 2.84Å; D17-S19 PolarHBondContact OD2-OG 3.33Å; D17-S19 VanDerWaalsContact OD2-OG 3.05Å; S19-E21 PolarHBondContact O-N 3.49Å
20	L	43.7	Very low	50	Low	166 Å²	166	125.4 Å²	125.4	87%	0.869	72%	0.717	S	S	*	*			trans	-63.7	83.7	167	-69.6	164.7	0	0	0	106.7	V18 E22	V18-L20 PolarHBondContact O-N 3.01Å; L20-E22 VanDerWaalsContact C-N 3.35Å; L20-E22 PolarHBondContact O-N 2.95Å
21	E	41.6	Very low	52.7	Low	149 Å²	149	125.7 Å²	125.7	70%	0.696	70%	0.703	S	S	*	*			trans	-62.1	102.2	167.1	-93.2	-161.6	130	0	0	107.3	S19 K24	S19-E21 PolarHBondContact O-N 3.49Å; E21-K24 IonicContact OE1-NZ 2.81Å; E21-K24 PolarHBondContact OE1-NZ 2.92Å
22	E	44.2	Very low	54.8	Low	168 Å²	168	126.6 Å²	126.6	79%	0.785	69%	0.691	S	S	*	*			trans	-49.1	143.7	167.3	-66.6	-175.9	151.4	0	0	109.7	L20 K24	L20-E22 VanDerWaalsContact C-N 3.35Å; L20-E22 PolarHBondContact O-N 2.95Å; E22-K24 PolarHBondContact O-N 3.27Å
23	P	47.6	Very low	57.7	Low	117 Å²	117	127 Å²	127	76%	0.76	68%	0.678	S	S	*	*			trans	-63.7	100.3	-175.9	25.5	-33.2	0	0	0	110	K25	P23-K25 PolarHBondContact O-N 3.3Å
24	K	60.1	Low	60.2	Low	164 Å²	164	127.7 Å²	127.7	71%	0.713	66%	0.656	S	S	*	*			trans	-50.1	118.6	168	-79.7	168.5	178.3	148.9	0	107.4	E21 E22 M26	E21-K24 IonicContact OE1-NZ 2.81Å; E21-K24 PolarHBondContact OE1-NZ 2.92Å; E22-K24 PolarHBondContact O-N 3.27Å; K24-M26 PolarHBondContact O-N 3.38Å
25	K	62.8	Low	63.1	Low	200 Å²	200	126.7 Å²	126.7	87%	0.87	63%	0.632	S	S	*	*			trans	-54	115.7	175.1	-70.6	178.9	-179.7	175.6	0	107.2	P23 T27	P23-K25 PolarHBondContact O-N 3.3Å; K25-T27 PolarHBondContact O-N 2.86Å
26	M	65.1	Low	66	Low	113 Å²	113	126.8 Å²	126.8	56%	0.557	62%	0.619	S	S	*	*			trans	-53.3	132.4	179	-75.4	-141.9	-84	0	0	109.5	K24 D30 K34	K24-M26 PolarHBondContact O-N 3.38Å; M26-D30 HydrophobicContact SD-CB 4.42Å; M26-K34 HydrophobicContact CE-CD 3.91Å
27	T	85	Confident	68.7	Low	68 Å²	68	125.1 Å²	125.1	42%	0.417	60%	0.601	S	S	.	*			trans	-66.2	156.1	176.3	71.6	0	0	0	0	109.3	K25 E29 D30 W31	K25-T27 PolarHBondContact O-N 2.86Å; T27-E29 PolarHBondContact O-N 3.44Å; T27-E29 VanDerWaalsContact O-N 3.15Å; T27-D30 PolarHBondContact O-N 3.38Å; T27-D30 VanDerWaalsContact O-N 3.12Å; T27-D30 PolarHBondContact OG1-N 2.81Å; T27-D30 PolarHBondContact OG1-OD2 3.12Å; T27-W31 PolarHBondContact O-N 3.45Å
28	R	85	Confident	71.5	Confident	187 Å²	187	120.6 Å²	120.6	71%	0.706	58%	0.576	S	S	*	*	H	α-helix	trans	-57	-31.4	178.4	-176.6	176.1	-177.9	163.5	2.2	112	R32	R28-R32 WeakPolarHBondContact O-CG 3.22Å; R28-R32 PolarHBondContact O-N 2.88Å; R28-R32 VanDerWaalsContact O-N 3.14Å
29	E	87.9	Confident	73.9	Confident	136 Å²	136	120.1 Å²	120.1	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-70.9	-44.2	178.1	-64.3	173.8	177.9	0	0	111.2	T27 W31 R32 K33	T27-E29 PolarHBondContact O-N 3.44Å; T27-E29 VanDerWaalsContact O-N 3.15Å; E29-W31 VanDerWaalsContact C-N 3.32Å; E29-W31 PolarHBondContact O-N 2.81Å; E29-R32 PolarHBondContact O-N 3.37Å; E29-K33 WeakPolarHBondContact O-CG 3.46Å; E29-K33 PolarHBondContact O-N 3.09Å
30	D	86.8	Confident	76.8	Confident	69 Å²	69	119.3 Å²	119.3	37%	0.369	55%	0.552	S	S	.	*	H	α-helix	trans	-66.5	-35.1	176.7	-60.1	-38.6	0	0	0	112.2	M26 T27 K33 K34	M26-D30 HydrophobicContact SD-CB 4.42Å; T27-D30 PolarHBondContact O-N 3.38Å; T27-D30 VanDerWaalsContact O-N 3.12Å; T27-D30 PolarHBondContact OG1-N 2.81Å; T27-D30 PolarHBondContact OG1-OD2 3.12Å; D30-K33 PolarHBondContact O-N 3.16Å; D30-K34 WeakPolarHBondContact O-CB 3.48Å; D30-K34 PolarHBondContact O-N 3.16Å
31	W	85.7	Confident	79.1	Confident	144 Å²	144	113.4 Å²	113.4	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-43.2	174.3	-174.2	88.9	0	0	0	112	T27 E29 K34 K35	T27-W31 PolarHBondContact O-N 3.45Å; E29-W31 VanDerWaalsContact C-N 3.32Å; E29-W31 PolarHBondContact O-N 2.81Å; W31-K34 PolarHBondContact O-N 3.43Å; W31-K35 HydrophobicContact CD2-CG 4.35Å; W31-K35 HydrophobicContact CE3-CG 4.39Å; W31-K35 HydrophobicContact CH2-CG 4.03Å; W31-K35 HydrophobicContact CZ2-CG 3.97Å; W31-K35 HydrophobicContact CZ3-CG 4.24Å; W31-K35 PolarHBondContact O-N 2.88Å
32	R	91.2	Very high	81.5	Confident	139 Å²	139	110.3 Å²	110.3	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-61.3	-48.2	173.5	-78.4	179.1	178.8	173	-1.8	111	R28 E29 K34 K35 E36	R28-R32 WeakPolarHBondContact O-CG 3.22Å; R28-R32 PolarHBondContact O-N 2.88Å; R28-R32 VanDerWaalsContact O-N 3.14Å; E29-R32 PolarHBondContact O-N 3.37Å; R32-K34 VanDerWaalsContact C-N 3.31Å; R32-K34 PolarHBondContact O-N 3.39Å; R32-K35 PolarHBondContact O-N 3.3Å; R32-K35 VanDerWaalsContact O-N 3.15Å; R32-E36 WeakPolarHBondContact O-CB 3.46Å; R32-E36 PolarHBondContact O-N 3.05Å
33	K	91.6	Very high	83.9	Confident	128 Å²	128	108.6 Å²	108.6	56%	0.557	50%	0.498	S	S	*	.	H	α-helix	trans	-57.1	-43.1	176.3	-74.8	176.9	-179.2	172.4	0	111.8	E29 D30 L37	E29-K33 WeakPolarHBondContact O-CG 3.46Å; E29-K33 PolarHBondContact O-N 3.09Å; D30-K33 PolarHBondContact O-N 3.16Å; K33-L37 WeakPolarHBondContact O-CB 3.44Å; K33-L37 PolarHBondContact O-N 2.91Å
34	K	87.6	Confident	86	Confident	101 Å²	101	106.2 Å²	106.2	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-39.4	177.9	-171.9	170.1	-176	164.1	0	112.3	M26 D30 W31 R32 E38	M26-K34 HydrophobicContact CE-CD 3.91Å; D30-K34 WeakPolarHBondContact O-CB 3.48Å; D30-K34 PolarHBondContact O-N 3.16Å; W31-K34 PolarHBondContact O-N 3.43Å; R32-K34 VanDerWaalsContact C-N 3.31Å; R32-K34 PolarHBondContact O-N 3.39Å; K34-E38 WeakPolarHBondContact O-CB 3.27Å; K34-E38 PolarHBondContact O-N 2.91Å
35	K	89.8	Confident	87.6	Confident	50 Å²	50	104.6 Å²	104.6	22%	0.217	49%	0.494	C	S	.	.	H	α-helix	trans	-69	-45.5	176.7	-83.7	-72.4	167.5	-155.5	0	112.5	W31 R32 L37 E38 E39	W31-K35 HydrophobicContact CD2-CG 4.35Å; W31-K35 HydrophobicContact CE3-CG 4.39Å; W31-K35 HydrophobicContact CH2-CG 4.03Å; W31-K35 HydrophobicContact CZ2-CG 3.97Å; W31-K35 HydrophobicContact CZ3-CG 4.24Å; W31-K35 PolarHBondContact O-N 2.88Å; R32-K35 PolarHBondContact O-N 3.3Å; R32-K35 VanDerWaalsContact O-N 3.15Å; K35-L37 VanDerWaalsContact C-N 3.3Å; K35-L37 PolarHBondContact O-N 2.96Å; K35-E38 IonicContact NZ-OE1 2.74Å; K35-E38 IonicContact NZ-OE2 3.08Å; K35-E38 PolarHBondContact NZ-OE2 3.03Å; K35-E38 WeakPolarHBondContact O-CB 3.46Å; K35-E38 PolarHBondContact O-N 2.97Å; K35-E39 WeakPolarHBondContact O-CG 3.24Å; K35-E39 PolarHBondContact O-N 2.62Å
36	E	92	Very high	89	Confident	117 Å²	117	96.3 Å²	96.3	55%	0.547	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.3	-174.7	172.8	-168.6	0	0	110.9	R32 E39 Q40	R32-E36 WeakPolarHBondContact O-CB 3.46Å; R32-E36 PolarHBondContact O-N 3.05Å; E36-E39 PolarHBondContact O-N 2.9Å; E36-Q40 VanDerWaalsContact O-CG 3.26Å; E36-Q40 WeakPolarHBondContact O-CG 3.34Å; E36-Q40 PolarHBondContact O-N 3.45Å
37	L	90.4	Very high	90.2	Very high	75 Å²	75	96.1 Å²	96.1	39%	0.393	47%	0.47	S	S	.	.	H	α-helix	trans	-66.6	-38.3	176.1	-163.7	156.6	0	0	0	111.6	K33 K35 E39 Q40 R41	K33-L37 WeakPolarHBondContact O-CB 3.44Å; K33-L37 PolarHBondContact O-N 2.91Å; K35-L37 VanDerWaalsContact C-N 3.3Å; K35-L37 PolarHBondContact O-N 2.96Å; L37-E39 VanDerWaalsContact C-N 3.35Å; L37-Q40 PolarHBondContact O-N 3.41Å; L37-R41 HydrophobicContact CD2-CG 4.03Å; L37-R41 WeakPolarHBondContact O-CB 3.47Å; L37-R41 WeakPolarHBondContact O-CG 3.35Å; L37-R41 PolarHBondContact O-N 3.01Å
38	E	88.9	Confident	90.5	Very high	31 Å²	31	94.1 Å²	94.1	15%	0.145	46%	0.46	C	S	.	.	H	α-helix	trans	-62	-40.4	171.7	-170.4	-169	158.3	0	0	111.9	K34 K35 R41 K42	K34-E38 WeakPolarHBondContact O-CB 3.27Å; K34-E38 PolarHBondContact O-N 2.91Å; K35-E38 IonicContact NZ-OE1 2.74Å; K35-E38 IonicContact NZ-OE2 3.08Å; K35-E38 PolarHBondContact NZ-OE2 3.03Å; K35-E38 WeakPolarHBondContact O-CB 3.46Å; K35-E38 PolarHBondContact O-N 2.97Å; E38-R41 WeakPolarHBondContact O-CB 3.48Å; E38-R41 PolarHBondContact O-N 3.02Å; E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.49Å; E38-K42 WeakPolarHBondContact OE1-CE 3.22Å; E38-K42 IonicContact OE1-NZ 3.19Å; E38-K42 PolarHBondContact OE1-NZ 2.91Å
39	E	91.2	Very high	90.6	Very high	118 Å²	118	87.5 Å²	87.5	55%	0.551	44%	0.438	S	S	*	.	H	α-helix	trans	-66.3	-45.6	175.1	-73.1	174.5	-177.4	0	0	111.6	K35 E36 L37 R41 K42 L43	K35-E39 WeakPolarHBondContact O-CG 3.24Å; K35-E39 PolarHBondContact O-N 2.62Å; E36-E39 PolarHBondContact O-N 2.9Å; L37-E39 VanDerWaalsContact C-N 3.35Å; E39-R41 VanDerWaalsContact C-N 3.28Å; E39-R41 PolarHBondContact O-N 3.33Å; E39-K42 PolarHBondContact O-N 3.05Å; E39-K42 VanDerWaalsContact O-N 3.15Å; E39-L43 VanDerWaalsContact O-CG 3.28Å; E39-L43 WeakPolarHBondContact O-CG 3.49Å; E39-L43 PolarHBondContact O-N 3.38Å
40	Q	93.8	Very high	90.8	Very high	65 Å²	65	84.8 Å²	84.8	30%	0.304	43%	0.43	S	S	.	.	H	α-helix	trans	-61.1	-36.7	174.4	-68.3	-64.1	-32.6	0	0	112.1	E36 L37 L43 G44 N45 A46	E36-Q40 VanDerWaalsContact O-CG 3.26Å; E36-Q40 WeakPolarHBondContact O-CG 3.34Å; E36-Q40 PolarHBondContact O-N 3.45Å; L37-Q40 PolarHBondContact O-N 3.41Å; Q40-L43 CarbonylContact O-C 3.51Å; Q40-L43 PolarHBondContact O-N 2.9Å; Q40-G44 PolarHBondContact O-N 2.88Å; Q40-G44 VanDerWaalsContact O-N 3.16Å; Q40-N45 PolarHBondContact O-N 2.79Å; Q40-N45 PolarHBondContact OE1-ND2 2.88Å; Q40-A46 HydrophobicContact CB-CB 3.93Å; Q40-A46 PolarHBondContact O-N 3.45Å
41	R	91.8	Very high	90.8	Very high	43 Å²	43	82.4 Å²	82.4	16%	0.162	42%	0.418	C	S	.	.	H	α-helix	trans	-65.7	-42.6	173.3	-79.2	176.8	174.2	148.9	-2.4	112.3	L37 E38 E39 L43 G44 A46 P47 E49 P59	L37-R41 HydrophobicContact CD2-CG 4.03Å; L37-R41 WeakPolarHBondContact O-CB 3.47Å; L37-R41 WeakPolarHBondContact O-CG 3.35Å; L37-R41 PolarHBondContact O-N 3.01Å; E38-R41 WeakPolarHBondContact O-CB 3.48Å; E38-R41 PolarHBondContact O-N 3.02Å; E39-R41 VanDerWaalsContact C-N 3.28Å; E39-R41 PolarHBondContact O-N 3.33Å; R41-L43 PolarHBondContact O-N 3.45Å; R41-G44 PolarHBondContact O-N 3.06Å; R41-A46 HydrophobicContact CG-CB 3.75Å; R41-P47 WeakPolarHBondContact CD-O 3.45Å; R41-P47 VanDerWaalsContact CG-O 3.32Å; R41-P47 WeakPolarHBondContact CG-O 3.46Å; R41-P47 PolarHBondContact NE-O 3.29Å; R41-E49 IonicContact CZ-OE1 3.99Å; R41-E49 VanDerWaalsContact NH1-CD 3.25Å; R41-E49 IonicContact NH1-OE1 3.35Å; R41-E49 PolarHBondContact NH1-OE1 3.25Å; R41-E49 VanDerWaalsContact NH2-CG 3.34Å; R41-P59 HydrophobicContact CB-CB 3.68Å; R41-P59 HydrophobicContact CB-CG 3.69Å; R41-P59 HydrophobicContact CG-CG 4.39Å
42	K	92.8	Very high	90.9	Very high	84 Å²	84	80.2 Å²	80.2	37%	0.365	41%	0.413	S	S	.	.	H	α-helix	trans	-66.1	-29	174.7	-74.5	172.7	-174.3	168.5	0	112.5	E38 E39 P59 H60	E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.49Å; E38-K42 WeakPolarHBondContact OE1-CE 3.22Å; E38-K42 IonicContact OE1-NZ 3.19Å; E38-K42 PolarHBondContact OE1-NZ 2.91Å; E39-K42 PolarHBondContact O-N 3.05Å; E39-K42 VanDerWaalsContact O-N 3.15Å; K42-P59 WeakPolarHBondContact CE-O 3.44Å; K42-P59 HydrophobicContact CG-CB 4.18Å; K42-H60 PolarHBondContact O-CE1 3.14Å
43	L	94.2	Very high	90.7	Very high	132 Å²	132	77.1 Å²	77.1	69%	0.691	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.3	171.8	-67.4	170.6	0	0	0	112.8	E39 Q40 R41 N45	E39-L43 VanDerWaalsContact O-CG 3.28Å; E39-L43 WeakPolarHBondContact O-CG 3.49Å; E39-L43 PolarHBondContact O-N 3.38Å; Q40-L43 CarbonylContact O-C 3.51Å; Q40-L43 PolarHBondContact O-N 2.9Å; R41-L43 PolarHBondContact O-N 3.45Å; L43-N45 VanDerWaalsContact C-N 3.27Å; L43-N45 PolarHBondContact O-N 2.63Å
44	G	92.4	Very high	90.5	Very high	67 Å²	67	73.5 Å²	73.5	69%	0.691	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	10.7	-179	0	0	0	0	0	114.7	Q40 R41	Q40-G44 PolarHBondContact O-N 2.88Å; Q40-G44 VanDerWaalsContact O-N 3.16Å; R41-G44 PolarHBondContact O-N 3.06Å
45	N	94.2	Very high	90.8	Very high	129 Å²	129	73.9 Å²	73.9	69%	0.69	41%	0.405	S	S	*	.	S	Bend	trans	-91.4	-17.3	-177.5	-163.3	41.7	0	0	0	113.1	Q40 L43	Q40-N45 PolarHBondContact O-N 2.79Å; Q40-N45 PolarHBondContact OE1-ND2 2.88Å; L43-N45 VanDerWaalsContact C-N 3.27Å; L43-N45 PolarHBondContact O-N 2.63Å
46	A	91.9	Very high	90.9	Very high	26 Å²	26	77.2 Å²	77.2	22%	0.215	43%	0.426	C	S	.	.	S	Bend	trans	-121.1	146.7	176.4	0	0	0	0	0	111.1	Q40 R41	Q40-A46 HydrophobicContact CB-CB 3.93Å; Q40-A46 PolarHBondContact O-N 3.45Å; R41-A46 HydrophobicContact CG-CB 3.75Å
47	P	91	Very high	90.9	Very high	109 Å²	109	72.2 Å²	72.2	71%	0.708	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-65.6	149.8	179.8	28.4	-35.3	0	0	0	111.5	R41	R41-P47 WeakPolarHBondContact CD-O 3.45Å; R41-P47 VanDerWaalsContact CG-O 3.32Å; R41-P47 WeakPolarHBondContact CG-O 3.46Å; R41-P47 PolarHBondContact NE-O 3.29Å
48	A	90.7	Very high	90.9	Very high	26 Å²	26	72.8 Å²	72.8	22%	0.215	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-60.1	162.7	178	0	0	0	0	0	112.6	D56 P59	A48-D56 HydrophobicContact CB-CB 3.85Å; A48-P59 HydrophobicContact CB-CG 4.35Å
49	E	87.6	Confident	91.1	Very high	49 Å²	49	72.6 Å²	72.6	23%	0.229	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	128.5	167.9	-68.1	-173.3	164.6	0	0	108.6	R41 I57 P78	R41-E49 IonicContact CZ-OE1 3.99Å; R41-E49 VanDerWaalsContact NH1-CD 3.25Å; R41-E49 IonicContact NH1-OE1 3.35Å; R41-E49 PolarHBondContact NH1-OE1 3.25Å; R41-E49 VanDerWaalsContact NH2-CG 3.34Å; E49-I57 HydrophobicContact CB-CB 4.27Å; E49-I57 HydrophobicContact CB-CD1 4.4Å; E49-I57 WeakPolarHBondContact O-CB 3.41Å; E49-I57 PolarHBondContact O-N 3.44Å; E49-P78 HydrophobicContact CB-CB 4.29Å; E49-P78 WeakPolarHBondContact OE2-CB 3.46Å
50	V	90.8	Very high	91.2	Very high	79 Å²	79	72.9 Å²	72.9	48%	0.479	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.2	176.9	-174.3	0	0	0	0	108.5
51	D	88.3	Confident	91.1	Very high	19 Å²	19	71.7 Å²	71.7	10%	0.102	40%	0.404	C	S	.	.			trans	-77.9	177.9	175.1	78.1	3.7	0	0	0	112.2	E53 G54 K55 I57 P78	D51-E53 PolarHBondContact O-N 3.14Å; D51-E53 VanDerWaalsContact OD1-C 3.27Å; D51-E53 VanDerWaalsContact OD1-CA 3.28Å; D51-E53 WeakPolarHBondContact OD1-CA 3.31Å; D51-E53 WeakPolarHBondContact OD1-CB 3.27Å; D51-E53 PolarHBondContact OD1-N 3.02Å; D51-G54 PolarHBondContact O-N 3.24Å; D51-G54 VanDerWaalsContact O-N 3.11Å; D51-G54 PolarHBondContact OD1-N 2.97Å; D51-K55 PolarHBondContact N-O 3.12Å; D51-K55 PolarHBondContact OD1-N 3.23Å; D51-I57 HydrophobicContact CB-CD1 4.28Å; D51-I57 HydrophobicContact CB-CG1 4.31Å; D51-P78 WeakPolarHBondContact CA-O 3.44Å
52	E	86.2	Confident	91.1	Very high	97 Å²	97	72.2 Å²	72.2	45%	0.453	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.5	176	64.5	-158.6	-138.2	0	0	115.1	G54 K81	E52-G54 VanDerWaalsContact C-N 3.34Å; E52-K81 WeakPolarHBondContact OE1-CD 3.38Å; E52-K81 WeakPolarHBondContact OE1-CE 3.27Å; E52-K81 IonicContact OE1-NZ 3.21Å; E52-K81 PolarHBondContact OE1-NZ 3.15Å
53	E	87.4	Confident	91	Very high	75 Å²	75	73.1 Å²	73.1	35%	0.35	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0	172.3	-64.2	-177.3	-179.4	0	0	111.8	D51 K55 K81 R84	D51-E53 PolarHBondContact O-N 3.14Å; D51-E53 VanDerWaalsContact OD1-C 3.27Å; D51-E53 VanDerWaalsContact OD1-CA 3.28Å; D51-E53 WeakPolarHBondContact OD1-CA 3.31Å; D51-E53 WeakPolarHBondContact OD1-CB 3.27Å; D51-E53 PolarHBondContact OD1-N 3.02Å; E53-K55 HydrophobicContact CB-CD 4.48Å; E53-K55 HydrophobicContact CB-CG 4.33Å; E53-K55 WeakPolarHBondContact OE2-CE 3.47Å; E53-K55 IonicContact OE2-NZ 2.77Å; E53-K55 PolarHBondContact OE2-NZ 3.33Å; E53-K81 WeakPolarHBondContact OE1-CE 3.49Å; E53-K81 IonicContact OE1-NZ 2.62Å; E53-R84 IonicContact OE1-CZ 2.76Å; E53-R84 IonicContact OE1-NH1 3.67Å; E53-R84 PolarHBondContact OE1-NH1 3.29Å; E53-R84 IonicContact OE1-NH2 2.82Å; E53-R84 PolarHBondContact OE1-NH2 3.45Å; E53-R84 IonicContact OE2-CZ 3.09Å; E53-R84 IonicContact OE2-NH1 2.78Å; E53-R84 IonicContact OE2-NH2 3.87Å; E53-R84 PolarHBondContact OE2-NH2 3.02Å
54	G	88.6	Confident	90.8	Very high	52 Å²	52	75 Å²	75	54%	0.536	42%	0.418	S	S	.	.	S	Bend	trans	78.7	15.6	-175.8	0	0	0	0	0	114.2	D51 E52	D51-G54 PolarHBondContact O-N 3.24Å; D51-G54 VanDerWaalsContact O-N 3.11Å; D51-G54 PolarHBondContact OD1-N 2.97Å; E52-G54 VanDerWaalsContact C-N 3.34Å
55	K	92.1	Very high	90.9	Very high	108 Å²	108	74.5 Å²	74.5	47%	0.47	40%	0.398	S	S	.	.			trans	-95.2	142.4	178.5	-60.7	179.2	179.4	159.2	0	111.4	D51 E53	D51-K55 PolarHBondContact N-O 3.12Å; D51-K55 PolarHBondContact OD1-N 3.23Å; E53-K55 HydrophobicContact CB-CD 4.48Å; E53-K55 HydrophobicContact CB-CG 4.33Å; E53-K55 WeakPolarHBondContact OE2-CE 3.47Å; E53-K55 IonicContact OE2-NZ 2.77Å; E53-K55 PolarHBondContact OE2-NZ 3.33Å
56	D	92.9	Very high	90.7	Very high	120 Å²	120	69.6 Å²	69.6	64%	0.642	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.3	178.5	-59.5	-31.4	0	0	0	111.4	A48 N58	A48-D56 HydrophobicContact CB-CB 3.85Å; D56-N58 PolarHBondContact O-N 2.83Å
57	I	91.4	Very high	90.5	Very high	13 Å²	13	71 Å²	71	7%	0.067	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.9	170.2	-57.6	177.4	0	0	0	107.8	E49 D51 P59 I61 P78	E49-I57 HydrophobicContact CB-CB 4.27Å; E49-I57 HydrophobicContact CB-CD1 4.4Å; E49-I57 WeakPolarHBondContact O-CB 3.41Å; E49-I57 PolarHBondContact O-N 3.44Å; D51-I57 HydrophobicContact CB-CD1 4.28Å; D51-I57 HydrophobicContact CB-CG1 4.31Å; I57-P59 VanDerWaalsContact O-CD 3.3Å; I57-P59 WeakPolarHBondContact O-CD 3.36Å; I57-P59 VanDerWaalsContact O-N 3.16Å; I57-I61 HydrophobicContact CG2-CD1 4.14Å; I57-P78 HydrophobicContact CD1-CB 3.93Å
58	N	91.5	Very high	90.5	Very high	86 Å²	86	66.3 Å²	66.3	46%	0.46	35%	0.351	S	S	.	.			trans	-56.5	119.9	178.7	-177.3	-22.4	0	0	0	110.8	D56 H60 I61	D56-N58 PolarHBondContact O-N 2.83Å; N58-H60 PolarHBondContact O-N 3.1Å; N58-H60 VanDerWaalsContact O-N 3.09Å; N58-H60 WeakPolarHBondContact OD1-CB 3.5Å; N58-H60 PolarHBondContact OD1-CD2 3Å; N58-H60 VanDerWaalsContact OD1-CD2 3.29Å; N58-H60 PolarHBondContact OD1-N 3.36Å; N58-I61 HydrophobicContact CB-CD1 3.93Å; N58-I61 HydrophobicContact CB-CG1 4.04Å; N58-I61 WeakPolarHBondContact O-CB 3.33Å; N58-I61 VanDerWaalsContact O-CG1 3.32Å; N58-I61 WeakPolarHBondContact O-CG1 3.28Å; N58-I61 PolarHBondContact O-N 3.09Å
59	P	92.1	Very high	90.6	Very high	27 Å²	27	66.7 Å²	66.7	18%	0.175	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.3	-178.6	-25.2	35.4	0	0	0	115.5	R41 K42 A48 I57 I61	R41-P59 HydrophobicContact CB-CB 3.68Å; R41-P59 HydrophobicContact CB-CG 3.69Å; R41-P59 HydrophobicContact CG-CG 4.39Å; K42-P59 WeakPolarHBondContact CE-O 3.44Å; K42-P59 HydrophobicContact CG-CB 4.18Å; A48-P59 HydrophobicContact CB-CG 4.35Å; I57-P59 VanDerWaalsContact O-CD 3.3Å; I57-P59 WeakPolarHBondContact O-CD 3.36Å; I57-P59 VanDerWaalsContact O-N 3.16Å; P59-I61 VanDerWaalsContact C-N 3.29Å
60	H	93.3	Very high	90.7	Very high	124 Å²	124	73.3 Å²	73.3	57%	0.574	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-7.4	176.3	-60.1	-74.9	0	0	0	113	K42 N58 P62	K42-H60 PolarHBondContact O-CE1 3.14Å; N58-H60 PolarHBondContact O-N 3.1Å; N58-H60 VanDerWaalsContact O-N 3.09Å; N58-H60 WeakPolarHBondContact OD1-CB 3.5Å; N58-H60 PolarHBondContact OD1-CD2 3Å; N58-H60 VanDerWaalsContact OD1-CD2 3.29Å; N58-H60 PolarHBondContact OD1-N 3.36Å; H60-P62 WeakPolarHBondContact O-CD 3.25Å
61	I	92.3	Very high	90.6	Very high	41 Å²	41	77.2 Å²	77.2	21%	0.21	38%	0.382	C	S	.	.	S	Bend	trans	-65.3	123.1	170.8	-63.7	167.3	0	0	0	108	I57 N58 P59 Q63 I65 L80	I57-I61 HydrophobicContact CG2-CD1 4.14Å; N58-I61 HydrophobicContact CB-CD1 3.93Å; N58-I61 HydrophobicContact CB-CG1 4.04Å; N58-I61 WeakPolarHBondContact O-CB 3.33Å; N58-I61 VanDerWaalsContact O-CG1 3.32Å; N58-I61 WeakPolarHBondContact O-CG1 3.28Å; N58-I61 PolarHBondContact O-N 3.09Å; P59-I61 VanDerWaalsContact C-N 3.29Å; I61-Q63 PolarHBondContact O-N 2.75Å; I61-I65 HydrophobicContact CG2-CB 3.73Å; I61-I65 HydrophobicContact CG2-CG2 3.85Å; I61-L80 HydrophobicContact CD1-CD2 4.27Å
62	P	92.4	Very high	90.7	Very high	53 Å²	53	79.6 Å²	79.6	34%	0.344	39%	0.394	S	S	.	.			trans	-55.1	141.9	178.4	-26	33.8	0	0	0	112.2	H60 Y64 I65 S66	H60-P62 WeakPolarHBondContact O-CD 3.25Å; P62-Y64 HydrophobicContact CB-CD1 3.69Å; P62-Y64 HydrophobicContact CB-CE1 3.23Å; P62-Y64 HydrophobicContact CG-CE1 4.04Å; P62-Y64 PolarHBondContact O-N 3.03Å; P62-I65 HydrophobicContact CG-CD1 4.35Å; P62-I65 PolarHBondContact O-N 3.49Å; P62-S66 PolarHBondContact O-N 3.44Å
63	Q	89.4	Confident	90.6	Very high	103 Å²	103	77.9 Å²	77.9	48%	0.481	39%	0.388	S	S	.	.	H	α-helix	trans	-53.9	-33.2	-173.8	-173.3	175.8	-2.2	0	0	113.7	I61 I65 S66 S67	I61-Q63 PolarHBondContact O-N 2.75Å; Q63-I65 VanDerWaalsContact C-N 3.3Å; Q63-I65 PolarHBondContact O-N 3.2Å; Q63-S66 PolarHBondContact O-OG 2.99Å; Q63-S67 WeakPolarHBondContact O-CB 3.43Å; Q63-S67 PolarHBondContact O-N 3.31Å; Q63-S67 PolarHBondContact O-OG 3Å; Q63-S67 VanDerWaalsContact O-OG 3.07Å
64	Y	91.1	Very high	90.5	Very high	173 Å²	173	79.2 Å²	79.2	68%	0.678	40%	0.404	S	S	*	.	H	α-helix	trans	-71.7	-22.5	179.6	64.9	-95.9	0	0	0	113.7	P62 S67	P62-Y64 HydrophobicContact CB-CD1 3.69Å; P62-Y64 HydrophobicContact CB-CE1 3.23Å; P62-Y64 HydrophobicContact CG-CE1 4.04Å; P62-Y64 PolarHBondContact O-N 3.03Å; Y64-S67 PolarHBondContact O-OG 3.23Å
65	I	93	Very high	90.2	Very high	56 Å²	56	80.9 Å²	80.9	29%	0.287	41%	0.407	S	S	.	.	H	α-helix	trans	-84	-45.3	176	-56.9	-173.9	0	0	0	109.6	I61 P62 Q63 L80 H82 Q83	I61-I65 HydrophobicContact CG2-CB 3.73Å; I61-I65 HydrophobicContact CG2-CG2 3.85Å; P62-I65 HydrophobicContact CG-CD1 4.35Å; P62-I65 PolarHBondContact O-N 3.49Å; Q63-I65 VanDerWaalsContact C-N 3.3Å; Q63-I65 PolarHBondContact O-N 3.2Å; I65-L80 HydrophobicContact CG2-CD1 4.4Å; I65-H82 PolarHBondContact O-CE1 3.02Å; I65-H82 PolarHBondContact O-NE2 2.87Å; I65-Q83 HydrophobicContact CG2-CG 4.02Å; I65-Q83 PolarHBondContact O-NE2 3.32Å
66	S	90.1	Very high	89.7	Confident	25 Å²	25	82.6 Å²	82.6	18%	0.175	41%	0.414	C	S	.	.	H	α-helix	trans	-75.8	-25.6	-178.9	58.6	0	0	0	0	113.3	P62 Q63 V68	P62-S66 PolarHBondContact O-N 3.44Å; Q63-S66 PolarHBondContact O-OG 2.99Å; S66-V68 PolarHBondContact O-N 2.85Å
67	S	89.1	Confident	89.3	Confident	57 Å²	57	84.4 Å²	84.4	40%	0.399	41%	0.412	S	S	.	.	S	Bend	trans	-66.5	121.2	175.4	64.8	0	0	0	0	110.4	Q63 Y64 P69 H82	Q63-S67 WeakPolarHBondContact O-CB 3.43Å; Q63-S67 PolarHBondContact O-N 3.31Å; Q63-S67 PolarHBondContact O-OG 3Å; Q63-S67 VanDerWaalsContact O-OG 3.07Å; Y64-S67 PolarHBondContact O-OG 3.23Å; S67-P69 VanDerWaalsContact O-CD 3.26Å; S67-P69 WeakPolarHBondContact O-CD 3.37Å; S67-H82 PolarHBondContact O-NE2 3.15Å; S67-H82 VanDerWaalsContact O-NE2 3.08Å
68	V	91.4	Very high	89	Confident	9 Å²	9	86.5 Å²	86.5	6%	0.055	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-78	118.7	171.4	-174.2	0	0	0	0	108.8	S66 I72 D73 R77 T79	S66-V68 PolarHBondContact O-N 2.85Å; V68-I72 HydrophobicContact CG1-CB 3.99Å; V68-I72 HydrophobicContact CG1-CG2 4.1Å; V68-D73 HydrophobicContact CG1-CB 4.16Å; V68-R77 VanDerWaalsContact CG2-O 3.28Å; V68-R77 WeakPolarHBondContact CG2-O 3.25Å; V68-T79 HydrophobicContact CG2-CG2 3.49Å; V68-T79 VanDerWaalsContact CG2-CG2 3.49Å; V68-T79 WeakPolarHBondContact CG2-O 3.34Å
69	P	90.9	Very high	89	Confident	35 Å²	35	82.4 Å²	82.4	23%	0.227	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-63.6	152	173.2	-20.4	31.1	0	0	0	112.7	S67 Y71 I72 D73	S67-P69 VanDerWaalsContact O-CD 3.26Å; S67-P69 WeakPolarHBondContact O-CD 3.37Å; P69-Y71 HydrophobicContact CB-CD1 3.72Å; P69-Y71 HydrophobicContact CB-CE1 3.24Å; P69-Y71 HydrophobicContact CB-CE2 4.11Å; P69-Y71 HydrophobicContact CB-CG 4.33Å; P69-Y71 VanDerWaalsContact CB-CZ 3.45Å; P69-Y71 HydrophobicContact CG-CE1 3.98Å; P69-Y71 HydrophobicContact CG-CE2 4.43Å; P69-Y71 PolarHBondContact O-N 3.42Å; P69-Y71 VanDerWaalsContact O-N 3.12Å; P69-I72 HydrophobicContact CB-CD1 3.99Å; P69-I72 HydrophobicContact CG-CD1 3.85Å; P69-I72 PolarHBondContact O-N 3.34Å; P69-I72 VanDerWaalsContact O-N 3.12Å; P69-D73 PolarHBondContact O-N 2.84Å
70	W	90	Very high	88.9	Confident	188 Å²	188	84 Å²	84	71%	0.712	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.6	-175.3	67.4	-91.4	0	0	0	114.8	I72 D73	W70-I72 VanDerWaalsContact C-N 3.31Å; W70-D73 CarbonylContact O-C 3.56Å
71	Y	89.7	Confident	88.8	Confident	161 Å²	161	82 Å²	82	63%	0.631	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.1	-178.1	56.8	-102.8	0	0	0	113.5	P69	P69-Y71 HydrophobicContact CB-CD1 3.72Å; P69-Y71 HydrophobicContact CB-CE1 3.24Å; P69-Y71 HydrophobicContact CB-CE2 4.11Å; P69-Y71 HydrophobicContact CB-CG 4.33Å; P69-Y71 VanDerWaalsContact CB-CZ 3.45Å; P69-Y71 HydrophobicContact CG-CE1 3.98Å; P69-Y71 HydrophobicContact CG-CE2 4.43Å; P69-Y71 PolarHBondContact O-N 3.42Å; P69-Y71 VanDerWaalsContact O-N 3.12Å
72	I	89.1	Confident	88.7	Confident	68 Å²	68	81.1 Å²	81.1	35%	0.349	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-58.7	167.8	-63.6	119.1	0	0	0	108.4	V68 P69 W70 H82	V68-I72 HydrophobicContact CG1-CB 3.99Å; V68-I72 HydrophobicContact CG1-CG2 4.1Å; P69-I72 HydrophobicContact CB-CD1 3.99Å; P69-I72 HydrophobicContact CG-CD1 3.85Å; P69-I72 PolarHBondContact O-N 3.34Å; P69-I72 VanDerWaalsContact O-N 3.12Å; W70-I72 VanDerWaalsContact C-N 3.31Å; I72-H82 HydrophobicContact CD1-CB 3.7Å; I72-H82 HydrophobicContact CG1-CB 4.11Å; I72-H82 HydrophobicContact CG2-CB 4.28Å
73	D	85.6	Confident	88.8	Confident	61 Å²	61	83.3 Å²	83.3	33%	0.326	40%	0.401	S	S	.	.			trans	-136.9	122.4	177.4	-66.9	-50.6	0	0	0	110.8	V68 P69 W70 S75 K76	V68-D73 HydrophobicContact CG1-CB 4.16Å; P69-D73 PolarHBondContact O-N 2.84Å; W70-D73 CarbonylContact O-C 3.56Å; D73-S75 PolarHBondContact O-N 3.42Å; D73-K76 PolarHBondContact O-N 3.04Å
74	P	85.4	Confident	88.9	Confident	104 Å²	104	84 Å²	84	68%	0.675	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.7	-179.8	26.7	-33.7	0	0	0	112.4	K76	P74-K76 VanDerWaalsContact C-N 3.28Å; P74-K76 PolarHBondContact O-N 2.73Å
75	S	81.6	Confident	89.1	Confident	86 Å²	86	80.6 Å²	80.6	60%	0.601	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-4.6	-178.1	-53	0	0	0	0	114.5	D73 R77	D73-S75 PolarHBondContact O-N 3.42Å; S75-R77 PolarHBondContact O-N 2.88Å; S75-R77 VanDerWaalsContact O-N 3.07Å
76	K	81.9	Confident	89	Confident	145 Å²	145	81.3 Å²	81.3	63%	0.63	40%	0.401	S	S	*	.			trans	45.1	42.4	178.4	-60.8	178.3	-176.7	175.3	0	113.5	D73 P74	D73-K76 PolarHBondContact O-N 3.04Å; P74-K76 VanDerWaalsContact C-N 3.28Å; P74-K76 PolarHBondContact O-N 2.73Å
77	R	84.7	Confident	89.2	Confident	158 Å²	158	85.7 Å²	85.7	60%	0.596	43%	0.429	S	S	*	.			trans	-64	144.3	175.2	-69.1	-176.2	178.4	-174.1	0	109	V68 S75 T79	V68-R77 VanDerWaalsContact CG2-O 3.28Å; V68-R77 WeakPolarHBondContact CG2-O 3.25Å; S75-R77 PolarHBondContact O-N 2.88Å; S75-R77 VanDerWaalsContact O-N 3.07Å; R77-T79 PolarHBondContact O-N 2.92Å
78	P	84.9	Confident	89.3	Confident	56 Å²	56	90.5 Å²	90.5	36%	0.364	45%	0.445	S	S	.	.	S	Bend	trans	-69.2	101.3	176.6	29	-33.1	0	0	0	108.9	E49 D51 I57	E49-P78 HydrophobicContact CB-CB 4.29Å; E49-P78 WeakPolarHBondContact OE2-CB 3.46Å; D51-P78 WeakPolarHBondContact CA-O 3.44Å; I57-P78 HydrophobicContact CD1-CB 3.93Å
79	T	90.3	Very high	89.3	Confident	1 Å²	1	97.1 Å²	97.1	1%	0.006	47%	0.473	C	S	.	.			trans	-147	150.9	176.5	176.7	0	0	0	0	110	V68 R77 K81 H82	V68-T79 HydrophobicContact CG2-CG2 3.49Å; V68-T79 VanDerWaalsContact CG2-CG2 3.49Å; V68-T79 WeakPolarHBondContact CG2-O 3.34Å; R77-T79 PolarHBondContact O-N 2.92Å; T79-K81 WeakPolarHBondContact OG1-CG 3.31Å; T79-K81 PolarHBondContact OG1-N 2.88Å; T79-H82 PolarHBondContact O-CE1 2.94Å; T79-H82 VanDerWaalsContact O-CE1 3.3Å; T79-H82 PolarHBondContact O-ND1 3.32Å
80	L	91.4	Very high	89.3	Confident	61 Å²	61	101.2 Å²	101.2	32%	0.319	49%	0.489	S	S	.	.			trans	-104.8	11.3	177	-152.7	69.6	0	0	0	112.2	I61 I65 H82 Q83	I61-L80 HydrophobicContact CD1-CD2 4.27Å; I65-L80 HydrophobicContact CG2-CD1 4.4Å; L80-H82 VanDerWaalsContact C-N 3.3Å; L80-H82 PolarHBondContact O-N 2.94Å; L80-Q83 HydrophobicContact CD1-CB 4.44Å; L80-Q83 HydrophobicContact CD1-CG 3.87Å; L80-Q83 HydrophobicContact CG-CB 4.17Å; L80-Q83 HydrophobicContact CG-CG 4.14Å; L80-Q83 PolarHBondContact O-N 2.81Å; L80-Q83 VanDerWaalsContact O-N 3.15Å
81	K	91.1	Very high	89.3	Confident	81 Å²	81	99.1 Å²	99.1	35%	0.352	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-61.6	-33.8	-177.5	-77.4	-177.1	-178.9	-177.5	0	113.5	E52 E53 T79 Q83 R84	E52-K81 WeakPolarHBondContact OE1-CD 3.38Å; E52-K81 WeakPolarHBondContact OE1-CE 3.27Å; E52-K81 IonicContact OE1-NZ 3.21Å; E52-K81 PolarHBondContact OE1-NZ 3.15Å; E53-K81 WeakPolarHBondContact OE1-CE 3.49Å; E53-K81 IonicContact OE1-NZ 2.62Å; T79-K81 WeakPolarHBondContact OG1-CG 3.31Å; T79-K81 PolarHBondContact OG1-N 2.88Å; K81-Q83 PolarHBondContact O-N 2.92Å; K81-R84 WeakPolarHBondContact O-CB 3.29Å; K81-R84 PolarHBondContact O-N 3.01Å; K81-R84 VanDerWaalsContact O-N 3.07Å
82	H	90.3	Very high	89.3	Confident	23 Å²	23	99.8 Å²	99.8	11%	0.106	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-67.3	-19	177.9	63.3	-64.8	0	0	0	114	I65 S67 I72 T79 L80	I65-H82 PolarHBondContact O-CE1 3.02Å; I65-H82 PolarHBondContact O-NE2 2.87Å; S67-H82 PolarHBondContact O-NE2 3.15Å; S67-H82 VanDerWaalsContact O-NE2 3.08Å; I72-H82 HydrophobicContact CD1-CB 3.7Å; I72-H82 HydrophobicContact CG1-CB 4.11Å; I72-H82 HydrophobicContact CG2-CB 4.28Å; T79-H82 PolarHBondContact O-CE1 2.94Å; T79-H82 VanDerWaalsContact O-CE1 3.3Å; T79-H82 PolarHBondContact O-ND1 3.32Å; L80-H82 VanDerWaalsContact C-N 3.3Å; L80-H82 PolarHBondContact O-N 2.94Å
83	Q	92.9	Very high	89.5	Confident	98 Å²	98	100.7 Å²	100.7	46%	0.458	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-88.7	-7.6	174.8	-54.6	-61.2	-11.6	0	0	112.8	I65 L80 K81	I65-Q83 HydrophobicContact CG2-CG 4.02Å; I65-Q83 PolarHBondContact O-NE2 3.32Å; L80-Q83 HydrophobicContact CD1-CB 4.44Å; L80-Q83 HydrophobicContact CD1-CG 3.87Å; L80-Q83 HydrophobicContact CG-CB 4.17Å; L80-Q83 HydrophobicContact CG-CG 4.14Å; L80-Q83 PolarHBondContact O-N 2.81Å; L80-Q83 VanDerWaalsContact O-N 3.15Å; K81-Q83 PolarHBondContact O-N 2.92Å
84	R	92.9	Very high	89.9	Confident	119 Å²	119	99.3 Å²	99.3	45%	0.449	49%	0.488	S	S	.	.	S	Bend	trans	-67.4	155	172.1	-69	-169.7	173.9	167.1	9	110.1	E53 K81 Q86	E53-R84 IonicContact OE1-CZ 2.76Å; E53-R84 IonicContact OE1-NH1 3.67Å; E53-R84 PolarHBondContact OE1-NH1 3.29Å; E53-R84 IonicContact OE1-NH2 2.82Å; E53-R84 PolarHBondContact OE1-NH2 3.45Å; E53-R84 IonicContact OE2-CZ 3.09Å; E53-R84 IonicContact OE2-NH1 2.78Å; E53-R84 IonicContact OE2-NH2 3.87Å; E53-R84 PolarHBondContact OE2-NH2 3.02Å; K81-R84 WeakPolarHBondContact O-CB 3.29Å; K81-R84 PolarHBondContact O-N 3.01Å; K81-R84 VanDerWaalsContact O-N 3.07Å; R84-Q86 PolarHBondContact O-N 3.36Å; R84-Q86 VanDerWaalsContact O-N 3.16Å
85	P	94.1	Very high	90.3	Very high	100 Å²	100	97.6 Å²	97.6	65%	0.649	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-55.4	123.3	179.4	-24.9	34.1	0	0	0	112.1
86	Q	92.8	Very high	90.6	Very high	72 Å²	72	99.3 Å²	99.3	34%	0.336	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-73.9	135.8	-174.7	-68.3	169.1	-17.1	0	0	111.2	R84 E88 K89 Q90	R84-Q86 PolarHBondContact O-N 3.36Å; R84-Q86 VanDerWaalsContact O-N 3.16Å; Q86-E88 VanDerWaalsContact C-N 3.25Å; Q86-E88 HydrophobicContact CB-CG 3.96Å; Q86-E88 PolarHBondContact O-N 2.84Å; Q86-E88 PolarHBondContact OE1-OE1 3.23Å; Q86-K89 PolarHBondContact O-N 3.37Å; Q86-K89 VanDerWaalsContact O-N 3.1Å; Q86-Q90 WeakPolarHBondContact O-CG 3.16Å; Q86-Q90 PolarHBondContact O-N 2.86Å
87	P	92.7	Very high	91	Very high	117 Å²	117	95.8 Å²	95.8	76%	0.76	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-32.3	-177.7	24.9	-33.9	0	0	0	112.8	K89 Q90	P87-K89 VanDerWaalsContact C-N 3.31Å; P87-K89 PolarHBondContact O-N 2.84Å; P87-Q90 PolarHBondContact O-N 3.45Å
88	E	91.8	Very high	91.3	Very high	158 Å²	158	92.1 Å²	92.1	74%	0.738	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.5	176.9	51.7	168.5	-153.5	0	0	114.3	Q86	Q86-E88 VanDerWaalsContact C-N 3.25Å; Q86-E88 HydrophobicContact CB-CG 3.96Å; Q86-E88 PolarHBondContact O-N 2.84Å; Q86-E88 PolarHBondContact OE1-OE1 3.23Å
89	K	91.6	Very high	91.8	Very high	148 Å²	148	92.3 Å²	92.3	64%	0.643	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-19.5	178.8	-72	176.3	-178.2	156.3	0	112.3	Q86 P87 K91	Q86-K89 PolarHBondContact O-N 3.37Å; Q86-K89 VanDerWaalsContact O-N 3.1Å; P87-K89 VanDerWaalsContact C-N 3.31Å; P87-K89 PolarHBondContact O-N 2.84Å; K89-K91 PolarHBondContact O-N 3.31Å
90	Q	91.4	Very high	91.9	Very high	120 Å²	120	95.4 Å²	95.4	56%	0.561	49%	0.493	S	S	*	.			trans	-74.5	109.2	175.8	-68.4	-66.3	3.9	0	0	109.2	Q86 P87	Q86-Q90 WeakPolarHBondContact O-CG 3.16Å; Q86-Q90 PolarHBondContact O-N 2.86Å; P87-Q90 PolarHBondContact O-N 3.45Å
91	K	89.9	Confident	91.9	Very high	145 Å²	145	98.6 Å²	98.6	63%	0.63	51%	0.505	S	S	*	.			trans	-76.2	135.8	172.8	-65.5	173.7	-173	170.8	0	108.1	K89 Y93	K89-K91 PolarHBondContact O-N 3.31Å; K91-Y93 HydrophobicContact CB-CE1 4.04Å; K91-Y93 HydrophobicContact CB-CE2 3.98Å; K91-Y93 HydrophobicContact CD-CE1 4.49Å; K91-Y93 WeakPolarHBondContact O-CD2 3.38Å; K91-Y93 PolarHBondContact O-N 2.99Å
92	Q	89.8	Confident	91.9	Very high	175 Å²	175	103.3 Å²	103.3	82%	0.818	52%	0.52	S	S	*	.			trans	-76.1	116.5	173.9	-171.2	68	-14.4	0	0	109.4
93	Y	92.8	Very high	91.8	Very high	86 Å²	86	104.9 Å²	104.9	34%	0.337	54%	0.543	S	S	.	.			trans	-104.4	149	175.9	-61.1	-63.9	0	0	0	111.3	K91 M158 D160	K91-Y93 HydrophobicContact CB-CE1 4.04Å; K91-Y93 HydrophobicContact CB-CE2 3.98Å; K91-Y93 HydrophobicContact CD-CE1 4.49Å; K91-Y93 WeakPolarHBondContact O-CD2 3.38Å; K91-Y93 PolarHBondContact O-N 2.99Å; Y93-M158 CarbonylContact C-O 3.4Å; Y93-M158 VanDerWaalsContact CA-O 3.23Å; Y93-M158 WeakPolarHBondContact CA-O 3.17Å; Y93-D160 WeakPolarHBondContact CE2-OD1 3.45Å; Y93-D160 PolarHBondContact OH-OD1 3.43Å; Y93-D160 VanDerWaalsContact OH-OD1 3.14Å
94	S	93.5	Very high	91.5	Very high	32 Å²	32	103.2 Å²	103.2	22%	0.224	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-72.4	145.1	170.6	-58.8	0	0	0	0	110	L157 M158 F159	S94-L157 WeakPolarHBondContact OG-CD2 3.08Å; S94-M158 PolarHBondContact N-O 2.97Å; S94-M158 PolarHBondContact OG-N 3.45Å; S94-F159 VanDerWaalsContact CB-CE1 3.46Å
95	S	93.5	Very high	91.1	Very high	68 Å²	68	101 Å²	101	48%	0.476	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-76.3	163	-173.9	75.9	0	0	0	0	112.2	G97 D98	S95-G97 PolarHBondContact O-N 2.98Å; S95-D98 PolarHBondContact N-OD2 3.23Å; S95-D98 PolarHBondContact O-N 3.24Å; S95-D98 VanDerWaalsContact OG-CG 3.31Å; S95-D98 PolarHBondContact OG-OD2 3.4Å
96	S	88.9	Confident	90.3	Very high	123 Å²	123	103.5 Å²	103.5	86%	0.86	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	121.8	172.9	-174.4	0	0	0	0	109.4
97	G	89.1	Confident	89.4	Confident	70 Å²	70	108.9 Å²	108.9	72%	0.722	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.3	-26	-173	0	0	0	0	0	113.4	S95 W99	S95-G97 PolarHBondContact O-N 2.98Å; G97-W99 PolarHBondContact O-N 3.42Å
98	D	91.9	Very high	88.2	Confident	82 Å²	82	105.7 Å²	105.7	44%	0.439	55%	0.545	S	S	.	.			trans	-74.5	108.4	170.8	-68.5	-37.9	0	0	0	109.1	S95 F159	S95-D98 PolarHBondContact N-OD2 3.23Å; S95-D98 PolarHBondContact O-N 3.24Å; S95-D98 VanDerWaalsContact OG-CG 3.31Å; S95-D98 PolarHBondContact OG-OD2 3.4Å; D98-F159 WeakPolarHBondContact O-CE1 3.39Å; D98-F159 WeakPolarHBondContact O-CZ 3.26Å
99	W	94.6	Very high	87.4	Confident	59 Å²	59	102.2 Å²	102.2	22%	0.223	54%	0.535	C	S	.	.			trans	-130.2	165.6	177.7	-168.2	-125.5	0	0	0	112.1	G97 K101 F159 N169	G97-W99 PolarHBondContact O-N 3.42Å; W99-K101 PolarHBondContact O-N 3.16Å; W99-F159 AromaticContact CE3-CE2 3.85Å; W99-F159 HydrophobicContact CE3-CE2 3.85Å; W99-F159 AromaticContact CE3-CZ 3.83Å; W99-F159 HydrophobicContact CE3-CZ 3.83Å; W99-F159 HydrophobicContact CZ3-CD2 4.34Å; W99-F159 AromaticContact CZ3-CE2 3.63Å; W99-F159 HydrophobicContact CZ3-CE2 3.63Å; W99-F159 HydrophobicContact CZ3-CZ 4.06Å; W99-N169 HydrophobicContact CD2-CB 3.83Å; W99-N169 HydrophobicContact CE3-CB 3.86Å; W99-N169 HydrophobicContact CH2-CB 3.87Å; W99-N169 HydrophobicContact CZ2-CB 3.81Å; W99-N169 HydrophobicContact CZ3-CB 3.88Å; W99-N169 PolarHBondContact NE1-O 3.2Å
100	Y	93.3	Very high	86.9	Confident	66 Å²	66	96.1 Å²	96.1	26%	0.259	51%	0.512	S	S	.	.			trans	-55.1	133.8	172.2	-64.7	-74.7	0	0	0	110.4	R102 Q154 P155 L157	Y100-R102 PolarHBondContact O-N 3.49Å; Y100-R102 VanDerWaalsContact O-N 3.14Å; Y100-Q154 HydrophobicContact CD1-CB 4.13Å; Y100-Q154 HydrophobicContact CD1-CG 4.49Å; Y100-P155 WeakPolarHBondContact CE1-O 3.47Å; Y100-L157 HydrophobicContact CD1-CD1 4.18Å; Y100-L157 HydrophobicContact CD2-CD1 4.34Å; Y100-L157 HydrophobicContact CE1-CB 4.47Å; Y100-L157 HydrophobicContact CE1-CD1 4.21Å; Y100-L157 HydrophobicContact CE1-CG 4.35Å; Y100-L157 HydrophobicContact CE2-CD1 4.35Å; Y100-L157 HydrophobicContact CG-CD1 4.26Å
101	K	91.8	Very high	86.5	Confident	128 Å²	128	96.3 Å²	96.3	56%	0.557	52%	0.522	S	S	*	.			trans	-72.5	112.2	179.8	-59.5	-172.3	179.2	-171.6	0	108.8	W99 H152 Q154	W99-K101 PolarHBondContact O-N 3.16Å; K101-H152 HydrophobicContact CB-CB 3.92Å; K101-H152 VanDerWaalsContact CB-ND1 3.34Å; K101-H152 WeakPolarHBondContact CB-ND1 3.36Å; K101-Q154 PolarHBondContact O-NE2 3.33Å
102	R	89.8	Confident	86.3	Confident	180 Å²	180	97.2 Å²	97.2	68%	0.679	53%	0.525	S	S	*	.			trans	-86.9	151.6	175.8	-58	-66.8	-175.4	-162	-2.6	109.9	Y100	Y100-R102 PolarHBondContact O-N 3.49Å; Y100-R102 VanDerWaalsContact O-N 3.14Å
103	G	88.3	Confident	86.2	Confident	56 Å²	56	91.9 Å²	91.9	58%	0.577	50%	0.498	S	S	*	.	S	Bend	trans	96.6	-176.1	-179.4	0	0	0	0	0	114.3
104	V	87.6	Confident	86.1	Confident	63 Å²	63	91.4 Å²	91.4	38%	0.382	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-114.1	157.2	-178	-65.7	0	0	0	0	110.8	E106 P149	V104-E106 HydrophobicContact CG2-CG 4.36Å; V104-E106 PolarHBondContact O-N 3.42Å; V104-E106 VanDerWaalsContact O-N 3.12Å; V104-P149 HydrophobicContact CB-CB 4.14Å; V104-P149 HydrophobicContact CB-CG 3.78Å; V104-P149 HydrophobicContact CG1-CG 4.17Å; V104-P149 HydrophobicContact CG2-CB 4.32Å; V104-P149 HydrophobicContact CG2-CG 3.7Å
105	Q	84.9	Confident	85.8	Confident	74 Å²	74	99.7 Å²	99.7	35%	0.346	53%	0.528	S	S	.	.			trans	-77	98.6	174.4	-61.4	-169.9	-14.9	0	0	109.9	H107 P149 D150 H152	Q105-H107 PolarHBondContact O-N 3.11Å; Q105-P149 WeakPolarHBondContact O-CB 3.38Å; Q105-D150 WeakPolarHBondContact CB-O 3.28Å; Q105-D150 PolarHBondContact N-O 2.91Å; Q105-H152 WeakPolarHBondContact CG-CD2 3.39Å; Q105-H152 WeakPolarHBondContact CG-NE2 3.35Å
106	E	76.9	Confident	85.5	Confident	151 Å²	151	99.8 Å²	99.8	71%	0.706	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-22	-179	-63.9	-171.7	164.2	0	0	113.2	V104 A108	V104-E106 HydrophobicContact CG2-CG 4.36Å; V104-E106 PolarHBondContact O-N 3.42Å; V104-E106 VanDerWaalsContact O-N 3.12Å; E106-A108 VanDerWaalsContact C-N 3.32Å; E106-A108 PolarHBondContact O-N 3.08Å
107	H	72.7	Confident	85.6	Confident	185 Å²	185	94.2 Å²	94.2	86%	0.856	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-10.3	-171.9	-41	-50.8	0	0	0	114	Q105	Q105-H107 PolarHBondContact O-N 3.11Å
108	A	68.6	Low	85.7	Confident	51 Å²	51	91 Å²	91	42%	0.421	47%	0.468	S	S	.	.			trans	-138.3	66.2	-171.7	0	0	0	0	0	112.5	E106	E106-A108 VanDerWaalsContact C-N 3.32Å; E106-A108 PolarHBondContact O-N 3.08Å
109	V	75.8	Confident	85.6	Confident	84 Å²	84	90.2 Å²	90.2	51%	0.509	46%	0.461	S	S	.	.			trans	-83.9	115.9	171.6	-174.1	0	0	0	0	109.7	P149	V109-P149 HydrophobicContact CG2-CB 4.23Å
110	A	79.9	Confident	85.4	Confident	21 Å²	21	87.7 Å²	87.7	17%	0.174	45%	0.452	C	S	.	.			trans	-75.9	131.5	174.2	0	0	0	0	0	110.9	K112 R114 I147	A110-K112 VanDerWaalsContact C-N 3.34Å; A110-R114 VanDerWaalsContact CB-NE 3.3Å; A110-I147 HydrophobicContact CB-CG2 4.39Å; A110-I147 VanDerWaalsContact O-CB 3.22Å; A110-I147 WeakPolarHBondContact O-CB 3.3Å; A110-I147 VanDerWaalsContact O-CG2 3.31Å; A110-I147 WeakPolarHBondContact O-CG2 3.28Å
111	T	82.3	Confident	85.2	Confident	124 Å²	124	84.5 Å²	84.5	76%	0.761	44%	0.44	S	S	*	.	S	Bend	trans	-84.9	-9.8	178	53.4	0	0	0	0	113.5
112	K	86.1	Confident	85	Confident	163 Å²	163	78.4 Å²	78.4	71%	0.709	41%	0.413	S	S	*	.	S	Bend	trans	-130.4	148.5	-178.6	-65.9	-176.3	-179.6	178.4	0	110.8	A110 R114	A110-K112 VanDerWaalsContact C-N 3.34Å; K112-R114 PolarHBondContact O-N 3.23Å
113	Y	88.8	Confident	85	Confident	63 Å²	63	69.9 Å²	69.9	25%	0.247	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-62.9	127.7	173.9	179.3	-100.5	0	0	0	110.8	A117 K141	Y113-A117 HydrophobicContact CD2-CB 4.24Å; Y113-A117 HydrophobicContact CE2-CB 3.76Å; Y113-A117 PolarHBondContact OH-O 2.84Å; Y113-K141 HydrophobicContact CD1-CG 4.4Å; Y113-K141 HydrophobicContact CD2-CB 4.47Å; Y113-K141 HydrophobicContact CE1-CB 4.37Å; Y113-K141 HydrophobicContact CE1-CG 3.84Å; Y113-K141 HydrophobicContact CE2-CB 4.1Å; Y113-K141 HydrophobicContact CE2-CG 4.41Å
114	R	88.9	Confident	85.1	Confident	76 Å²	76	70.8 Å²	70.8	29%	0.287	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-97.9	140.5	178.8	-71.6	175.8	-83.3	158.9	0.3	109.9	A110 K112 G116 A117 L124 D150	A110-R114 VanDerWaalsContact CB-NE 3.3Å; K112-R114 PolarHBondContact O-N 3.23Å; R114-G116 PolarHBondContact O-N 2.79Å; R114-A117 HydrophobicContact CB-CB 4.44Å; R114-A117 WeakPolarHBondContact O-CB 3.49Å; R114-A117 PolarHBondContact O-N 2.85Å; R114-L124 HydrophobicContact CB-CD2 4.17Å; R114-L124 HydrophobicContact CB-CG 4.45Å; R114-D150 IonicContact CZ-OD2 2.83Å; R114-D150 IonicContact NH1-OD2 3.03Å; R114-D150 PolarHBondContact NH1-OD2 3.42Å; R114-D150 VanDerWaalsContact NH2-CG 3.28Å; R114-D150 IonicContact NH2-OD1 3.55Å; R114-D150 PolarHBondContact NH2-OD1 3.23Å; R114-D150 IonicContact NH2-OD2 3.73Å; R114-D150 PolarHBondContact NH2-OD2 3.39Å
115	K	87.6	Confident	85.1	Confident	206 Å²	206	70.8 Å²	70.8	90%	0.896	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	128.3	176.8	-68.8	-176.5	179.7	179.7	0	109.3
116	G	87.7	Confident	85.4	Confident	71 Å²	71	68.7 Å²	68.7	73%	0.732	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	-6.5	-175.1	0	0	0	0	0	114.5	R114	R114-G116 PolarHBondContact O-N 2.79Å
117	A	90.8	Very high	86.1	Confident	5 Å²	5	69.2 Å²	69.2	4%	0.041	36%	0.362	C	S	.	.	S	Bend	trans	-75	156.8	174.4	0	0	0	0	0	112.3	Y113 R114 E119 G122 A123 L124	Y113-A117 HydrophobicContact CD2-CB 4.24Å; Y113-A117 HydrophobicContact CE2-CB 3.76Å; Y113-A117 PolarHBondContact OH-O 2.84Å; R114-A117 HydrophobicContact CB-CB 4.44Å; R114-A117 WeakPolarHBondContact O-CB 3.49Å; R114-A117 PolarHBondContact O-N 2.85Å; A117-E119 PolarHBondContact O-N 3.25Å; A117-G122 WeakPolarHBondContact CB-O 3.44Å; A117-A123 CarbonylContact C-O 3.5Å; A117-A123 WeakPolarHBondContact CA-O 3.45Å; A117-A123 WeakPolarHBondContact CB-O 3.33Å; A117-L124 HydrophobicContact CB-CD2 3.79Å; A117-L124 HydrophobicContact CB-CG 4.26Å
118	C	91.3	Very high	87	Confident	3 Å²	3	66 Å²	66	2%	0.02	35%	0.346	C	S	.	.			trans	-52.1	127.3	174.4	176.5	0	0	0	0	111	N120 C121 G122 A123 K128	C118-N120 PolarHBondContact O-N 2.94Å; C118-N120 VanDerWaalsContact O-N 3.15Å; C118-N120 PolarHBondContact SG-N 3.41Å; C118-C121 VanDerWaalsContact SG-SG 3.62Å; C118-G122 WeakPolarHBondContact O-CA 3.48Å; C118-G122 PolarHBondContact O-N 2.91Å; C118-A123 WeakPolarHBondContact CB-O 3.5Å; C118-A123 PolarHBondContact N-O 2.83Å; C118-K128 VanDerWaalsContact SG-CA 3.59Å
119	E	90.1	Very high	88.1	Confident	66 Å²	66	73 Å²	73	31%	0.308	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.2	-176.7	-46.4	-173.2	133.7	0	0	113.2	A117 K128 G139 A140 K141	A117-E119 PolarHBondContact O-N 3.25Å; E119-K128 HydrophobicContact CB-CD 4.24Å; E119-K128 IonicContact OE2-NZ 3.7Å; E119-G139 CarbonylContact O-C 3.56Å; E119-G139 WeakPolarHBondContact O-CA 3.32Å; E119-A140 PolarHBondContact O-N 2.9Å; E119-K141 HydrophobicContact CB-CB 4.09Å; E119-K141 HydrophobicContact CB-CD 4.11Å; E119-K141 HydrophobicContact CG-CD 3.93Å; E119-K141 PolarHBondContact O-N 2.86Å; E119-K141 IonicContact OE1-NZ 3.43Å; E119-K141 PolarHBondContact OE1-NZ 3.36Å
120	N	90.9	Very high	88.8	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.027	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-59.2	-179.7	-170.7	38	0	0	0	112.4	C118 K128 E133 R134 R136 A140	C118-N120 PolarHBondContact O-N 2.94Å; C118-N120 VanDerWaalsContact O-N 3.15Å; C118-N120 PolarHBondContact SG-N 3.41Å; N120-K128 HydrophobicContact CB-CG 4.3Å; N120-E133 PolarHBondContact ND2-O 3.36Å; N120-R134 PolarHBondContact ND2-O 2.81Å; N120-R134 VanDerWaalsContact ND2-O 3.07Å; N120-R136 VanDerWaalsContact OD1-CB 3.28Å; N120-R136 WeakPolarHBondContact OD1-CB 3.32Å; N120-R136 VanDerWaalsContact OD1-CG 3.3Å; N120-R136 WeakPolarHBondContact OD1-CG 3.21Å; N120-R136 PolarHBondContact OD1-N 3.31Å; N120-A140 WeakPolarHBondContact O-CB 3.34Å; N120-A140 PolarHBondContact O-N 3.31Å
121	C	87.8	Confident	89.4	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-21.2	-172.2	64.6	0	0	0	0	114.6	C118 H126 E133 I147 A148	C118-C121 VanDerWaalsContact SG-SG 3.62Å; C121-H126 PolarHBondContact SG-NE2 2.95Å; C121-E133 HydrophobicContact CB-CB 4.18Å; C121-E133 VanDerWaalsContact CB-CD 3.41Å; C121-E133 HydrophobicContact CB-CG 3.91Å; C121-E133 WeakPolarHBondContact CB-OE2 3.46Å; C121-I147 WeakPolarHBondContact O-CA 3.34Å; C121-A148 HydrophobicContact CB-CB 3.99Å; C121-A148 PolarHBondContact O-N 2.77Å
122	G	88.2	Confident	89.7	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	38%	0.376	C	S	.	.			trans	86	7.4	-179.6	0	0	0	0	0	116.7	A117 C118	A117-G122 WeakPolarHBondContact CB-O 3.44Å; C118-G122 WeakPolarHBondContact O-CA 3.48Å; C118-G122 PolarHBondContact O-N 2.91Å
123	A	90.3	Very high	89.9	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.357	C	S	.	.			trans	-77	147.4	170.2	0	0	0	0	0	112.1	A117 C118 A148 D150	A117-A123 CarbonylContact C-O 3.5Å; A117-A123 WeakPolarHBondContact CA-O 3.45Å; A117-A123 WeakPolarHBondContact CB-O 3.33Å; C118-A123 WeakPolarHBondContact CB-O 3.5Å; C118-A123 PolarHBondContact N-O 2.83Å; A123-A148 HydrophobicContact CB-CB 4.4Å; A123-D150 WeakPolarHBondContact CA-OD1 3.38Å
124	L	89.1	Confident	90	Very high	76 Å²	76	79.9 Å²	79.9	40%	0.398	39%	0.385	S	S	.	.	S	Bend	trans	-86	-17.8	-178.2	-79.8	176.8	0	0	0	114.8	R114 A117 D150	R114-L124 HydrophobicContact CB-CD2 4.17Å; R114-L124 HydrophobicContact CB-CG 4.45Å; A117-L124 HydrophobicContact CB-CD2 3.79Å; A117-L124 HydrophobicContact CB-CG 4.26Å; L124-D150 PolarHBondContact N-OD1 2.89Å
125	T	89.4	Confident	90.2	Very high	63 Å²	63	81.7 Å²	81.7	39%	0.387	41%	0.406	S	S	.	.	S	Bend	trans	-79.5	-21.5	-166.9	34.2	0	0	0	0	114.4	D150 E151	T125-D150 HydrophobicContact CG2-CB 4.4Å; T125-E151 WeakPolarHBondContact CB-OE2 3.25Å; T125-E151 HydrophobicContact CG2-CB 4.22Å; T125-E151 WeakPolarHBondContact CG2-O 3.38Å; T125-E151 VanDerWaalsContact OG1-CD 3.24Å; T125-E151 PolarHBondContact OG1-N 2.78Å; T125-E151 PolarHBondContact OG1-OE2 3.24Å
126	H	89.6	Confident	90.2	Very high	29 Å²	29	75.5 Å²	75.5	13%	0.134	38%	0.377	C	S	.	.	S	Bend	trans	-138.9	165.4	-177.9	63.8	-96.6	0	0	0	113.1	C121 C131 E151	C121-H126 PolarHBondContact SG-NE2 2.95Å; H126-C131 VanDerWaalsContact CD2-CA 3.5Å; H126-C131 WeakPolarHBondContact CD2-CA 3.33Å; H126-C131 PolarHBondContact NE2-SG 3.29Å; H126-C131 VanDerWaalsContact NE2-SG 3.36Å; H126-E151 IonicContact CE1-OE1 3.4Å; H126-E151 PolarHBondContact CE1-OE1 3.5Å; H126-E151 IonicContact CE1-OE2 3.09Å; H126-E151 IonicContact CG-OE2 3.42Å; H126-E151 IonicContact ND1-OE1 3.54Å; H126-E151 PolarHBondContact ND1-OE1 3.21Å; H126-E151 VanDerWaalsContact ND1-OE1 3.09Å; H126-E151 IonicContact ND1-OE2 2.89Å; H126-E151 PolarHBondContact ND1-OE2 2.89Å
127	K	92.4	Very high	90.3	Very high	162 Å²	162	82.5 Å²	82.5	70%	0.704	39%	0.388	S	S	*	.			trans	-92.8	162.4	176.7	-66.2	178.2	-177.4	173.5	0	111	K129 D130 C131	K127-K129 PolarHBondContact O-N 2.68Å; K127-D130 CarbonylContact O-C 3.53Å; K127-D130 PolarHBondContact O-N 2.97Å; K127-C131 PolarHBondContact O-N 3.18Å
128	K	91.2	Very high	90.1	Very high	118 Å²	118	86.3 Å²	86.3	51%	0.513	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-51.5	-34.7	179.4	-172	-176.6	-174	174.1	0	114.8	C118 E119 N120 C131	C118-K128 VanDerWaalsContact SG-CA 3.59Å; E119-K128 HydrophobicContact CB-CD 4.24Å; E119-K128 IonicContact OE2-NZ 3.7Å; N120-K128 HydrophobicContact CB-CG 4.3Å; K128-C131 WeakPolarHBondContact O-CB 3.46Å
129	K	92.1	Very high	90	Very high	199 Å²	199	86.4 Å²	86.4	87%	0.865	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-70.1	-33.8	-178.7	-65.9	-175.2	178.9	-176	0	112.8	K127 C131	K127-K129 PolarHBondContact O-N 2.68Å; K129-C131 VanDerWaalsContact C-N 3.35Å
130	D	91.4	Very high	90	Very high	117 Å²	117	83.3 Å²	83.3	63%	0.626	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-102.8	22.5	-176.8	-48.1	-52.6	0	0	0	111	K127	K127-D130 CarbonylContact O-C 3.53Å; K127-D130 PolarHBondContact O-N 2.97Å
131	C	91.6	Very high	89.9	Confident	24 Å²	24	86.9 Å²	86.9	16%	0.162	41%	0.413	C	S	.	.			trans	-74.8	127.6	-176.7	-171.2	0	0	0	0	110.8	H126 K127 K128 K129 E133	H126-C131 VanDerWaalsContact CD2-CA 3.5Å; H126-C131 WeakPolarHBondContact CD2-CA 3.33Å; H126-C131 PolarHBondContact NE2-SG 3.29Å; H126-C131 VanDerWaalsContact NE2-SG 3.36Å; K127-C131 PolarHBondContact O-N 3.18Å; K128-C131 WeakPolarHBondContact O-CB 3.46Å; K129-C131 VanDerWaalsContact C-N 3.35Å; C131-E133 VanDerWaalsContact C-N 3.29Å
132	M	89.1	Confident	89.8	Confident	169 Å²	169	95.1 Å²	95.1	83%	0.833	45%	0.445	S	S	*	.	S	Bend	trans	-77.1	-16.7	178.2	-62.2	-173.8	179.8	0	0	112.9
133	E	89.4	Confident	89.7	Confident	67 Å²	67	98.3 Å²	98.3	31%	0.313	47%	0.465	S	S	.	.	S	Bend	trans	-84.4	150.3	175.4	-67.4	-162.7	164.2	0	0	112.3	N120 C121 C131 R136 A148	N120-E133 PolarHBondContact ND2-O 3.36Å; C121-E133 HydrophobicContact CB-CB 4.18Å; C121-E133 VanDerWaalsContact CB-CD 3.41Å; C121-E133 HydrophobicContact CB-CG 3.91Å; C121-E133 WeakPolarHBondContact CB-OE2 3.46Å; C131-E133 VanDerWaalsContact C-N 3.29Å; E133-R136 IonicContact OE1-NH2 3.03Å; E133-R136 IonicContact OE2-CZ 3.82Å; E133-R136 IonicContact OE2-NE 2.66Å; E133-R136 IonicContact OE2-NH2 2.86Å; E133-R136 PolarHBondContact OE2-NH2 3.07Å; E133-A148 WeakPolarHBondContact OE1-CB 3.42Å
134	R	91.6	Very high	89.3	Confident	221 Å²	221	99.8 Å²	99.8	83%	0.834	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-51.9	131.2	175	-176.4	170.6	171.6	-118.9	0.4	111	N120 R136	N120-R134 PolarHBondContact ND2-O 2.81Å; N120-R134 VanDerWaalsContact ND2-O 3.07Å; R134-R136 PolarHBondContact O-N 3.36Å; R134-R136 VanDerWaalsContact O-N 3.16Å
135	P	92.3	Very high	89	Confident	114 Å²	114	102.2 Å²	102.2	74%	0.74	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-57.5	119.1	176.2	-27.7	35.8	0	0	0	112.3
136	R	89.1	Confident	88.7	Confident	76 Å²	76	105.4 Å²	105.4	29%	0.287	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-91.2	142.8	178.6	-54.8	176.9	-167.3	-176.1	2.3	109.8	N120 E133 R134 V138 M145 N146	N120-R136 VanDerWaalsContact OD1-CB 3.28Å; N120-R136 WeakPolarHBondContact OD1-CB 3.32Å; N120-R136 VanDerWaalsContact OD1-CG 3.3Å; N120-R136 WeakPolarHBondContact OD1-CG 3.21Å; N120-R136 PolarHBondContact OD1-N 3.31Å; E133-R136 IonicContact OE1-NH2 3.03Å; E133-R136 IonicContact OE2-CZ 3.82Å; E133-R136 IonicContact OE2-NE 2.66Å; E133-R136 IonicContact OE2-NH2 2.86Å; E133-R136 PolarHBondContact OE2-NH2 3.07Å; R134-R136 PolarHBondContact O-N 3.36Å; R134-R136 VanDerWaalsContact O-N 3.16Å; R136-V138 PolarHBondContact O-N 3.39Å; R136-M145 PolarHBondContact NH1-O 3.16Å; R136-N146 PolarHBondContact NH1-O 3Å; R136-N146 PolarHBondContact NH2-O 3.34Å
137	K	88.4	Confident	88.7	Confident	218 Å²	218	105 Å²	105	95%	0.948	50%	0.504	S	S	*	.	S	Bend	trans	-64.1	-40.1	-178.2	-170.7	176.9	-178.4	-178.5	0	113.1
138	V	87.6	Confident	88.5	Confident	85 Å²	85	97.7 Å²	97.7	52%	0.515	47%	0.474	S	S	.	.	S	Bend	trans	-99.7	-38.2	179.2	-172.5	0	0	0	0	110.9	R136 Y142 T143	R136-V138 PolarHBondContact O-N 3.39Å; V138-Y142 VanDerWaalsContact O-CD2 3.26Å; V138-Y142 WeakPolarHBondContact O-CD2 3.49Å; V138-T143 HydrophobicContact CB-CG2 3.95Å; V138-T143 HydrophobicContact CG1-CG2 3.53Å
139	G	88.8	Confident	88.4	Confident	6 Å²	6	93.7 Å²	93.7	6%	0.062	46%	0.46	C	S	.	.			trans	78.7	153.8	177.5	0	0	0	0	0	114.1	E119 K141 Y142 T143	E119-G139 CarbonylContact O-C 3.56Å; E119-G139 WeakPolarHBondContact O-CA 3.32Å; G139-K141 PolarHBondContact O-N 3.41Å; G139-Y142 PolarHBondContact O-N 3.42Å; G139-T143 PolarHBondContact O-N 3.32Å; G139-T143 PolarHBondContact O-OG1 3.44Å
140	A	89.3	Confident	88.3	Confident	0 Å²	0	85 Å²	85	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-61.4	-22.6	-177.2	0	0	0	0	0	114.2	E119 N120 Y142 G144 I147	E119-A140 PolarHBondContact O-N 2.9Å; N120-A140 WeakPolarHBondContact O-CB 3.34Å; N120-A140 PolarHBondContact O-N 3.31Å; A140-Y142 VanDerWaalsContact C-N 3.31Å; A140-Y142 PolarHBondContact O-N 3.29Å; A140-G144 WeakPolarHBondContact O-CA 3.34Å; A140-G144 PolarHBondContact O-N 2.71Å; A140-I147 HydrophobicContact CB-CD1 3.93Å
141	K	88.4	Confident	88.1	Confident	81 Å²	81	81.6 Å²	81.6	35%	0.352	40%	0.403	S	S	.	.	H	α-helix	trans	-60.1	-37.9	178	-175.2	178.5	-172.8	-177.7	0	113.3	Y113 E119 G139	Y113-K141 HydrophobicContact CD1-CG 4.4Å; Y113-K141 HydrophobicContact CD2-CB 4.47Å; Y113-K141 HydrophobicContact CE1-CB 4.37Å; Y113-K141 HydrophobicContact CE1-CG 3.84Å; Y113-K141 HydrophobicContact CE2-CB 4.1Å; Y113-K141 HydrophobicContact CE2-CG 4.41Å; E119-K141 HydrophobicContact CB-CB 4.09Å; E119-K141 HydrophobicContact CB-CD 4.11Å; E119-K141 HydrophobicContact CG-CD 3.93Å; E119-K141 PolarHBondContact O-N 2.86Å; E119-K141 IonicContact OE1-NZ 3.43Å; E119-K141 PolarHBondContact OE1-NZ 3.36Å; G139-K141 PolarHBondContact O-N 3.41Å
142	Y	87.5	Confident	87.9	Confident	173 Å²	173	82.9 Å²	82.9	68%	0.678	41%	0.407	S	S	*	.	H	α-helix	trans	-102.6	-29.4	-174.7	-56.1	-81.7	0	0	0	112.7	V138 G139 A140	V138-Y142 VanDerWaalsContact O-CD2 3.26Å; V138-Y142 WeakPolarHBondContact O-CD2 3.49Å; G139-Y142 PolarHBondContact O-N 3.42Å; A140-Y142 VanDerWaalsContact C-N 3.31Å; A140-Y142 PolarHBondContact O-N 3.29Å
143	T	85.5	Confident	87.9	Confident	66 Å²	66	80.8 Å²	80.8	41%	0.405	40%	0.403	S	S	.	.	H	α-helix	trans	-92.1	-27.9	179	60.5	0	0	0	0	113.5	V138 G139 M145	V138-T143 HydrophobicContact CB-CG2 3.95Å; V138-T143 HydrophobicContact CG1-CG2 3.53Å; G139-T143 PolarHBondContact O-N 3.32Å; G139-T143 PolarHBondContact O-OG1 3.44Å; T143-M145 WeakPolarHBondContact O-CG 3.42Å; T143-M145 PolarHBondContact O-N 2.9Å; T143-M145 VanDerWaalsContact O-N 3.09Å
144	G	82.6	Confident	87.9	Confident	31 Å²	31	81.6 Å²	81.6	32%	0.32	41%	0.407	S	S	.	.			trans	63.1	9	-174.4	0	0	0	0	0	114.7	A140	A140-G144 WeakPolarHBondContact O-CA 3.34Å; A140-G144 PolarHBondContact O-N 2.71Å
145	M	81.7	Confident	87.9	Confident	128 Å²	128	73.7 Å²	73.7	63%	0.631	39%	0.385	S	S	*	.			trans	-98.1	145.3	-176.9	-60.5	179.7	83.1	0	0	111.1	R136 T143	R136-M145 PolarHBondContact NH1-O 3.16Å; T143-M145 WeakPolarHBondContact O-CG 3.42Å; T143-M145 PolarHBondContact O-N 2.9Å; T143-M145 VanDerWaalsContact O-N 3.09Å
146	N	84	Confident	87.8	Confident	130 Å²	130	76 Å²	76	70%	0.695	39%	0.385	S	S	*	.	S	Bend	trans	52.4	67	178.4	-59	-25.7	0	0	0	112.1	R136	R136-N146 PolarHBondContact NH1-O 3Å; R136-N146 PolarHBondContact NH2-O 3.34Å
147	I	88.7	Confident	87.9	Confident	19 Å²	19	73.3 Å²	73.3	10%	0.097	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-78.6	126.2	174.4	-56.6	-62.9	0	0	0	109	A110 C121 A140	A110-I147 HydrophobicContact CB-CG2 4.39Å; A110-I147 VanDerWaalsContact O-CB 3.22Å; A110-I147 WeakPolarHBondContact O-CB 3.3Å; A110-I147 VanDerWaalsContact O-CG2 3.31Å; A110-I147 WeakPolarHBondContact O-CG2 3.28Å; C121-I147 WeakPolarHBondContact O-CA 3.34Å; A140-I147 HydrophobicContact CB-CD1 3.93Å
148	A	87.8	Confident	88.1	Confident	9 Å²	9	67.2 Å²	67.2	7%	0.074	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-70.4	146	175.5	0	0	0	0	0	111.4	C121 A123 E133	C121-A148 HydrophobicContact CB-CB 3.99Å; C121-A148 PolarHBondContact O-N 2.77Å; A123-A148 HydrophobicContact CB-CB 4.4Å; E133-A148 WeakPolarHBondContact OE1-CB 3.42Å
149	P	89.8	Confident	88.4	Confident	34 Å²	34	64.1 Å²	64.1	22%	0.221	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-60.4	150.4	166.7	24.5	-31.3	0	0	0	110.9	V104 Q105 V109	V104-P149 HydrophobicContact CB-CB 4.14Å; V104-P149 HydrophobicContact CB-CG 3.78Å; V104-P149 HydrophobicContact CG1-CG 4.17Å; V104-P149 HydrophobicContact CG2-CB 4.32Å; V104-P149 HydrophobicContact CG2-CG 3.7Å; Q105-P149 WeakPolarHBondContact O-CB 3.38Å; V109-P149 HydrophobicContact CG2-CB 4.23Å
150	D	89	Confident	88.7	Confident	17 Å²	17	67.8 Å²	67.8	9%	0.091	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-71.9	144.2	176.2	-68.4	-32.3	0	0	0	110.7	Q105 R114 A123 L124 T125	Q105-D150 WeakPolarHBondContact CB-O 3.28Å; Q105-D150 PolarHBondContact N-O 2.91Å; R114-D150 IonicContact CZ-OD2 2.83Å; R114-D150 IonicContact NH1-OD2 3.03Å; R114-D150 PolarHBondContact NH1-OD2 3.42Å; R114-D150 VanDerWaalsContact NH2-CG 3.28Å; R114-D150 IonicContact NH2-OD1 3.55Å; R114-D150 PolarHBondContact NH2-OD1 3.23Å; R114-D150 IonicContact NH2-OD2 3.73Å; R114-D150 PolarHBondContact NH2-OD2 3.39Å; A123-D150 WeakPolarHBondContact CA-OD1 3.38Å; L124-D150 PolarHBondContact N-OD1 2.89Å; T125-D150 HydrophobicContact CG2-CB 4.4Å
151	E	88.4	Confident	89	Confident	45 Å²	45	74.9 Å²	74.9	21%	0.21	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-77.1	164	175.8	-64	108.9	-159.1	0	0	112.1	T125 H126	T125-E151 WeakPolarHBondContact CB-OE2 3.25Å; T125-E151 HydrophobicContact CG2-CB 4.22Å; T125-E151 WeakPolarHBondContact CG2-O 3.38Å; T125-E151 VanDerWaalsContact OG1-CD 3.24Å; T125-E151 PolarHBondContact OG1-N 2.78Å; T125-E151 PolarHBondContact OG1-OE2 3.24Å; H126-E151 IonicContact CE1-OE1 3.4Å; H126-E151 PolarHBondContact CE1-OE1 3.5Å; H126-E151 IonicContact CE1-OE2 3.09Å; H126-E151 IonicContact CG-OE2 3.42Å; H126-E151 IonicContact ND1-OE1 3.54Å; H126-E151 PolarHBondContact ND1-OE1 3.21Å; H126-E151 VanDerWaalsContact ND1-OE1 3.09Å; H126-E151 IonicContact ND1-OE2 2.89Å; H126-E151 PolarHBondContact ND1-OE2 2.89Å
152	H	88.3	Confident	89.3	Confident	51 Å²	51	76.9 Å²	76.9	24%	0.236	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-72.8	136.9	175.4	-70.5	-160.7	0	0	0	110.7	K101 Q105 Q154	K101-H152 HydrophobicContact CB-CB 3.92Å; K101-H152 VanDerWaalsContact CB-ND1 3.34Å; K101-H152 WeakPolarHBondContact CB-ND1 3.36Å; Q105-H152 WeakPolarHBondContact CG-CD2 3.39Å; Q105-H152 WeakPolarHBondContact CG-NE2 3.35Å; H152-Q154 PolarHBondContact O-N 3.33Å; H152-Q154 PolarHBondContact O-NE2 3.11Å
153	V	87.5	Confident	89.6	Confident	125 Å²	125	69.7 Å²	69.7	76%	0.758	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-65.5	121.7	167.6	-178.5	0	0	0	0	108.6
154	Q	89.9	Confident	90	Very high	85 Å²	85	72.5 Å²	72.5	40%	0.397	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-83.6	129.6	-176.4	-61.7	-57	-30.8	0	0	110.9	Y100 K101 H152	Y100-Q154 HydrophobicContact CD1-CB 4.13Å; Y100-Q154 HydrophobicContact CD1-CG 4.49Å; K101-Q154 PolarHBondContact O-NE2 3.33Å; H152-Q154 PolarHBondContact O-N 3.33Å; H152-Q154 PolarHBondContact O-NE2 3.11Å
155	P	91.8	Very high	90.6	Very high	55 Å²	55	78.8 Å²	78.8	36%	0.357	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-68.8	149.8	171.7	28	-31.8	0	0	0	110.7	Y100 L157	Y100-P155 WeakPolarHBondContact CE1-O 3.47Å; P155-L157 HydrophobicContact CB-CD2 4.03Å; P155-L157 HydrophobicContact CB-CG 4.25Å; P155-L157 HydrophobicContact CG-CD1 4.1Å; P155-L157 HydrophobicContact CG-CD2 3.9Å; P155-L157 HydrophobicContact CG-CG 3.89Å; P155-L157 PolarHBondContact O-N 3.27Å; P155-L157 VanDerWaalsContact O-N 3.11Å
156	Q	89.2	Confident	91.3	Very high	162 Å²	162	76.1 Å²	76.1	76%	0.757	38%	0.38	S	S	*	.			trans	-79.7	92.7	170.9	-176	62.6	27.6	0	0	109
157	L	92.3	Very high	91.8	Very high	19 Å²	19	80.1 Å²	80.1	10%	0.099	39%	0.385	C	S	.	.			trans	-89.6	132.2	-180	-56.9	172.6	0	0	0	110.2	S94 Y100 P155 F159	S94-L157 WeakPolarHBondContact OG-CD2 3.08Å; Y100-L157 HydrophobicContact CD1-CD1 4.18Å; Y100-L157 HydrophobicContact CD2-CD1 4.34Å; Y100-L157 HydrophobicContact CE1-CB 4.47Å; Y100-L157 HydrophobicContact CE1-CD1 4.21Å; Y100-L157 HydrophobicContact CE1-CG 4.35Å; Y100-L157 HydrophobicContact CE2-CD1 4.35Å; Y100-L157 HydrophobicContact CG-CD1 4.26Å; P155-L157 HydrophobicContact CB-CD2 4.03Å; P155-L157 HydrophobicContact CB-CG 4.25Å; P155-L157 HydrophobicContact CG-CD1 4.1Å; P155-L157 HydrophobicContact CG-CD2 3.9Å; P155-L157 HydrophobicContact CG-CG 3.89Å; P155-L157 PolarHBondContact O-N 3.27Å; P155-L157 VanDerWaalsContact O-N 3.11Å; L157-F159 HydrophobicContact CB-CD2 4.3Å; L157-F159 HydrophobicContact CB-CE2 3.48Å; L157-F159 VanDerWaalsContact CB-CE2 3.48Å; L157-F159 HydrophobicContact CB-CZ 3.7Å; L157-F159 HydrophobicContact CD1-CE2 4.15Å; L157-F159 HydrophobicContact CD1-CZ 3.86Å; L157-F159 HydrophobicContact CG-CE2 4.44Å; L157-F159 HydrophobicContact CG-CZ 4.3Å
158	M	93.1	Very high	92.1	Very high	91 Å²	91	86.4 Å²	86.4	45%	0.448	41%	0.408	S	S	.	.			trans	-116.2	119.9	176.6	-65.8	-66.5	-78.1	0	0	107.6	Y93 S94	Y93-M158 CarbonylContact C-O 3.4Å; Y93-M158 VanDerWaalsContact CA-O 3.23Å; Y93-M158 WeakPolarHBondContact CA-O 3.17Å; S94-M158 PolarHBondContact N-O 2.97Å; S94-M158 PolarHBondContact OG-N 3.45Å
159	F	93.9	Very high	92.4	Very high	20 Å²	20	87.7 Å²	87.7	9%	0.088	41%	0.414	C	S	.	.			trans	-119.8	163.2	177.9	-55.1	-80.5	0	0	0	111	S94 D98 W99 L157 K164	S94-F159 VanDerWaalsContact CB-CE1 3.46Å; D98-F159 WeakPolarHBondContact O-CE1 3.39Å; D98-F159 WeakPolarHBondContact O-CZ 3.26Å; W99-F159 AromaticContact CE3-CE2 3.85Å; W99-F159 HydrophobicContact CE3-CE2 3.85Å; W99-F159 AromaticContact CE3-CZ 3.83Å; W99-F159 HydrophobicContact CE3-CZ 3.83Å; W99-F159 HydrophobicContact CZ3-CD2 4.34Å; W99-F159 AromaticContact CZ3-CE2 3.63Å; W99-F159 HydrophobicContact CZ3-CE2 3.63Å; W99-F159 HydrophobicContact CZ3-CZ 4.06Å; L157-F159 HydrophobicContact CB-CD2 4.3Å; L157-F159 HydrophobicContact CB-CE2 3.48Å; L157-F159 VanDerWaalsContact CB-CE2 3.48Å; L157-F159 HydrophobicContact CB-CZ 3.7Å; L157-F159 HydrophobicContact CD1-CE2 4.15Å; L157-F159 HydrophobicContact CD1-CZ 3.86Å; L157-F159 HydrophobicContact CG-CE2 4.44Å; L157-F159 HydrophobicContact CG-CZ 4.3Å; F159-K164 HydrophobicContact CB-CG 3.83Å; F159-K164 HydrophobicContact CD2-CG 4.43Å; F159-K164 WeakPolarHBondContact O-CE 3.34Å
160	D	94.4	Very high	92.6	Very high	82 Å²	82	88.5 Å²	88.5	44%	0.439	43%	0.428	S	S	.	.			trans	-63.3	173.4	164.9	-73	-50.1	0	0	0	112.4	Y93 D162 G163 K164	Y93-D160 WeakPolarHBondContact CE2-OD1 3.45Å; Y93-D160 PolarHBondContact OH-OD1 3.43Å; Y93-D160 VanDerWaalsContact OH-OD1 3.14Å; D160-D162 VanDerWaalsContact C-N 3.34Å; D160-D162 PolarHBondContact O-N 3.43Å; D160-G163 PolarHBondContact O-N 3.29Å; D160-K164 WeakPolarHBondContact O-CG 3.26Å; D160-K164 PolarHBondContact O-N 3.19Å
161	Y	94.8	Very high	92.9	Very high	149 Å²	149	91.5 Å²	91.5	58%	0.584	44%	0.439	S	S	*	.	H	α-helix	trans	-56.3	-48.5	176.5	176.2	-85.2	0	0	0	111.9	K164 R165	Y161-K164 PolarHBondContact O-N 2.07Å; Y161-R165 WeakPolarHBondContact O-CD 3.46Å; Y161-R165 WeakPolarHBondContact O-CG 3.49Å; Y161-R165 PolarHBondContact O-N 3.28Å; Y161-R165 PolarHBondContact OH-NE 3.17Å; Y161-R165 PolarHBondContact OH-NH1 3.49Å
162	D	94.9	Very high	93.1	Very high	124 Å²	124	93.4 Å²	93.4	66%	0.663	45%	0.451	S	S	*	.	H	α-helix	trans	-67.4	-44.7	178.9	-65	-24.6	0	0	0	110.5	D160 K164 R165 D166	D160-D162 VanDerWaalsContact C-N 3.34Å; D160-D162 PolarHBondContact O-N 3.43Å; D162-K164 VanDerWaalsContact C-N 3.3Å; D162-K164 PolarHBondContact O-N 3.13Å; D162-R165 CarbonylContact O-C 3.57Å; D162-R165 PolarHBondContact O-N 3.47Å; D162-D166 PolarHBondContact O-N 3.39Å
163	G	93.8	Very high	93.4	Very high	22 Å²	22	95.5 Å²	95.5	23%	0.227	47%	0.468	C	S	.	.	H	α-helix	trans	-59.4	-35.6	178.2	0	0	0	0	0	113.5	D160 R165 N169	D160-G163 PolarHBondContact O-N 3.29Å; G163-R165 VanDerWaalsContact C-N 3.34Å; G163-N169 PolarHBondContact O-ND2 3.46Å
164	K	94.5	Very high	93.7	Very high	125 Å²	125	95.9 Å²	95.9	54%	0.543	46%	0.462	S	S	.	.	H	α-helix	trans	-70.7	-29.1	174.1	-70.1	-175	-177.8	175.7	0	113.6	F159 D160 Y161 D162	F159-K164 HydrophobicContact CB-CG 3.83Å; F159-K164 HydrophobicContact CD2-CG 4.43Å; F159-K164 WeakPolarHBondContact O-CE 3.34Å; D160-K164 WeakPolarHBondContact O-CG 3.26Å; D160-K164 PolarHBondContact O-N 3.19Å; Y161-K164 PolarHBondContact O-N 2.07Å; D162-K164 VanDerWaalsContact C-N 3.3Å; D162-K164 PolarHBondContact O-N 3.13Å
165	R	94.6	Very high	93.9	Very high	163 Å²	163	96.4 Å²	96.4	62%	0.615	47%	0.465	S	S	*	.	H	α-helix	trans	-104.3	-0.4	-170.7	-68.8	152.6	110.8	114.9	161.1	112.5	Y161 D162 G163 R167	Y161-R165 WeakPolarHBondContact O-CD 3.46Å; Y161-R165 WeakPolarHBondContact O-CG 3.49Å; Y161-R165 PolarHBondContact O-N 3.28Å; Y161-R165 PolarHBondContact OH-NE 3.17Å; Y161-R165 PolarHBondContact OH-NH1 3.49Å; D162-R165 CarbonylContact O-C 3.57Å; D162-R165 PolarHBondContact O-N 3.47Å; G163-R165 VanDerWaalsContact C-N 3.34Å; R165-R167 PolarHBondContact O-N 3.39Å; R165-R167 VanDerWaalsContact O-N 3.16Å
166	D	96.1	Very high	94.1	Very high	71 Å²	71	98.5 Å²	98.5	38%	0.38	47%	0.469	S	S	.	.			trans	-61.2	119.6	174.8	-171.3	1.2	0	0	0	109.6	D162 W168 N169	D162-D166 PolarHBondContact O-N 3.39Å; D166-W168 PolarHBondContact O-N 2.99Å; D166-W168 PolarHBondContact OD1-N 3.32Å; D166-N169 PolarHBondContact O-N 3.04Å; D166-N169 PolarHBondContact O-ND2 2.92Å; D166-N169 VanDerWaalsContact O-ND2 3.13Å
167	R	95.4	Very high	94.4	Very high	214 Å²	214	95.4 Å²	95.4	81%	0.808	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.9	179.1	-178.8	178.7	173.5	-173.3	-2.7	111.1	R165 N169	R165-R167 PolarHBondContact O-N 3.39Å; R165-R167 VanDerWaalsContact O-N 3.16Å; R167-N169 VanDerWaalsContact C-N 3.34Å
168	W	95.4	Very high	94.6	Very high	152 Å²	152	100.3 Å²	100.3	58%	0.576	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	16.9	-174.8	-59	104.4	0	0	0	113.2	D166 G170 Y171	D166-W168 PolarHBondContact O-N 2.99Å; D166-W168 PolarHBondContact OD1-N 3.32Å; W168-G170 PolarHBondContact O-N 2.77Å; W168-Y171 AromaticContact CE3-CD2 3.77Å; W168-Y171 HydrophobicContact CE3-CD2 3.77Å; W168-Y171 HydrophobicContact CE3-CE2 4.22Å; W168-Y171 HydrophobicContact CE3-CG 4.11Å; W168-Y171 HydrophobicContact CZ3-CD2 4.01Å; W168-Y171 HydrophobicContact CZ3-CE2 4.04Å; W168-Y171 WeakPolarHBondContact O-CB 3.48Å; W168-Y171 PolarHBondContact O-N 3.09Å
169	N	94.5	Very high	94.8	Very high	36 Å²	36	99.3 Å²	99.3	19%	0.193	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	121.7	174.3	-84.9	-29.8	0	0	0	112.7	W99 G163 D166 R167 Y171	W99-N169 HydrophobicContact CD2-CB 3.83Å; W99-N169 HydrophobicContact CE3-CB 3.86Å; W99-N169 HydrophobicContact CH2-CB 3.87Å; W99-N169 HydrophobicContact CZ2-CB 3.81Å; W99-N169 HydrophobicContact CZ3-CB 3.88Å; W99-N169 PolarHBondContact NE1-O 3.2Å; G163-N169 PolarHBondContact O-ND2 3.46Å; D166-N169 PolarHBondContact O-N 3.04Å; D166-N169 PolarHBondContact O-ND2 2.92Å; D166-N169 VanDerWaalsContact O-ND2 3.13Å; R167-N169 VanDerWaalsContact C-N 3.34Å; N169-Y171 VanDerWaalsContact C-N 3.34Å
170	G	92.7	Very high	95	Very high	51 Å²	51	101.6 Å²	101.6	53%	0.526	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	17.9	-175.9	0	0	0	0	0	114.1	W168 N172	W168-G170 PolarHBondContact O-N 2.77Å; G170-N172 PolarHBondContact O-N 3.28Å
171	Y	94.9	Very high	95.1	Very high	80 Å²	80	102.7 Å²	102.7	31%	0.314	49%	0.49	S	S	.	.			trans	-64.7	128.1	171.3	-178.4	-109.2	0	0	0	110.4	W168 N169 P173 E175 H176	W168-Y171 AromaticContact CE3-CD2 3.77Å; W168-Y171 HydrophobicContact CE3-CD2 3.77Å; W168-Y171 HydrophobicContact CE3-CE2 4.22Å; W168-Y171 HydrophobicContact CE3-CG 4.11Å; W168-Y171 HydrophobicContact CZ3-CD2 4.01Å; W168-Y171 HydrophobicContact CZ3-CE2 4.04Å; W168-Y171 WeakPolarHBondContact O-CB 3.48Å; W168-Y171 PolarHBondContact O-N 3.09Å; N169-Y171 VanDerWaalsContact C-N 3.34Å; Y171-P173 WeakPolarHBondContact O-CD 3.15Å; Y171-E175 HydrophobicContact CE2-CB 4.21Å; Y171-H176 WeakPolarHBondContact OH-CA 3.4Å; Y171-H176 WeakPolarHBondContact OH-CB 3.3Å; Y171-H176 PolarHBondContact OH-N 3.15Å; Y171-H176 VanDerWaalsContact OH-N 3.17Å
172	N	92.9	Very high	95.2	Very high	85 Å²	85	101.2 Å²	101.2	46%	0.455	49%	0.488	S	S	.	.			trans	-88.3	117.2	172.6	-176.7	2.8	0	0	0	108.9	G170 E174 E175	G170-N172 PolarHBondContact O-N 3.28Å; N172-E174 PolarHBondContact O-N 3.16Å; N172-E174 PolarHBondContact OD1-N 3.35Å; N172-E175 HydrophobicContact CB-CG 4.28Å; N172-E175 WeakPolarHBondContact O-CB 3.38Å; N172-E175 PolarHBondContact O-N 3.21Å
173	P	94.5	Very high	95.3	Very high	94 Å²	94	102.5 Å²	102.5	61%	0.61	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-55.5	-26.1	179.7	-26.6	36.1	0	0	0	114	Y171 E175 H176	Y171-P173 WeakPolarHBondContact O-CD 3.15Å; P173-E175 PolarHBondContact O-N 3.25Å; P173-H176 WeakPolarHBondContact O-CB 3.41Å; P173-H176 PolarHBondContact O-N 2.89Å; P173-H176 VanDerWaalsContact O-N 3.09Å
174	E	95.3	Very high	95.5	Very high	133 Å²	133	104.2 Å²	104.2	62%	0.621	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-63.7	-27.2	176	-62.4	-60.7	154.5	0	0	113.1	N172 H176 M177	N172-E174 PolarHBondContact O-N 3.16Å; N172-E174 PolarHBondContact OD1-N 3.35Å; E174-H176 PolarHBondContact O-N 2.91Å; E174-M177 VanDerWaalsContact O-CB 3.29Å; E174-M177 WeakPolarHBondContact O-CB 3.49Å; E174-M177 PolarHBondContact O-N 3.11Å
175	E	93.9	Very high	95.6	Very high	97 Å²	97	104.6 Å²	104.6	45%	0.453	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-66.2	-22.1	175.7	-67.5	-168.6	151.5	0	0	112.4	Y171 N172 P173 M177 K178	Y171-E175 HydrophobicContact CE2-CB 4.21Å; N172-E175 HydrophobicContact CB-CG 4.28Å; N172-E175 WeakPolarHBondContact O-CB 3.38Å; N172-E175 PolarHBondContact O-N 3.21Å; P173-E175 PolarHBondContact O-N 3.25Å; E175-M177 PolarHBondContact O-N 3.38Å; E175-K178 WeakPolarHBondContact O-CB 3.4Å; E175-K178 PolarHBondContact O-N 3.01Å; E175-K178 VanDerWaalsContact O-N 3.17Å
176	H	95.1	Very high	95.8	Very high	98 Å²	98	100.3 Å²	100.3	45%	0.454	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-27.3	173.4	-168.8	-95.1	0	0	0	111.8	Y171 P173 E174 K178 I179 V180	Y171-H176 WeakPolarHBondContact OH-CA 3.4Å; Y171-H176 WeakPolarHBondContact OH-CB 3.3Å; Y171-H176 PolarHBondContact OH-N 3.15Å; Y171-H176 VanDerWaalsContact OH-N 3.17Å; P173-H176 WeakPolarHBondContact O-CB 3.41Å; P173-H176 PolarHBondContact O-N 2.89Å; P173-H176 VanDerWaalsContact O-N 3.09Å; E174-H176 PolarHBondContact O-N 2.91Å; H176-K178 PolarHBondContact O-N 3.21Å; H176-I179 WeakPolarHBondContact O-CB 3.37Å; H176-I179 PolarHBondContact O-N 3.42Å; H176-V180 PolarHBondContact O-N 2.92Å
177	M	96.6	Very high	95.8	Very high	98 Å²	98	100.2 Å²	100.2	48%	0.483	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-31.2	176.8	-66.3	-58.7	-65.3	0	0	112.6	E174 E175 I179 V180 E181	E174-M177 VanDerWaalsContact O-CB 3.29Å; E174-M177 WeakPolarHBondContact O-CB 3.49Å; E174-M177 PolarHBondContact O-N 3.11Å; E175-M177 PolarHBondContact O-N 3.38Å; M177-I179 VanDerWaalsContact C-N 3.26Å; M177-I179 PolarHBondContact O-N 2.93Å; M177-V180 WeakPolarHBondContact O-CB 3.33Å; M177-V180 PolarHBondContact O-N 3.48Å; M177-V180 VanDerWaalsContact O-N 3.11Å; M177-E181 WeakPolarHBondContact O-CG 3.33Å; M177-E181 PolarHBondContact O-N 2.96Å
178	K	96.4	Very high	95.8	Very high	122 Å²	122	94.9 Å²	94.9	53%	0.53	47%	0.473	S	S	.	.	H	α-helix	trans	-61.2	-38	174.4	-63.1	175.2	-177.6	166.2	0	111.6	E175 H176 E181 E182	E175-K178 WeakPolarHBondContact O-CB 3.4Å; E175-K178 PolarHBondContact O-N 3.01Å; E175-K178 VanDerWaalsContact O-N 3.17Å; H176-K178 PolarHBondContact O-N 3.21Å; K178-E181 WeakPolarHBondContact O-CB 3.32Å; K178-E181 PolarHBondContact O-N 2.92Å; K178-E182 WeakPolarHBondContact O-CG 3.5Å; K178-E182 PolarHBondContact O-N 3.32Å
179	I	96.7	Very high	95.8	Very high	70 Å²	70	89.8 Å²	89.8	36%	0.359	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-44.3	175.3	-57.4	172	0	0	0	109.3	H176 M177 E181 E182 Y183	H176-I179 WeakPolarHBondContact O-CB 3.37Å; H176-I179 PolarHBondContact O-N 3.42Å; M177-I179 VanDerWaalsContact C-N 3.26Å; M177-I179 PolarHBondContact O-N 2.93Å; I179-E181 VanDerWaalsContact C-N 3.29Å; I179-E181 PolarHBondContact O-N 3.41Å; I179-E182 WeakPolarHBondContact O-CB 3.26Å; I179-E182 PolarHBondContact O-N 2.85Å; I179-E182 VanDerWaalsContact O-N 3.12Å; I179-Y183 HydrophobicContact CG2-CD2 3.79Å; I179-Y183 HydrophobicContact CG2-CE2 3.73Å; I179-Y183 VanDerWaalsContact O-CD2 3.31Å; I179-Y183 WeakPolarHBondContact O-CD2 2.8Å; I179-Y183 PolarHBondContact O-N 2.85Å
180	V	97.4	Very high	95.9	Very high	67 Å²	67	93.6 Å²	93.6	41%	0.406	48%	0.479	S	S	.	.	H	α-helix	trans	-58.4	-42	175.6	178.8	0	0	0	0	111.4	H176 M177 Y183 S184	H176-V180 PolarHBondContact O-N 2.92Å; M177-V180 WeakPolarHBondContact O-CB 3.33Å; M177-V180 PolarHBondContact O-N 3.48Å; M177-V180 VanDerWaalsContact O-N 3.11Å; V180-Y183 PolarHBondContact O-N 2.82Å; V180-S184 PolarHBondContact O-N 3.32Å
181	E	96.9	Very high	96	Very high	106 Å²	106	99.4 Å²	99.4	50%	0.495	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-41.9	174.5	-70.5	173.8	-166.9	0	0	112.3	M177 K178 I179 S184 K185	M177-E181 WeakPolarHBondContact O-CG 3.33Å; M177-E181 PolarHBondContact O-N 2.96Å; K178-E181 WeakPolarHBondContact O-CB 3.32Å; K178-E181 PolarHBondContact O-N 2.92Å; I179-E181 VanDerWaalsContact C-N 3.29Å; I179-E181 PolarHBondContact O-N 3.41Å; E181-S184 WeakPolarHBondContact CA-OG 3.28Å; E181-S184 PolarHBondContact O-N 2.62Å; E181-S184 PolarHBondContact O-OG 2.73Å; E181-K185 WeakPolarHBondContact O-CG 3.28Å; E181-K185 PolarHBondContact O-N 2.83Å; E181-K185 VanDerWaalsContact O-N 3.08Å
182	E	97.1	Very high	96	Very high	117 Å²	117	99.2 Å²	99.2	55%	0.547	49%	0.492	S	S	.	.	H	α-helix	trans	-59.8	-47	174	-73.2	174.8	-178.7	0	0	111.8	K178 I179 S184 K185 V186	K178-E182 WeakPolarHBondContact O-CG 3.5Å; K178-E182 PolarHBondContact O-N 3.32Å; I179-E182 WeakPolarHBondContact O-CB 3.26Å; I179-E182 PolarHBondContact O-N 2.85Å; I179-E182 VanDerWaalsContact O-N 3.12Å; E182-S184 VanDerWaalsContact C-N 3.31Å; E182-S184 PolarHBondContact O-N 3.31Å; E182-K185 PolarHBondContact O-N 3.42Å; E182-V186 WeakPolarHBondContact O-CG2 3.09Å; E182-V186 PolarHBondContact O-N 3.27Å
183	Y	97	Very high	96.1	Very high	152 Å²	152	99.7 Å²	99.7	60%	0.596	49%	0.494	S	S	*	.	H	α-helix	trans	-62.2	-38.1	176.3	-86.8	-98.4	0	0	0	112.1	I179 V180 K185 V186 D187	I179-Y183 HydrophobicContact CG2-CD2 3.79Å; I179-Y183 HydrophobicContact CG2-CE2 3.73Å; I179-Y183 VanDerWaalsContact O-CD2 3.31Å; I179-Y183 WeakPolarHBondContact O-CD2 2.8Å; I179-Y183 PolarHBondContact O-N 2.85Å; V180-Y183 PolarHBondContact O-N 2.82Å; Y183-K185 VanDerWaalsContact C-N 3.34Å; Y183-K185 PolarHBondContact O-N 3Å; Y183-V186 WeakPolarHBondContact O-CB 3.4Å; Y183-V186 PolarHBondContact O-N 2.93Å; Y183-D187 PolarHBondContact O-N 2.84Å
184	S	97.4	Very high	96.1	Very high	58 Å²	58	102.3 Å²	102.3	41%	0.406	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-41	174.9	78.3	0	0	0	0	112.5	V180 E181 E182 D187 L188	V180-S184 PolarHBondContact O-N 3.32Å; E181-S184 WeakPolarHBondContact CA-OG 3.28Å; E181-S184 PolarHBondContact O-N 2.62Å; E181-S184 PolarHBondContact O-OG 2.73Å; E182-S184 VanDerWaalsContact C-N 3.31Å; E182-S184 PolarHBondContact O-N 3.31Å; S184-D187 PolarHBondContact O-N 3.05Å; S184-L188 WeakPolarHBondContact O-CG 3.19Å; S184-L188 PolarHBondContact O-N 3.35Å
185	K	97.3	Very high	96	Very high	133 Å²	133	98.6 Å²	98.6	58%	0.578	49%	0.488	S	S	*	.	H	α-helix	trans	-66.5	-40.8	175.5	-69.5	168	-172.7	165.2	0	111.4	E181 E182 Y183 D187 L188 A189	E181-K185 WeakPolarHBondContact O-CG 3.28Å; E181-K185 PolarHBondContact O-N 2.83Å; E181-K185 VanDerWaalsContact O-N 3.08Å; E182-K185 PolarHBondContact O-N 3.42Å; Y183-K185 VanDerWaalsContact C-N 3.34Å; Y183-K185 PolarHBondContact O-N 3Å; K185-D187 VanDerWaalsContact C-N 3.34Å; K185-L188 PolarHBondContact O-N 2.74Å; K185-A189 WeakPolarHBondContact O-CB 3.28Å; K185-A189 PolarHBondContact O-N 3.42Å
186	V	97.4	Very high	95.9	Very high	72 Å²	72	98.8 Å²	98.8	44%	0.436	49%	0.488	S	S	.	.	H	α-helix	trans	-61.8	-42.8	175.1	170.4	0	0	0	0	110.9	E182 Y183 A189 K190	E182-V186 WeakPolarHBondContact O-CG2 3.09Å; E182-V186 PolarHBondContact O-N 3.27Å; Y183-V186 WeakPolarHBondContact O-CB 3.4Å; Y183-V186 PolarHBondContact O-N 2.93Å; V186-A189 PolarHBondContact O-N 2.89Å; V186-K190 HydrophobicContact CG1-CD 4.29Å; V186-K190 WeakPolarHBondContact O-CG 3.33Å; V186-K190 PolarHBondContact O-N 3.12Å
187	D	96.1	Very high	95.7	Very high	69 Å²	69	100.1 Å²	100.1	37%	0.369	49%	0.493	S	S	.	.	H	α-helix	trans	-69.6	-37.9	179.1	-72.5	-17.8	0	0	0	112.3	Y183 S184 K185 K190 R191	Y183-D187 PolarHBondContact O-N 2.84Å; S184-D187 PolarHBondContact O-N 3.05Å; K185-D187 VanDerWaalsContact C-N 3.34Å; D187-K190 PolarHBondContact O-N 3.12Å; D187-K190 IonicContact OD1-NZ 3.75Å; D187-R191 WeakPolarHBondContact O-CG 3.3Å; D187-R191 PolarHBondContact O-N 3.24Å
188	L	96.6	Very high	95.2	Very high	102 Å²	102	100.4 Å²	100.4	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-59.8	-47.4	170.2	-72.4	173.9	0	0	0	111.1	S184 K185 K190 R191 T192	S184-L188 WeakPolarHBondContact O-CG 3.19Å; S184-L188 PolarHBondContact O-N 3.35Å; K185-L188 PolarHBondContact O-N 2.74Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 3.25Å; L188-R191 PolarHBondContact O-N 3.25Å; L188-R191 VanDerWaalsContact O-N 3.16Å; L188-T192 WeakPolarHBondContact O-CG2 3.36Å; L188-T192 PolarHBondContact O-N 2.86Å; L188-T192 PolarHBondContact O-OG1 3.3Å
189	A	95.9	Very high	94.7	Very high	45 Å²	45	101.1 Å²	101.1	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-38.9	177	0	0	0	0	0	112.4	K185 V186 T192 L193	K185-A189 WeakPolarHBondContact O-CB 3.28Å; K185-A189 PolarHBondContact O-N 3.42Å; V186-A189 PolarHBondContact O-N 2.89Å; A189-T192 WeakPolarHBondContact CA-OG1 3.15Å; A189-T192 PolarHBondContact O-N 3.38Å; A189-T192 PolarHBondContact O-OG1 3.45Å; A189-L193 WeakPolarHBondContact O-CB 3.46Å; A189-L193 VanDerWaalsContact O-CG 3.27Å; A189-L193 WeakPolarHBondContact O-CG 3.25Å; A189-L193 PolarHBondContact O-N 3.41Å
190	K	95.4	Very high	94.2	Very high	116 Å²	116	103.9 Å²	103.9	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-63.4	-41.2	173.8	-76	173.7	-177.1	168	0	111.8	V186 D187 L188 K194	V186-K190 HydrophobicContact CG1-CD 4.29Å; V186-K190 WeakPolarHBondContact O-CG 3.33Å; V186-K190 PolarHBondContact O-N 3.12Å; D187-K190 PolarHBondContact O-N 3.12Å; D187-K190 IonicContact OD1-NZ 3.75Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 3.25Å; K190-K194 WeakPolarHBondContact O-CG 3.3Å; K190-K194 PolarHBondContact O-N 2.94Å
191	R	94.7	Very high	93.5	Very high	174 Å²	174	105.9 Å²	105.9	66%	0.657	52%	0.517	S	S	*	.	H	α-helix	trans	-65.3	-44.2	176.4	-71.8	176.5	-166.4	178	4.8	111.4	D187 L188 K194 A195	D187-R191 WeakPolarHBondContact O-CG 3.3Å; D187-R191 PolarHBondContact O-N 3.24Å; L188-R191 PolarHBondContact O-N 3.25Å; L188-R191 VanDerWaalsContact O-N 3.16Å; R191-K194 PolarHBondContact O-N 3.15Å; R191-A195 WeakPolarHBondContact O-CB 3.45Å; R191-A195 PolarHBondContact O-N 3.42Å
192	T	95.8	Very high	92.7	Very high	75 Å²	75	106.7 Å²	106.7	46%	0.46	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-40.2	177.4	56.2	0	0	0	0	111.6	L188 A189 A195 Q196	L188-T192 WeakPolarHBondContact O-CG2 3.36Å; L188-T192 PolarHBondContact O-N 2.86Å; L188-T192 PolarHBondContact O-OG1 3.3Å; A189-T192 WeakPolarHBondContact CA-OG1 3.15Å; A189-T192 PolarHBondContact O-N 3.38Å; A189-T192 PolarHBondContact O-OG1 3.45Å; T192-A195 PolarHBondContact O-N 3.21Å; T192-Q196 WeakPolarHBondContact O-CB 3.28Å; T192-Q196 VanDerWaalsContact O-CG 3.31Å; T192-Q196 WeakPolarHBondContact O-CG 3.12Å; T192-Q196 PolarHBondContact O-N 2.92Å
193	L	94.6	Very high	91.9	Very high	95 Å²	95	105.2 Å²	105.2	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-65.1	-38.8	175.4	-75	174.1	0	0	0	112.2	A189 K197	A189-L193 WeakPolarHBondContact O-CB 3.46Å; A189-L193 VanDerWaalsContact O-CG 3.27Å; A189-L193 WeakPolarHBondContact O-CG 3.25Å; A189-L193 PolarHBondContact O-N 3.41Å; L193-K197 WeakPolarHBondContact O-CB 3.49Å; L193-K197 VanDerWaalsContact O-CG 3.26Å; L193-K197 WeakPolarHBondContact O-CG 3.37Å; L193-K197 PolarHBondContact O-N 3.07Å
194	K	93.9	Very high	90.7	Very high	150 Å²	150	102 Å²	102	65%	0.652	53%	0.533	S	S	*	.	H	α-helix	trans	-63.9	-44	172.9	-75.8	-176.7	177.2	-168.6	0	111.4	K190 R191 K197 L198	K190-K194 WeakPolarHBondContact O-CG 3.3Å; K190-K194 PolarHBondContact O-N 2.94Å; R191-K194 PolarHBondContact O-N 3.15Å; K194-K197 PolarHBondContact O-N 2.71Å; K194-L198 WeakPolarHBondContact O-CG 3.15Å; K194-L198 PolarHBondContact O-N 3.31Å
195	A	93.5	Very high	88.7	Confident	55 Å²	55	101 Å²	101	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-42.9	177.2	0	0	0	0	0	112.4	R191 T192 L198 Q199	R191-A195 WeakPolarHBondContact O-CB 3.45Å; R191-A195 PolarHBondContact O-N 3.42Å; T192-A195 PolarHBondContact O-N 3.21Å; A195-L198 PolarHBondContact O-N 2.97Å; A195-Q199 WeakPolarHBondContact O-CB 3.34Å; A195-Q199 PolarHBondContact O-N 3.01Å
196	Q	92.1	Very high	86.6	Confident	100 Å²	100	104 Å²	104	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-61.5	-44.8	175.2	-77	174.9	-6.3	0	0	111.6	T192 Q199 E200	T192-Q196 WeakPolarHBondContact O-CB 3.28Å; T192-Q196 VanDerWaalsContact O-CG 3.31Å; T192-Q196 WeakPolarHBondContact O-CG 3.12Å; T192-Q196 PolarHBondContact O-N 2.92Å; Q196-Q199 PolarHBondContact O-N 3.41Å; Q196-E200 WeakPolarHBondContact O-CB 3.41Å; Q196-E200 WeakPolarHBondContact O-CG 3.41Å; Q196-E200 PolarHBondContact O-N 3.33Å
197	K	90.3	Very high	84.2	Confident	126 Å²	126	107 Å²	107	55%	0.548	56%	0.557	S	S	.	*	H	α-helix	trans	-60.7	-45.8	175.6	-75.1	176.4	179.9	-170.6	0	112.5	L193 K194 Q199 E200 E201	L193-K197 WeakPolarHBondContact O-CB 3.49Å; L193-K197 VanDerWaalsContact O-CG 3.26Å; L193-K197 WeakPolarHBondContact O-CG 3.37Å; L193-K197 PolarHBondContact O-N 3.07Å; K194-K197 PolarHBondContact O-N 2.71Å; K197-Q199 VanDerWaalsContact C-N 3.29Å; K197-Q199 PolarHBondContact O-N 2.84Å; K197-E200 PolarHBondContact O-N 3.22Å; K197-E201 WeakPolarHBondContact O-CB 3.19Å; K197-E201 VanDerWaalsContact O-CG 3.31Å; K197-E201 WeakPolarHBondContact O-CG 3.28Å; K197-E201 PolarHBondContact O-N 2.71Å
198	L	86.6	Confident	81.4	Confident	105 Å²	105	111.9 Å²	111.9	55%	0.55	58%	0.577	S	S	.	*	H	α-helix	trans	-61	-40.3	175.3	-71.3	172.3	0	0	0	111.4	K194 A195 E201 L202	K194-L198 WeakPolarHBondContact O-CG 3.15Å; K194-L198 PolarHBondContact O-N 3.31Å; A195-L198 PolarHBondContact O-N 2.97Å; L198-E201 PolarHBondContact O-N 3.26Å; L198-L202 WeakPolarHBondContact O-CB 3.34Å; L198-L202 VanDerWaalsContact O-CG 3.26Å; L198-L202 WeakPolarHBondContact O-CG 3.06Å; L198-L202 PolarHBondContact O-N 3.2Å
199	Q	86.5	Confident	78.6	Confident	137 Å²	137	116 Å²	116	64%	0.64	59%	0.594	S	S	*	*	H	α-helix	trans	-68.9	-37.4	177.8	-164	174.8	4.7	0	0	112.3	A195 Q196 K197 A203	A195-Q199 WeakPolarHBondContact O-CB 3.34Å; A195-Q199 PolarHBondContact O-N 3.01Å; Q196-Q199 PolarHBondContact O-N 3.41Å; K197-Q199 VanDerWaalsContact C-N 3.29Å; K197-Q199 PolarHBondContact O-N 2.84Å; Q199-A203 WeakPolarHBondContact O-CB 3.22Å; Q199-A203 PolarHBondContact O-N 2.59Å
200	E	86.5	Confident	75.8	Confident	128 Å²	128	120 Å²	120	60%	0.598	61%	0.613	S	S	*	*	H	α-helix	trans	-68	-36.4	172	-74.9	174.8	-177.3	0	0	112.1	Q196 K197 A203 S204	Q196-E200 WeakPolarHBondContact O-CB 3.41Å; Q196-E200 WeakPolarHBondContact O-CG 3.41Å; Q196-E200 PolarHBondContact O-N 3.33Å; K197-E200 PolarHBondContact O-N 3.22Å; E200-A203 PolarHBondContact O-N 2.94Å; E200-S204 WeakPolarHBondContact O-CB 3.33Å; E200-S204 PolarHBondContact O-N 3.31Å; E200-S204 PolarHBondContact O-OG 3.41Å
201	E	81.3	Confident	72.9	Confident	108 Å²	108	121.8 Å²	121.8	51%	0.505	63%	0.628	S	S	.	*	H	α-helix	trans	-66.4	-41.6	173.3	-77	172.8	-178.4	0	0	111.7	K197 L198 S204	K197-E201 WeakPolarHBondContact O-CB 3.19Å; K197-E201 VanDerWaalsContact O-CG 3.31Å; K197-E201 WeakPolarHBondContact O-CG 3.28Å; K197-E201 PolarHBondContact O-N 2.71Å; L198-E201 PolarHBondContact O-N 3.26Å; E201-S204 WeakPolarHBondContact CA-OG 3.38Å; E201-S204 PolarHBondContact O-OG 3.06Å
202	L	79.9	Confident	69.8	Low	123 Å²	123	119 Å²	119	64%	0.644	64%	0.635	S	S	*	*	H	α-helix	trans	-64.6	-42.3	171.4	-71.1	170	0	0	0	111.5	L198 G205 L207	L198-L202 WeakPolarHBondContact O-CB 3.34Å; L198-L202 VanDerWaalsContact O-CG 3.26Å; L198-L202 WeakPolarHBondContact O-CG 3.06Å; L198-L202 PolarHBondContact O-N 3.2Å; L202-G205 PolarHBondContact O-N 3.38Å; L202-L207 HydrophobicContact CD2-CD1 4.36Å
203	A	80.3	Confident	67.6	Low	87 Å²	87	120.8 Å²	120.8	72%	0.719	65%	0.648	S	S	*	*	H	α-helix	trans	-74.5	-29.4	-179.4	0	0	0	0	0	113.6	Q199 E200 G205	Q199-A203 WeakPolarHBondContact O-CB 3.22Å; Q199-A203 PolarHBondContact O-N 2.59Å; E200-A203 PolarHBondContact O-N 2.94Å; A203-G205 PolarHBondContact O-N 3.14Å
204	S	72.9	Confident	64.4	Low	85 Å²	85	126.6 Å²	126.6	59%	0.594	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	2.6	177.1	60	0	0	0	0	113.4	E200 E201 K206	E200-S204 WeakPolarHBondContact O-CB 3.33Å; E200-S204 PolarHBondContact O-N 3.31Å; E200-S204 PolarHBondContact O-OG 3.41Å; E201-S204 WeakPolarHBondContact CA-OG 3.38Å; E201-S204 PolarHBondContact O-OG 3.06Å; S204-K206 PolarHBondContact O-N 3.09Å; S204-K206 VanDerWaalsContact O-N 3.16Å
205	G	55.2	Low	61.5	Low	35 Å²	35	125.5 Å²	125.5	36%	0.361	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	66.9	17.9	167.5	0	0	0	0	0	114.7	L202 A203 L207 E208	L202-G205 PolarHBondContact O-N 3.38Å; A203-G205 PolarHBondContact O-N 3.14Å; G205-L207 PolarHBondContact O-N 3.06Å; G205-E208 PolarHBondContact O-N 3.42Å
206	K	53.3	Low	58.5	Low	198 Å²	198	130.4 Å²	130.4	86%	0.861	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	0.9	179.1	-140.6	179.4	-176.3	-172.6	0	113.6	S204	S204-K206 PolarHBondContact O-N 3.09Å; S204-K206 VanDerWaalsContact O-N 3.16Å
207	L	47.6	Very low	55.2	Low	135 Å²	135	137.6 Å²	137.6	71%	0.707	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	16.2	178.7	-129.3	136.5	0	0	0	112.5	L202 G205	L202-L207 HydrophobicContact CD2-CD1 4.36Å; G205-L207 PolarHBondContact O-N 3.06Å
208	E	37.8	Very low	52.3	Low	171 Å²	171	134.9 Å²	134.9	80%	0.799	71%	0.705	S	S	*	*			trans	-101.4	34.9	-174.3	-116.9	-173.8	-173.7	0	0	114.5	G205	G205-E208 PolarHBondContact O-N 3.42Å
209	Q	37.7	Very low	49.5	Very low	189 Å²	189	138 Å²	138	88%	0.883	72%	0.717	S	S	*	*	S	Bend	trans	-139.1	47.9	164.8	-79.2	-167.1	22.1	0	0	113.7
210	V	36.8	Very low	46.7	Very low	127 Å²	127	139 Å²	139	77%	0.77	72%	0.721	S	S	*	*	S	Bend	trans	-153.5	92	136.4	-171.6	0	0	0	0	106.8
211	N	34.6	Very low	44	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	73%	0.732	S	S	*	*			trans	-174.5	124.2	134.2	-94.2	-17.1	0	0	0	110.9
212	S	28.5	Very low	42.2	Very low	115 Å²	115	141 Å²	141	80%	0.804	74%	0.74	S	S	*	*			trans	-127.5	150.1	152	-135.1	0	0	0	0	107.3
213	P	49.1	Very low	39.7	Very low	114 Å²	114	142.5 Å²	142.5	74%	0.74	75%	0.749	S	S	*	*				-121.7	174.4	-106.5	19.1	4	0	0	0	110.1
214	R	28.6	Very low	37.2	Very low	216 Å²	216	143.5 Å²	143.5	82%	0.815	75%	0.751	S	S	*	*			trans	169.4	137	131.7	177.9	164.7	-162.8	153	0.3	115.6
215	H	32.2	Very low	35.4	Very low	128 Å²	128	148.4 Å²	148.4	59%	0.593	76%	0.764	S	S	*	*			trans	73.4	99.4	164.2	-83	-62.3	0	0	0	117.7
216	Q	30.3	Very low	34.1	Very low	157 Å²	157	153.2 Å²	153.2	73%	0.734	79%	0.787	S	S	*	*				73.7	97.8	61.6	-172.8	-179.2	29.7	0	0	114
217	W	24.4	Very low	33.3	Very low	251 Å²	251	152.5 Å²	152.5	95%	0.951	79%	0.786	S	S	*	*			trans	-159	135.8	146.9	-74.5	101.1	0	0	0	105.9
218	G	27.7	Very low	32.6	Very low	70 Å²	70	157.2 Å²	157.2	72%	0.722	80%	0.795	S	S	*	*			cis	97.4	109.6	41.3	0	0	0	0	0	108
219	E	28.7	Very low	32.3	Very low	170 Å²	170	156.1 Å²	156.1	79%	0.794	80%	0.795	S	S	*	*			trans	-51.2	151.7	-164.4	-88.6	179.8	166.8	0	0	121
220	E	28.5	Very low	32.4	Very low	157 Å²	157	156.2 Å²	156.2	73%	0.734	80%	0.795	S	S	*	*			trans	83.8	113.5	134.8	-74	179.1	-176	0	0	124.2
221	E	29.8	Very low	32.5	Very low	174 Å²	174	156.1 Å²	156.1	81%	0.813	79%	0.79	S	S	*	*			trans	77.8	158.2	130.2	-76.4	-64.8	127.6	0	0	120.2
222	P	42.1	Very low	32.7	Very low	105 Å²	105	154.1 Å²	154.1	68%	0.682	79%	0.788	S	S	*	*				-120	176.4	-118.2	42	-28.4	0	0	0	115
223	N	28.3	Very low	33.2	Very low	154 Å²	154	156 Å²	156	82%	0.824	78%	0.784	S	S	*	*			trans	94.2	109.6	157.8	-157.5	25.5	0	0	0	117.9
224	S	27.8	Very low	33	Very low	109 Å²	109	157.5 Å²	157.5	76%	0.762	79%	0.786	S	S	*	*				165.5	149.5	119.8	54.7	0	0	0	0	111.8
225	Q	33.9	Very low	33.9	Very low	187 Å²	187	156 Å²	156	87%	0.874	79%	0.788	S	S	*	*			trans	-42.6	140.1	173.4	-68.7	161.6	-61.3	0	0	113.6
226	T	29.4	Very low	34.7	Very low	137 Å²	137	156.2 Å²	156.2	84%	0.84	79%	0.794	S	S	*	*				172.8	139.2	119.8	-62.5	0	0	0	0	108.5
227	E	35.8	Very low	35.6	Very low	182 Å²	182	156.3 Å²	156.3	85%	0.85	79%	0.794	S	S	*	*			trans	-55.1	142.4	-177.5	-47.3	-162.5	160	0	0	114.3
228	R	32	Very low	36.9	Very low	234 Å²	234	151 Å²	151	88%	0.883	78%	0.784	S	S	*	*			trans	-161.8	117.6	152.2	-113.9	174	-166.8	177.6	4.2	111
229	D	33.1	Very low	38	Very low	149 Å²	149	155.9 Å²	155.9	80%	0.797	79%	0.785	S	S	*	*			trans	14.4	107.3	152.9	-82.2	-43.7	0	0	0	118
230	H	37.9	Very low	39.3	Very low	191 Å²	191	156.6 Å²	156.6	88%	0.884	78%	0.782	S	S	*	*			trans	-103.8	86.5	148.3	-82.4	-65.2	0	0	0	108.3
231	N	40.8	Very low	40.5	Very low	125 Å²	125	152.1 Å²	152.1	67%	0.668	77%	0.772	S	S	*	*			trans	-107.1	99.7	160.8	-159.4	-2.8	0	0	0	107.5
232	S	38	Very low	41.5	Very low	111 Å²	111	151 Å²	151	78%	0.776	77%	0.772	S	S	*	*			trans	-142	79.7	161.6	66.2	0	0	0	0	108.2
233	E	40	Very low	41.9	Very low	154 Å²	154	153 Å²	153	72%	0.72	78%	0.777	S	S	*	*			trans	-7.3	114.1	155.8	-63.5	170.2	159.2	0	0	116.9	E235	E233-E235 PolarHBondContact O-N 2.84Å
234	D	43.6	Very low	43.1	Very low	147 Å²	147	151.4 Å²	151.4	79%	0.786	77%	0.767	S	S	*	*	S	Bend		62	33.7	111.4	-62.4	-14.8	0	0	0	121.5
235	E	46.9	Very low	44.2	Very low	184 Å²	184	153.1 Å²	153.1	86%	0.86	77%	0.767	S	S	*	*	S	Bend	trans	-129	-8.5	167.6	-86.6	-171.4	160.2	0	0	117.3	E233	E233-E235 PolarHBondContact O-N 2.84Å
236	D	48.8	Very low	45.2	Very low	133 Å²	133	149.2 Å²	149.2	71%	0.711	75%	0.75	S	S	*	*	S	Bend	trans	-116.6	-1.1	-175.3	-73.9	-35.9	0	0	0	115.4
237	E	50.2	Low	46.1	Very low	158 Å²	158	148.6 Å²	148.6	74%	0.738	75%	0.748	S	S	*	*	S	Bend	trans	-83.1	-27.1	-175.3	-159.8	149.8	-163.8	0	0	113.3	K239 Y240 A241	E237-K239 VanDerWaalsContact C-N 3.28Å; E237-K239 PolarHBondContact O-N 3.49Å; E237-Y240 PolarHBondContact O-N 3.48Å; E237-A241 PolarHBondContact O-N 3.26Å
238	D	51.7	Low	46.9	Very low	140 Å²	140	142.7 Å²	142.7	75%	0.749	74%	0.737	S	S	*	*	H	α-helix	trans	-69.9	-24.2	179.6	-71.4	-20.6	0	0	0	113.1
239	K	51.1	Low	47.9	Very low	172 Å²	172	134 Å²	134	75%	0.748	71%	0.706	S	S	*	*	H	α-helix	trans	-82.5	-23.3	-177.2	-154.4	174.8	-171.4	179.1	0	113.4	E237	E237-K239 VanDerWaalsContact C-N 3.28Å; E237-K239 PolarHBondContact O-N 3.49Å
240	Y	55.3	Low	48.9	Very low	186 Å²	186	133.2 Å²	133.2	73%	0.729	70%	0.702	S	S	*	*	H	α-helix	trans	-86.8	-17	172	-80.3	-84.5	0	0	0	112.6	E237 I244	E237-Y240 PolarHBondContact O-N 3.48Å; Y240-I244 WeakPolarHBondContact O-CG1 3.34Å
241	A	53.7	Low	49.5	Very low	62 Å²	62	131.3 Å²	131.3	51%	0.512	69%	0.691	S	S	.	*	H	α-helix	trans	-73	-30.9	177.8	0	0	0	0	0	113.1	E237	E237-A241 PolarHBondContact O-N 3.26Å
242	D	50.6	Low	50	Low	152 Å²	152	128.9 Å²	128.9	81%	0.813	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-23.3	-179.3	-93.7	-16.1	0	0	0	113.8
243	D	51.1	Low	51.2	Low	147 Å²	147	128.7 Å²	128.7	79%	0.786	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-4.2	-179	-78.8	-25.8	0	0	0	113.6	D245	D243-D245 PolarHBondContact O-N 3.43Å
244	I	53.5	Low	52.5	Low	119 Å²	119	130.4 Å²	130.4	61%	0.61	68%	0.682	S	S	*	*	S	Bend	trans	-82.7	98.1	171.6	-64.7	170	0	0	0	108.2	Y240 M246	Y240-I244 WeakPolarHBondContact O-CG1 3.34Å; I244-M246 PolarHBondContact O-N 3.28Å
245	D	51.3	Low	53.2	Low	146 Å²	146	132.1 Å²	132.1	78%	0.781	68%	0.678	S	S	*	*			trans	-54.5	103.3	170.4	-155.9	8.8	0	0	0	109	D243 P247	D243-D245 PolarHBondContact O-N 3.43Å; D245-P247 VanDerWaalsContact O-CD 3.25Å; D245-P247 WeakPolarHBondContact O-CD 3.4Å
246	M	55.5	Low	53.9	Low	105 Å²	105	135 Å²	135	52%	0.517	68%	0.681	S	S	.	*			trans	-58.1	111.8	-169.9	-169.3	-172.5	59.3	0	0	109.3	I244 G248 Q249	I244-M246 PolarHBondContact O-N 3.28Å; M246-G248 PolarHBondContact O-N 3.22Å; M246-Q249 HydrophobicContact CE-CB 4.37Å; M246-Q249 HydrophobicContact CE-CG 4.4Å; M246-Q249 PolarHBondContact O-N 3.49Å
247	P	47.1	Very low	54.4	Low	123 Å²	123	134.4 Å²	134.4	80%	0.799	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	114.5	-169.4	23.2	-31.8	0	0	0	110.5	D245	D245-P247 VanDerWaalsContact O-CD 3.25Å; D245-P247 WeakPolarHBondContact O-CD 3.4Å
248	G	53.7	Low	55.2	Low	59 Å²	59	129 Å²	129	61%	0.608	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	128.4	-2.8	176.3	0	0	0	0	0	115.5	M246 N250	M246-G248 PolarHBondContact O-N 3.22Å; G248-N250 PolarHBondContact O-N 3.3Å
249	Q	53	Low	55.7	Low	51 Å²	51	127 Å²	127	24%	0.238	65%	0.647	C	S	.	*			trans	-91.5	90.4	175.2	-138.5	169.9	3.8	0	0	109.9	M246 F251 T258 R260	M246-Q249 HydrophobicContact CE-CB 4.37Å; M246-Q249 HydrophobicContact CE-CG 4.4Å; M246-Q249 PolarHBondContact O-N 3.49Å; Q249-F251 PolarHBondContact O-N 3.28Å; Q249-T258 HydrophobicContact CG-CG2 4Å; Q249-T258 PolarHBondContact NE2-OG1 3.42Å; Q249-R260 HydrophobicContact CG-CG 4.39Å; Q249-R260 VanDerWaalsContact NE2-NE 3.11Å
250	N	53.8	Low	56.6	Low	133 Å²	133	126.5 Å²	126.5	71%	0.711	64%	0.64	S	S	*	*			trans	-64.8	103.9	172.2	-68.8	-34.5	0	0	0	108.7	G248 D252	G248-N250 PolarHBondContact O-N 3.3Å; N250-D252 PolarHBondContact O-N 3.17Å
251	F	50	Low	57.6	Low	150 Å²	150	124 Å²	124	66%	0.658	64%	0.64	S	S	*	*			trans	-75.6	89.7	173.1	-166.1	-92.4	0	0	0	108.9	Q249 S253 T258	Q249-F251 PolarHBondContact O-N 3.28Å; F251-S253 PolarHBondContact O-N 2.82Å; F251-S253 VanDerWaalsContact O-N 3.11Å; F251-T258 HydrophobicContact CD2-CG2 4.25Å
252	D	51.8	Low	59	Low	75 Å²	75	129.4 Å²	129.4	40%	0.401	66%	0.659	S	S	.	*			trans	-72.8	100.5	172.9	-171	-3.9	0	0	0	108.9	N250 K254 R255	N250-D252 PolarHBondContact O-N 3.17Å; D252-K254 PolarHBondContact O-N 2.69Å; D252-K254 PolarHBondContact OD1-N 3.03Å; D252-R255 CarbonylContact O-C 3.58Å; D252-R255 PolarHBondContact O-N 2.83Å
253	S	62.1	Low	60.9	Low	106 Å²	106	129.2 Å²	129.2	74%	0.741	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-8.7	-173.8	35.5	0	0	0	0	114.7	F251	F251-S253 PolarHBondContact O-N 2.82Å; F251-S253 VanDerWaalsContact O-N 3.11Å
254	K	67.4	Low	62.8	Low	191 Å²	191	126.9 Å²	126.9	83%	0.83	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-22.5	174.9	-74.7	177.5	178.7	175.6	0	114.5	D252	D252-K254 PolarHBondContact O-N 2.69Å; D252-K254 PolarHBondContact OD1-N 3.03Å
255	R	59.8	Low	64.6	Low	183 Å²	183	132.2 Å²	132.2	69%	0.691	65%	0.645	S	S	*	*	S	Bend	trans	-126.4	105.7	177.5	-64.4	178	-177.6	-177.2	1.8	105	D252 I257	D252-R255 CarbonylContact O-C 3.58Å; D252-R255 PolarHBondContact O-N 2.83Å; R255-I257 PolarHBondContact O-N 3.32Å
256	R	60.2	Low	66.4	Low	244 Å²	244	132.5 Å²	132.5	92%	0.921	64%	0.642	S	S	*	*	S	Bend	trans	-67.6	46.8	180	-160.6	-169.1	-92.5	-147.3	-3.4	111.9
257	I	60.3	Low	68.2	Low	121 Å²	121	132.5 Å²	132.5	62%	0.621	64%	0.644	S	S	*	*	S	Bend	trans	-134.2	118.8	-179.1	-58.4	172.3	0	0	0	105	R255 V259	R255-I257 PolarHBondContact O-N 3.32Å; I257-V259 PolarHBondContact O-N 2.75Å
258	T	66.5	Low	70.3	Confident	45 Å²	45	131.1 Å²	131.1	28%	0.276	63%	0.629	S	S	.	*			trans	-72.9	115.8	171.7	52.9	0	0	0	0	108.2	Q249 F251 R260	Q249-T258 HydrophobicContact CG-CG2 4Å; Q249-T258 PolarHBondContact NE2-OG1 3.42Å; F251-T258 HydrophobicContact CD2-CG2 4.25Å; T258-R260 PolarHBondContact O-N 3.34Å
259	V	62.4	Low	72.3	Confident	97 Å²	97	129.3 Å²	129.3	59%	0.588	61%	0.609	S	S	*	*			trans	-74.8	80.1	173.4	-175.3	0	0	0	0	107	I257	I257-V259 PolarHBondContact O-N 2.75Å
260	R	69.5	Low	74.2	Confident	161 Å²	161	129.6 Å²	129.6	61%	0.608	61%	0.609	S	S	*	*			trans	-67.5	133.6	166	-65.8	-167.3	-167.2	101.5	-3.4	107.5	Q249 T258 L262	Q249-R260 HydrophobicContact CG-CG 4.39Å; Q249-R260 VanDerWaalsContact NE2-NE 3.11Å; T258-R260 PolarHBondContact O-N 3.34Å; R260-L262 PolarHBondContact O-N 3.26Å
261	N	76	Confident	76.2	Confident	135 Å²	135	128.4 Å²	128.4	72%	0.722	60%	0.595	S	S	*	*			trans	-58.6	124	170.3	-71	-37.5	0	0	0	108.2	R263	N261-R263 PolarHBondContact O-N 3.15Å
262	L	84.3	Confident	78.3	Confident	174 Å²	174	125 Å²	125	91%	0.911	58%	0.584	S	S	*	*	S	Bend	trans	-66.2	-20.5	-179.1	-85.1	74.7	0	0	0	112.5	R260 I264	R260-L262 PolarHBondContact O-N 3.26Å; L262-I264 PolarHBondContact O-N 3.3Å
263	R	89.3	Confident	80.2	Confident	149 Å²	149	123.9 Å²	123.9	56%	0.562	57%	0.574	S	S	*	*	S	Bend	trans	-78	118.8	177.6	-178.8	175.1	177.9	-172.4	-2.1	109.6	N261 R265	N261-R263 PolarHBondContact O-N 3.15Å; R263-R265 PolarHBondContact O-N 3.42Å
264	I	91.4	Very high	81.6	Confident	97 Å²	97	120.1 Å²	120.1	50%	0.497	55%	0.545	S	S	.	.			trans	-61.8	126.7	168.6	-59.1	171	0	0	0	108	L262 E266 D267	L262-I264 PolarHBondContact O-N 3.3Å; I264-E266 HydrophobicContact CG2-CB 4.13Å; I264-E266 WeakPolarHBondContact CG2-OE2 3.42Å; I264-D267 HydrophobicContact CB-CB 4.44Å; I264-D267 HydrophobicContact CG2-CB 4.27Å
265	R	90.4	Very high	82.8	Confident	231 Å²	231	117.9 Å²	117.9	87%	0.872	54%	0.542	S	S	*	.	S	Bend	trans	-83.4	-28.5	-172.6	-175.8	178.2	174.2	123.7	-0.4	111.5	R263 D267	R263-R265 PolarHBondContact O-N 3.42Å; R265-D267 VanDerWaalsContact C-N 3.27Å; R265-D267 PolarHBondContact O-N 3.48Å
266	E	90.1	Very high	84.4	Confident	153 Å²	153	114.1 Å²	114.1	72%	0.715	54%	0.535	S	S	*	.	S	Bend	trans	-64	-33.8	177.6	-58.6	74.6	-164.3	0	0	110.9	I264 I268	I264-E266 HydrophobicContact CG2-CB 4.13Å; I264-E266 WeakPolarHBondContact CG2-OE2 3.42Å; E266-I268 PolarHBondContact O-N 3.08Å
267	D	92.6	Very high	86	Confident	105 Å²	105	108.5 Å²	108.5	56%	0.561	53%	0.531	S	S	*	.	S	Bend	trans	-82	101.2	179.7	-71.7	-25.2	0	0	0	112.2	I264 R265 A269	I264-D267 HydrophobicContact CB-CB 4.44Å; I264-D267 HydrophobicContact CG2-CB 4.27Å; R265-D267 VanDerWaalsContact C-N 3.27Å; R265-D267 PolarHBondContact O-N 3.48Å; D267-A269 PolarHBondContact O-N 3.06Å
268	I	92.2	Very high	87.4	Confident	93 Å²	93	110.1 Å²	110.1	48%	0.477	54%	0.54	S	S	.	.			trans	-68.3	123.2	174.1	-55.3	169.5	0	0	0	109.5	E266 L272 R273	E266-I268 PolarHBondContact O-N 3.08Å; I268-L272 HydrophobicContact CG2-CB 4.06Å; I268-R273 PolarHBondContact O-NH2 3.29Å
269	A	94.4	Very high	88.5	Confident	22 Å²	22	109.5 Å²	109.5	18%	0.182	54%	0.538	C	S	.	.			trans	-58.4	143.1	175.2	0	0	0	0	0	111.4	D267 Y271 L272	D267-A269 PolarHBondContact O-N 3.06Å; A269-Y271 VanDerWaalsContact C-N 3.33Å; A269-Y271 HydrophobicContact CB-CD1 4.16Å; A269-Y271 HydrophobicContact CB-CE1 3.66Å; A269-Y271 PolarHBondContact O-N 3.27Å; A269-L272 HydrophobicContact CB-CD1 4.17Å; A269-L272 HydrophobicContact CB-CG 4.31Å; A269-L272 PolarHBondContact O-N 2.88Å
270	K	94.3	Very high	89.9	Confident	57 Å²	57	105.7 Å²	105.7	25%	0.248	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-52.2	-46.5	-173.6	-62.7	179.3	178	-177.1	0	113.1	L272 R273 Y282 R287 M289 Y306 D309	K270-L272 VanDerWaalsContact C-N 3.29Å; K270-L272 PolarHBondContact O-N 2.99Å; K270-R273 WeakPolarHBondContact O-CB 3.47Å; K270-R273 PolarHBondContact O-N 3.09Å; K270-Y282 HydrophobicContact CB-CD2 3.94Å; K270-Y282 HydrophobicContact CB-CE2 4Å; K270-Y282 HydrophobicContact CD-CE2 4.25Å; K270-R287 PolarHBondContact NZ-O 3.45Å; K270-M289 VanDerWaalsContact C-CE 3.41Å; K270-M289 HydrophobicContact CB-CB 4.14Å; K270-M289 HydrophobicContact CB-CE 4.06Å; K270-M289 HydrophobicContact CB-SD 4.27Å; K270-M289 HydrophobicContact CD-CB 4.01Å; K270-M289 WeakPolarHBondContact O-CE 3.26Å; K270-Y306 HydrophobicContact CD-CE1 4.34Å; K270-Y306 HydrophobicContact CD-CE2 4.43Å; K270-Y306 WeakPolarHBondContact CD-OH 3.37Å; K270-Y306 WeakPolarHBondContact CE-OH 3.45Å; K270-Y306 HydrophobicContact CG-CE1 4.27Å; K270-Y306 PolarHBondContact NZ-OH 3.41Å; K270-D309 IonicContact NZ-OD1 3.83Å; K270-D309 PolarHBondContact NZ-OD1 3.36Å; K270-D309 IonicContact NZ-OD2 3.1Å; K270-D309 PolarHBondContact NZ-OD2 3.07Å
271	Y	94.8	Very high	91.1	Very high	108 Å²	108	106.5 Å²	106.5	42%	0.424	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-72.8	-13.2	-179.4	60.3	-91.3	0	0	0	115	A269 R273 Y282	A269-Y271 VanDerWaalsContact C-N 3.33Å; A269-Y271 HydrophobicContact CB-CD1 4.16Å; A269-Y271 HydrophobicContact CB-CE1 3.66Å; A269-Y271 PolarHBondContact O-N 3.27Å; Y271-R273 VanDerWaalsContact C-N 3.31Å; Y271-Y282 AromaticContact CD1-CD1 3.65Å; Y271-Y282 HydrophobicContact CD1-CD1 3.65Å; Y271-Y282 HydrophobicContact CD1-CD2 4.42Å; Y271-Y282 AromaticContact CD1-CE1 3.39Å; Y271-Y282 HydrophobicContact CD1-CE1 3.39Å; Y271-Y282 HydrophobicContact CD1-CE2 4.22Å; Y271-Y282 HydrophobicContact CD1-CG 4.15Å; Y271-Y282 AromaticContact CD1-CZ 3.7Å; Y271-Y282 AromaticContact CE1-CE1 3.99Å; Y271-Y282 HydrophobicContact CE1-CE1 3.99Å; Y271-Y282 HydrophobicContact CG-CD1 4.08Å; Y271-Y282 HydrophobicContact CG-CE1 4.26Å; Y271-Y282 HydrophobicContact CG-CG 4.47Å
272	L	94.5	Very high	92.1	Very high	78 Å²	78	102.4 Å²	102.4	41%	0.408	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-90.8	-2.4	174.2	-63.6	177.7	0	0	0	112	I268 A269 K270 L275	I268-L272 HydrophobicContact CG2-CB 4.06Å; A269-L272 HydrophobicContact CB-CD1 4.17Å; A269-L272 HydrophobicContact CB-CG 4.31Å; A269-L272 PolarHBondContact O-N 2.88Å; K270-L272 VanDerWaalsContact C-N 3.29Å; K270-L272 PolarHBondContact O-N 2.99Å; L272-L275 WeakPolarHBondContact O-CD1 3.43Å
273	R	91.4	Very high	92.6	Very high	51 Å²	51	96.1 Å²	96.1	19%	0.192	46%	0.463	C	S	.	.	S	Bend	trans	-71.5	-35.7	-176.1	-163	63.9	65	103.4	0.4	111.9	I268 K270 Y271 P293 Y294	I268-R273 PolarHBondContact O-NH2 3.29Å; K270-R273 WeakPolarHBondContact O-CB 3.47Å; K270-R273 PolarHBondContact O-N 3.09Å; Y271-R273 VanDerWaalsContact C-N 3.31Å; R273-P293 HydrophobicContact CB-CB 4.38Å; R273-P293 HydrophobicContact CB-CG 4.09Å; R273-P293 HydrophobicContact CG-CG 3.9Å; R273-Y294 WeakPolarHBondContact CD-OH 3.34Å; R273-Y294 HydrophobicContact CG-CD2 4.29Å; R273-Y294 HydrophobicContact CG-CE1 4.44Å; R273-Y294 HydrophobicContact CG-CE2 3.27Å; R273-Y294 WeakPolarHBondContact CG-OH 3Å
274	N	91.6	Very high	93	Very high	28 Å²	28	93.2 Å²	93.2	15%	0.15	46%	0.464	C	S	.	.			trans	-136	126.2	166.9	-171.8	-15.2	0	0	0	108.5	D276 S279 P293	N274-D276 WeakPolarHBondContact OD1-CB 3.22Å; N274-D276 PolarHBondContact OD1-N 2.93Å; N274-D276 PolarHBondContact OD1-OD2 3.04Å; N274-S279 VanDerWaalsContact CG-CB 3.43Å; N274-S279 VanDerWaalsContact ND2-CB 3.32Å; N274-S279 WeakPolarHBondContact ND2-CB 3.39Å; N274-P293 HydrophobicContact CB-CB 3.94Å; N274-P293 PolarHBondContact ND2-O 2.79Å
275	L	93.6	Very high	93.2	Very high	144 Å²	144	96.9 Å²	96.9	75%	0.754	48%	0.476	S	S	*	.			trans	-89.2	-6.7	-176.9	-74.6	77.6	0	0	0	112.5	L272	L272-L275 WeakPolarHBondContact O-CD1 3.43Å
276	D	93	Very high	93.5	Very high	104 Å²	104	90.3 Å²	90.3	56%	0.556	46%	0.462	S	S	*	.			trans	-64.4	128	174	-64.6	-31.6	0	0	0	109.3	N274 N278 S279	N274-D276 WeakPolarHBondContact OD1-CB 3.22Å; N274-D276 PolarHBondContact OD1-N 2.93Å; N274-D276 PolarHBondContact OD1-OD2 3.04Å; D276-N278 PolarHBondContact O-N 3.4Å; D276-N278 VanDerWaalsContact O-N 3.12Å; D276-S279 VanDerWaalsContact O-CB 3.28Å; D276-S279 WeakPolarHBondContact O-CB 3.29Å; D276-S279 PolarHBondContact O-N 3.49Å; D276-S279 VanDerWaalsContact O-N 3.1Å; D276-S279 PolarHBondContact O-OG 2.9Å
277	P	92.6	Very high	93.8	Very high	126 Å²	126	91.1 Å²	91.1	82%	0.818	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.4	-174.9	25.4	-34.6	0	0	0	113
278	N	90.9	Very high	93.9	Very high	154 Å²	154	87.1 Å²	87.1	82%	0.824	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	15.5	-179.1	-60.9	-21.1	0	0	0	113	D276	D276-N278 PolarHBondContact O-N 3.4Å; D276-N278 VanDerWaalsContact O-N 3.12Å
279	S	89.1	Confident	94	Very high	32 Å²	32	82.8 Å²	82.8	22%	0.224	42%	0.417	C	S	.	.	S	Bend	trans	-72	-80.7	-177	55.8	0	0	0	0	112.6	N274 D276	N274-S279 VanDerWaalsContact CG-CB 3.43Å; N274-S279 VanDerWaalsContact ND2-CB 3.32Å; N274-S279 WeakPolarHBondContact ND2-CB 3.39Å; D276-S279 VanDerWaalsContact O-CB 3.28Å; D276-S279 WeakPolarHBondContact O-CB 3.29Å; D276-S279 PolarHBondContact O-N 3.49Å; D276-S279 VanDerWaalsContact O-N 3.1Å; D276-S279 PolarHBondContact O-OG 2.9Å
280	A	91.9	Very high	93.9	Very high	18 Å²	18	88.1 Å²	88.1	15%	0.149	43%	0.433	C	S	.	.			trans	-143.2	137.2	177.3	0	0	0	0	0	110.2	Y282 M289 E291 P293	A280-Y282 PolarHBondContact O-N 3.4Å; A280-M289 HydrophobicContact CB-CE 4.39Å; A280-M289 HydrophobicContact CB-CG 4.09Å; A280-M289 HydrophobicContact CB-SD 4.05Å; A280-E291 HydrophobicContact CB-CB 4.18Å; A280-P293 HydrophobicContact CB-CB 4.29Å
281	Y	95.4	Very high	93.8	Very high	178 Å²	178	90.8 Å²	90.8	70%	0.698	45%	0.446	S	S	*	.			trans	-70.6	122.6	178.5	-176.9	-104.1	0	0	0	111	D283	Y281-D283 HydrophobicContact CE1-CB 3.96Å
282	Y	96	Very high	93.6	Very high	48 Å²	48	87.1 Å²	87.1	19%	0.188	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.8	170.5	174.5	-101.9	0	0	0	109.2	K270 Y271 A280 P284 R287 M289	K270-Y282 HydrophobicContact CB-CD2 3.94Å; K270-Y282 HydrophobicContact CB-CE2 4Å; K270-Y282 HydrophobicContact CD-CE2 4.25Å; Y271-Y282 AromaticContact CD1-CD1 3.65Å; Y271-Y282 HydrophobicContact CD1-CD1 3.65Å; Y271-Y282 HydrophobicContact CD1-CD2 4.42Å; Y271-Y282 AromaticContact CD1-CE1 3.39Å; Y271-Y282 HydrophobicContact CD1-CE1 3.39Å; Y271-Y282 HydrophobicContact CD1-CE2 4.22Å; Y271-Y282 HydrophobicContact CD1-CG 4.15Å; Y271-Y282 AromaticContact CD1-CZ 3.7Å; Y271-Y282 AromaticContact CE1-CE1 3.99Å; Y271-Y282 HydrophobicContact CE1-CE1 3.99Å; Y271-Y282 HydrophobicContact CG-CD1 4.08Å; Y271-Y282 HydrophobicContact CG-CE1 4.26Å; Y271-Y282 HydrophobicContact CG-CG 4.47Å; A280-Y282 PolarHBondContact O-N 3.4Å; Y282-P284 HydrophobicContact CD1-CB 4.4Å; Y282-P284 HydrophobicContact CE1-CB 4.03Å; Y282-P284 WeakPolarHBondContact O-CD 3.09Å; Y282-R287 HydrophobicContact CE2-CB 4.45Å; Y282-R287 WeakPolarHBondContact OH-CA 3.4Å; Y282-R287 WeakPolarHBondContact OH-CB 3.25Å; Y282-M289 HydrophobicContact CD2-CB 4.17Å
283	D	95.9	Very high	93.5	Very high	43 Å²	43	83.6 Å²	83.6	23%	0.23	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	108.3	172.2	176	12	0	0	0	109.7	Y281 K285 T286 R287 A288	Y281-D283 HydrophobicContact CE1-CB 3.96Å; D283-K285 PolarHBondContact O-N 2.78Å; D283-K285 VanDerWaalsContact OD1-CB 3.23Å; D283-K285 WeakPolarHBondContact OD1-CB 3.32Å; D283-K285 PolarHBondContact OD1-N 3.24Å; D283-T286 WeakPolarHBondContact OD2-CG2 3.35Å; D283-T286 PolarHBondContact OD2-N 2.94Å; D283-T286 PolarHBondContact OD2-OG1 2.53Å; D283-R287 VanDerWaalsContact O-CA 3.23Å; D283-R287 WeakPolarHBondContact O-CA 3.21Å; D283-R287 PolarHBondContact O-N 3.43Å; D283-A288 PolarHBondContact N-O 3.29Å; D283-A288 PolarHBondContact O-N 2.91Å
284	P	96.1	Very high	93.3	Very high	88 Å²	88	83.6 Å²	83.6	57%	0.571	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.4	-179.4	29.6	-35.9	0	0	0	113.3	Y282	Y282-P284 HydrophobicContact CD1-CB 4.4Å; Y282-P284 HydrophobicContact CE1-CB 4.03Å; Y282-P284 WeakPolarHBondContact O-CD 3.09Å
285	K	97.3	Very high	92.9	Very high	174 Å²	174	85.8 Å²	85.8	76%	0.757	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-54.2	179.7	-175.3	176.5	-179.4	175.1	0	110.9	D283 R287	D283-K285 PolarHBondContact O-N 2.78Å; D283-K285 VanDerWaalsContact OD1-CB 3.23Å; D283-K285 WeakPolarHBondContact OD1-CB 3.32Å; D283-K285 PolarHBondContact OD1-N 3.24Å; K285-R287 PolarHBondContact O-NH1 3.08Å
286	T	96.1	Very high	92.5	Very high	93 Å²	93	86 Å²	86	57%	0.571	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-10.3	-179.9	59.3	0	0	0	0	113.2	D283 A288	D283-T286 WeakPolarHBondContact OD2-CG2 3.35Å; D283-T286 PolarHBondContact OD2-N 2.94Å; D283-T286 PolarHBondContact OD2-OG1 2.53Å; T286-A288 PolarHBondContact O-N 3.39Å
287	R	95.5	Very high	91.9	Very high	170 Å²	170	84.5 Å²	84.5	64%	0.642	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	33	-176.7	-55.6	168	177	76.2	-2.3	112.5	K270 Y282 D283 K285	K270-R287 PolarHBondContact NZ-O 3.45Å; Y282-R287 HydrophobicContact CE2-CB 4.45Å; Y282-R287 WeakPolarHBondContact OH-CA 3.4Å; Y282-R287 WeakPolarHBondContact OH-CB 3.25Å; D283-R287 VanDerWaalsContact O-CA 3.23Å; D283-R287 WeakPolarHBondContact O-CA 3.21Å; D283-R287 PolarHBondContact O-N 3.43Å; K285-R287 PolarHBondContact O-NH1 3.08Å
288	A	94.7	Very high	91	Very high	20 Å²	20	82 Å²	82	17%	0.165	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.7	-179.4	0	0	0	0	0	110.7	D283 T286 D309	D283-A288 PolarHBondContact N-O 3.29Å; D283-A288 PolarHBondContact O-N 2.91Å; T286-A288 PolarHBondContact O-N 3.39Å; A288-D309 WeakPolarHBondContact CA-OD2 3.49Å
289	M	94.3	Very high	90.4	Very high	3 Å²	3	80.8 Å²	80.8	2%	0.015	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.1	170	180	178	-82.5	0	0	107.1	K270 A280 Y282 E291 P293 Y306 D309	K270-M289 VanDerWaalsContact C-CE 3.41Å; K270-M289 HydrophobicContact CB-CB 4.14Å; K270-M289 HydrophobicContact CB-CE 4.06Å; K270-M289 HydrophobicContact CB-SD 4.27Å; K270-M289 HydrophobicContact CD-CB 4.01Å; K270-M289 WeakPolarHBondContact O-CE 3.26Å; A280-M289 HydrophobicContact CB-CE 4.39Å; A280-M289 HydrophobicContact CB-CG 4.09Å; A280-M289 HydrophobicContact CB-SD 4.05Å; Y282-M289 HydrophobicContact CD2-CB 4.17Å; M289-E291 WeakPolarHBondContact CG-O 3.38Å; M289-P293 HydrophobicContact SD-CB 3.97Å; M289-P293 HydrophobicContact SD-CG 3.77Å; M289-Y306 HydrophobicContact CB-CE1 4.18Å; M289-Y306 HydrophobicContact CG-CE1 4.33Å; M289-Y306 PolarHBondContact O-OH 3.16Å; M289-Y306 VanDerWaalsContact O-OH 3.14Å; M289-Y306 HydrophobicContact SD-CE1 3.9Å; M289-D309 PolarHBondContact N-OD2 3.26Å; M289-D309 VanDerWaalsContact N-OD2 3.09Å; M289-D309 WeakPolarHBondContact O-CB 3.39Å; M289-D309 PolarHBondContact O-N 2.94Å
290	R	92.3	Very high	89.7	Confident	133 Å²	133	83.6 Å²	83.6	50%	0.502	43%	0.431	S	S	.	.			trans	-80.9	-56.2	-168.8	-153.5	78.5	81.5	100.2	6.3	111.6	D309 N310	R290-D309 PolarHBondContact O-N 3.39Å; R290-N310 VanDerWaalsContact CD-OD1 3.22Å; R290-N310 WeakPolarHBondContact CD-OD1 3.34Å; R290-N310 WeakPolarHBondContact CG-ND2 3.43Å; R290-N310 VanDerWaalsContact CG-OD1 3.29Å; R290-N310 WeakPolarHBondContact CG-OD1 3.19Å; R290-N310 WeakPolarHBondContact O-CB 3.13Å; R290-N310 PolarHBondContact O-N 3.48Å; R290-N310 VanDerWaalsContact O-N 3.16Å
291	E	92.5	Very high	88.7	Confident	113 Å²	113	85 Å²	85	53%	0.528	44%	0.439	S	S	.	.	S	Bend	trans	-84.1	163.6	-178.5	-58.4	-51.4	131.3	0	0	112	A280 M289 N310	A280-E291 HydrophobicContact CB-CB 4.18Å; M289-E291 WeakPolarHBondContact CG-O 3.38Å; E291-N310 PolarHBondContact OE1-ND2 3.03Å
292	N	91.4	Very high	87.7	Confident	32 Å²	32	83 Å²	83	17%	0.171	44%	0.441	C	S	.	.			trans	-75.7	122.1	175.9	-175.2	-4	0	0	0	110.6	Y294 A295 A307	N292-Y294 PolarHBondContact O-N 3.09Å; N292-Y294 VanDerWaalsContact O-N 3.11Å; N292-Y294 WeakPolarHBondContact OD1-CB 3.36Å; N292-Y294 PolarHBondContact OD1-N 2.94Å; N292-A295 PolarHBondContact O-N 3.14Å; N292-A307 WeakPolarHBondContact CB-O 3.43Å
293	P	91	Very high	86.6	Confident	3 Å²	3	87.5 Å²	87.5	2%	0.019	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.9	176.6	26.6	-33.9	0	0	0	113.8	R273 N274 A280 M289 Y306	R273-P293 HydrophobicContact CB-CB 4.38Å; R273-P293 HydrophobicContact CB-CG 4.09Å; R273-P293 HydrophobicContact CG-CG 3.9Å; N274-P293 HydrophobicContact CB-CB 3.94Å; N274-P293 PolarHBondContact ND2-O 2.79Å; A280-P293 HydrophobicContact CB-CB 4.29Å; M289-P293 HydrophobicContact SD-CB 3.97Å; M289-P293 HydrophobicContact SD-CG 3.77Å; P293-Y306 HydrophobicContact CG-CD1 4.35Å
294	Y	88.7	Confident	85.8	Confident	51 Å²	51	86.3 Å²	86.3	20%	0.2	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	9.1	-176.3	-65.8	-69	0	0	0	115	R273 N292 N296 T297 V304	R273-Y294 WeakPolarHBondContact CD-OH 3.34Å; R273-Y294 HydrophobicContact CG-CD2 4.29Å; R273-Y294 HydrophobicContact CG-CE1 4.44Å; R273-Y294 HydrophobicContact CG-CE2 3.27Å; R273-Y294 WeakPolarHBondContact CG-OH 3Å; N292-Y294 PolarHBondContact O-N 3.09Å; N292-Y294 VanDerWaalsContact O-N 3.11Å; N292-Y294 WeakPolarHBondContact OD1-CB 3.36Å; N292-Y294 PolarHBondContact OD1-N 2.94Å; Y294-N296 PolarHBondContact O-N 3.14Å; Y294-T297 WeakPolarHBondContact CB-OG1 3.33Å; Y294-T297 HydrophobicContact CD1-CG2 4.33Å; Y294-T297 PolarHBondContact O-N 2.92Å; Y294-T297 PolarHBondContact O-OG1 3.09Å; Y294-V304 HydrophobicContact CD2-CB 4.47Å; Y294-V304 HydrophobicContact CD2-CG1 3.19Å; Y294-V304 HydrophobicContact CE2-CG1 3.3Å; Y294-V304 HydrophobicContact CG-CG1 4.05Å
295	A	83.8	Confident	85.2	Confident	74 Å²	74	85.9 Å²	85.9	61%	0.612	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-36.4	-174	0	0	0	0	0	114.3	N292	N292-A295 PolarHBondContact O-N 3.14Å
296	N	84	Confident	84.9	Confident	149 Å²	149	79.1 Å²	79.1	80%	0.797	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.1	-176.9	-59.3	-28.2	0	0	0	114.3	Y294	Y294-N296 PolarHBondContact O-N 3.14Å
297	T	79.6	Confident	84.7	Confident	73 Å²	73	75.2 Å²	75.2	45%	0.448	42%	0.416	S	S	.	.	S	Bend	trans	-92.3	-2	-170.7	61.5	0	0	0	0	114.1	Y294 K299	Y294-T297 WeakPolarHBondContact CB-OG1 3.33Å; Y294-T297 HydrophobicContact CD1-CG2 4.33Å; Y294-T297 PolarHBondContact O-N 2.92Å; Y294-T297 PolarHBondContact O-OG1 3.09Å; T297-K299 PolarHBondContact O-N 3.01Å; T297-K299 VanDerWaalsContact O-N 3.09Å
298	G	74.3	Confident	84.5	Confident	73 Å²	73	67.1 Å²	67.1	75%	0.753	39%	0.386	S	S	*	.			trans	66.8	7	176.6	0	0	0	0	0	115.1
299	K	77.6	Confident	84.4	Confident	128 Å²	128	67.6 Å²	67.6	56%	0.557	39%	0.385	S	S	*	.			trans	-76.9	135.3	173.2	-63.7	-171.1	177.2	-171.3	0	109.8	T297 V304	T297-K299 PolarHBondContact O-N 3.01Å; T297-K299 VanDerWaalsContact O-N 3.09Å; K299-V304 HydrophobicContact CB-CG2 3.67Å; K299-V304 HydrophobicContact CD-CG2 4.33Å
300	N	75.8	Confident	84.3	Confident	91 Å²	91	69.8 Å²	69.8	49%	0.487	40%	0.397	S	S	.	.			trans	-61.9	141.4	175.8	-64.9	-42.6	0	0	0	109.8	D302 E303 V304	N300-D302 PolarHBondContact O-N 3.37Å; N300-D302 VanDerWaalsContact O-N 3.14Å; N300-E303 HydrophobicContact CB-CG 4.27Å; N300-E303 PolarHBondContact ND2-OE1 2.93Å; N300-E303 PolarHBondContact O-N 2.76Å; N300-E303 VanDerWaalsContact O-N 3.14Å; N300-V304 VanDerWaalsContact O-CG2 3.32Å; N300-V304 WeakPolarHBondContact O-CG2 3.29Å
301	P	71.1	Confident	84.3	Confident	49 Å²	49	68.4 Å²	68.4	32%	0.318	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-60	-26.8	-178.4	25.4	-34.4	0	0	0	112.7	V304 A307 F311	P301-V304 PolarHBondContact O-N 3.48Å; P301-A307 HydrophobicContact CB-CB 3.85Å; P301-F311 HydrophobicContact CB-CE2 4.18Å; P301-F311 HydrophobicContact CB-CZ 4.22Å; P301-F311 HydrophobicContact CG-CE2 4.37Å
302	D	73.6	Confident	84.3	Confident	136 Å²	136	67.1 Å²	67.1	73%	0.727	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-78	-24.1	-178.3	-57.1	-28.8	0	0	0	113.1	N300 V304	N300-D302 PolarHBondContact O-N 3.37Å; N300-D302 VanDerWaalsContact O-N 3.14Å; D302-V304 VanDerWaalsContact C-N 3.3Å
303	E	72.6	Confident	84.3	Confident	141 Å²	141	71.1 Å²	71.1	66%	0.659	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-85.2	-9.3	177	-68.8	170	-153.5	0	0	112.3	N300	N300-E303 HydrophobicContact CB-CG 4.27Å; N300-E303 PolarHBondContact ND2-OE1 2.93Å; N300-E303 PolarHBondContact O-N 2.76Å; N300-E303 VanDerWaalsContact O-N 3.14Å
304	V	80	Confident	84.4	Confident	18 Å²	18	79.2 Å²	79.2	11%	0.109	44%	0.439	C	S	.	.	S	Bend	trans	-104.4	125.7	-171.9	177.3	0	0	0	0	109.4	Y294 K299 N300 P301 D302 Y306	Y294-V304 HydrophobicContact CD2-CB 4.47Å; Y294-V304 HydrophobicContact CD2-CG1 3.19Å; Y294-V304 HydrophobicContact CE2-CG1 3.3Å; Y294-V304 HydrophobicContact CG-CG1 4.05Å; K299-V304 HydrophobicContact CB-CG2 3.67Å; K299-V304 HydrophobicContact CD-CG2 4.33Å; N300-V304 VanDerWaalsContact O-CG2 3.32Å; N300-V304 WeakPolarHBondContact O-CG2 3.29Å; P301-V304 PolarHBondContact O-N 3.48Å; D302-V304 VanDerWaalsContact C-N 3.3Å; V304-Y306 WeakPolarHBondContact CG1-O 3.33Å; V304-Y306 PolarHBondContact O-N 3.11Å
305	G	83.9	Confident	84.6	Confident	79 Å²	79	80.9 Å²	80.9	81%	0.814	46%	0.455	S	S	*	.	S	Bend	trans	-62.4	-4.1	-179.4	0	0	0	0	0	115.9
306	Y	90.1	Very high	85	Confident	33 Å²	33	79.6 Å²	79.6	13%	0.129	45%	0.448	C	S	.	.			trans	-160.7	113.6	170.7	-175.6	-102.8	0	0	0	111.5	K270 M289 P293 V304 D309	K270-Y306 HydrophobicContact CD-CE1 4.34Å; K270-Y306 HydrophobicContact CD-CE2 4.43Å; K270-Y306 WeakPolarHBondContact CD-OH 3.37Å; K270-Y306 WeakPolarHBondContact CE-OH 3.45Å; K270-Y306 HydrophobicContact CG-CE1 4.27Å; K270-Y306 PolarHBondContact NZ-OH 3.41Å; M289-Y306 HydrophobicContact CB-CE1 4.18Å; M289-Y306 HydrophobicContact CG-CE1 4.33Å; M289-Y306 PolarHBondContact O-OH 3.16Å; M289-Y306 VanDerWaalsContact O-OH 3.14Å; M289-Y306 HydrophobicContact SD-CE1 3.9Å; P293-Y306 HydrophobicContact CG-CD1 4.35Å; V304-Y306 WeakPolarHBondContact CG1-O 3.33Å; V304-Y306 PolarHBondContact O-N 3.11Å; Y306-D309 PolarHBondContact OH-N 2.94Å; Y306-D309 PolarHBondContact OH-OD1 3.44Å; Y306-D309 PolarHBondContact OH-OD2 3.47Å
307	A	91.4	Very high	85.5	Confident	11 Å²	11	79 Å²	79	9%	0.091	45%	0.445	C	S	.	.			trans	-104.7	22.2	-178.7	0	0	0	0	0	114	N292 P301 F311	N292-A307 WeakPolarHBondContact CB-O 3.43Å; P301-A307 HydrophobicContact CB-CB 3.85Å; A307-F311 HydrophobicContact CB-CB 4.27Å; A307-F311 HydrophobicContact CB-CD1 3.87Å; A307-F311 HydrophobicContact CB-CE1 4.38Å; A307-F311 HydrophobicContact CB-CG 4.05Å
308	G	92	Very high	86.3	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	44%	0.442	C	S	.	.			trans	91.9	153	-178.4	0	0	0	0	0	113.9	N310 F311	G308-N310 VanDerWaalsContact C-N 3.29Å; G308-N310 PolarHBondContact O-N 2.84Å; G308-F311 PolarHBondContact O-N 3.18Å
309	D	93.1	Very high	87.3	Confident	29 Å²	29	79 Å²	79	16%	0.155	43%	0.427	C	S	.	.	H	α-helix	trans	-67.9	-29.6	-178.9	-67.9	-25.7	0	0	0	111.5	K270 A288 M289 R290 Y306 F311 V312 R313	K270-D309 IonicContact NZ-OD1 3.83Å; K270-D309 PolarHBondContact NZ-OD1 3.36Å; K270-D309 IonicContact NZ-OD2 3.1Å; K270-D309 PolarHBondContact NZ-OD2 3.07Å; A288-D309 WeakPolarHBondContact CA-OD2 3.49Å; M289-D309 PolarHBondContact N-OD2 3.26Å; M289-D309 VanDerWaalsContact N-OD2 3.09Å; M289-D309 WeakPolarHBondContact O-CB 3.39Å; M289-D309 PolarHBondContact O-N 2.94Å; R290-D309 PolarHBondContact O-N 3.39Å; Y306-D309 PolarHBondContact OH-N 2.94Å; Y306-D309 PolarHBondContact OH-OD1 3.44Å; Y306-D309 PolarHBondContact OH-OD2 3.47Å; D309-F311 VanDerWaalsContact C-N 3.32Å; D309-F311 PolarHBondContact O-N 3.14Å; D309-V312 PolarHBondContact O-N 2.75Å; D309-R313 WeakPolarHBondContact O-CB 3.32Å; D309-R313 WeakPolarHBondContact O-CD 3.47Å; D309-R313 WeakPolarHBondContact O-CG 3.35Å; D309-R313 PolarHBondContact O-N 2.67Å
310	N	92.1	Very high	88.2	Confident	49 Å²	49	75.4 Å²	75.4	26%	0.262	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-37.1	177.4	-85.1	-5.9	0	0	0	113	R290 E291 G308 V312 R313	R290-N310 VanDerWaalsContact CD-OD1 3.22Å; R290-N310 WeakPolarHBondContact CD-OD1 3.34Å; R290-N310 WeakPolarHBondContact CG-ND2 3.43Å; R290-N310 VanDerWaalsContact CG-OD1 3.29Å; R290-N310 WeakPolarHBondContact CG-OD1 3.19Å; R290-N310 WeakPolarHBondContact O-CB 3.13Å; R290-N310 PolarHBondContact O-N 3.48Å; R290-N310 VanDerWaalsContact O-N 3.16Å; E291-N310 PolarHBondContact OE1-ND2 3.03Å; G308-N310 VanDerWaalsContact C-N 3.29Å; G308-N310 PolarHBondContact O-N 2.84Å; N310-V312 VanDerWaalsContact C-N 3.34Å; N310-R313 PolarHBondContact O-N 2.96Å
311	F	91.6	Very high	89.1	Confident	105 Å²	105	76.3 Å²	76.3	46%	0.461	42%	0.42	S	S	.	.	H	α-helix	trans	-63.1	-42.2	178.4	-179.2	-103	0	0	0	111.3	P301 A307 G308 D309	P301-F311 HydrophobicContact CB-CE2 4.18Å; P301-F311 HydrophobicContact CB-CZ 4.22Å; P301-F311 HydrophobicContact CG-CE2 4.37Å; A307-F311 HydrophobicContact CB-CB 4.27Å; A307-F311 HydrophobicContact CB-CD1 3.87Å; A307-F311 HydrophobicContact CB-CE1 4.38Å; A307-F311 HydrophobicContact CB-CG 4.05Å; G308-F311 PolarHBondContact O-N 3.18Å; D309-F311 VanDerWaalsContact C-N 3.32Å; D309-F311 PolarHBondContact O-N 3.14Å
312	V	92.1	Very high	90.4	Very high	86 Å²	86	76.5 Å²	76.5	52%	0.521	43%	0.426	S	S	.	.	H	α-helix	trans	-80.4	-26.1	-179.8	-176.2	0	0	0	0	112.4	D309 N310 Y314 T315	D309-V312 PolarHBondContact O-N 2.75Å; N310-V312 VanDerWaalsContact C-N 3.34Å; V312-Y314 VanDerWaalsContact C-N 3.31Å; V312-Y314 PolarHBondContact O-N 3.43Å; V312-T315 HydrophobicContact CG1-CG2 4.1Å; V312-T315 WeakPolarHBondContact O-CG2 3.34Å; V312-T315 PolarHBondContact O-N 3.26Å
313	R	92.4	Very high	91.4	Very high	115 Å²	115	74 Å²	74	43%	0.434	41%	0.409	S	S	.	.	H	α-helix	trans	-60.9	-35.3	-177.1	-85.1	167.6	-168.1	-132.6	1.5	114.4	D309 N310	D309-R313 WeakPolarHBondContact O-CB 3.32Å; D309-R313 WeakPolarHBondContact O-CD 3.47Å; D309-R313 WeakPolarHBondContact O-CG 3.35Å; D309-R313 PolarHBondContact O-N 2.67Å; N310-R313 PolarHBondContact O-N 2.96Å
314	Y	92.3	Very high	92.5	Very high	173 Å²	173	68 Å²	68	68%	0.678	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	14.4	-177.9	-59.8	-68.6	0	0	0	112.9	V312 T318 I319	V312-Y314 VanDerWaalsContact C-N 3.31Å; V312-Y314 PolarHBondContact O-N 3.43Å; Y314-T318 PolarHBondContact O-OG1 3.19Å; Y314-I319 WeakPolarHBondContact O-CD1 3.43Å; Y314-I319 VanDerWaalsContact O-CG1 3.26Å; Y314-I319 WeakPolarHBondContact O-CG1 3.44Å
315	T	92.6	Very high	93.3	Very high	87 Å²	87	68.8 Å²	68.8	53%	0.534	39%	0.385	S	S	.	.	S	Bend	trans	-89.9	154.5	173.4	-160.6	0	0	0	0	111.3	V312 T318	V312-T315 HydrophobicContact CG1-CG2 4.1Å; V312-T315 WeakPolarHBondContact O-CG2 3.34Å; V312-T315 PolarHBondContact O-N 3.26Å; T315-T318 PolarHBondContact O-OG1 3.06Å
316	G	92.9	Very high	93.9	Very high	47 Å²	47	70 Å²	70	49%	0.485	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-140.2	177.6	0	0	0	0	0	115	T318 I319	G316-T318 PolarHBondContact O-N 3.05Å; G316-T318 VanDerWaalsContact O-N 3.17Å; G316-I319 PolarHBondContact O-N 3.49Å
317	D	95.4	Very high	94.2	Very high	135 Å²	135	69.8 Å²	69.8	72%	0.722	37%	0.372	S	S	*	.	H	α-helix	trans	-69.1	-13.6	-169.7	-68.4	-28.4	0	0	0	114.6	I319 S320 M321	D317-I319 PolarHBondContact O-N 3.15Å; D317-S320 PolarHBondContact O-N 3.12Å; D317-S320 VanDerWaalsContact O-N 3.15Å; D317-M321 WeakPolarHBondContact O-CB 3.42Å; D317-M321 PolarHBondContact O-N 2.72Å
318	T	95.9	Very high	94.4	Very high	63 Å²	63	69.4 Å²	69.4	39%	0.387	37%	0.369	S	S	.	.	H	α-helix	trans	-58.5	-36.6	176.9	55.6	0	0	0	0	111.8	Y314 T315 G316 A322	Y314-T318 PolarHBondContact O-OG1 3.19Å; T315-T318 PolarHBondContact O-OG1 3.06Å; G316-T318 PolarHBondContact O-N 3.05Å; G316-T318 VanDerWaalsContact O-N 3.17Å; T318-A322 WeakPolarHBondContact O-CB 3.35Å; T318-A322 PolarHBondContact O-N 3.31Å
319	I	95.6	Very high	94.5	Very high	85 Å²	85	76.2 Å²	76.2	44%	0.436	40%	0.395	S	S	.	.	H	α-helix	trans	-67.3	-48.6	175.6	-56.4	171.2	0	0	0	110.1	Y314 G316 D317 M321 A322 Q323	Y314-I319 WeakPolarHBondContact O-CD1 3.43Å; Y314-I319 VanDerWaalsContact O-CG1 3.26Å; Y314-I319 WeakPolarHBondContact O-CG1 3.44Å; G316-I319 PolarHBondContact O-N 3.49Å; D317-I319 PolarHBondContact O-N 3.15Å; I319-M321 VanDerWaalsContact C-N 3.32Å; I319-M321 PolarHBondContact O-N 3.26Å; I319-A322 PolarHBondContact O-N 2.86Å; I319-Q323 VanDerWaalsContact O-CG 3.3Å; I319-Q323 WeakPolarHBondContact O-CG 3.35Å; I319-Q323 PolarHBondContact O-N 3.1Å
320	S	95.1	Very high	94.7	Very high	51 Å²	51	78.9 Å²	78.9	36%	0.357	41%	0.407	S	S	.	.	H	α-helix	trans	-59.9	-43.1	178.7	-64.6	0	0	0	0	111.6	D317 Q323 T324	D317-S320 PolarHBondContact O-N 3.12Å; D317-S320 VanDerWaalsContact O-N 3.15Å; S320-Q323 PolarHBondContact O-N 2.86Å; S320-T324 WeakPolarHBondContact O-CG2 3.11Å; S320-T324 PolarHBondContact O-N 3.14Å; S320-T324 PolarHBondContact O-OG1 3.46Å
321	M	96.1	Very high	94.8	Very high	111 Å²	111	77 Å²	77	55%	0.547	40%	0.397	S	S	.	.	H	α-helix	trans	-67	-37.9	176.6	-172.6	-177.2	177.7	0	0	112.2	D317 I319 T324 Q325 L340	D317-M321 WeakPolarHBondContact O-CB 3.42Å; D317-M321 PolarHBondContact O-N 2.72Å; I319-M321 VanDerWaalsContact C-N 3.32Å; I319-M321 PolarHBondContact O-N 3.26Å; M321-T324 WeakPolarHBondContact CA-OG1 3.35Å; M321-T324 PolarHBondContact O-N 2.95Å; M321-T324 PolarHBondContact O-OG1 2.95Å; M321-Q325 VanDerWaalsContact O-CB 3.28Å; M321-Q325 WeakPolarHBondContact O-CB 3.42Å; M321-Q325 PolarHBondContact O-N 3Å; M321-L340 HydrophobicContact CE-CD2 3.76Å; M321-L340 HydrophobicContact CG-CD2 4.02Å
322	A	96.6	Very high	94.9	Very high	52 Å²	52	79 Å²	79	43%	0.43	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-41.2	174.4	0	0	0	0	0	111.4	T318 I319 Q325 L326	T318-A322 WeakPolarHBondContact O-CB 3.35Å; T318-A322 PolarHBondContact O-N 3.31Å; I319-A322 PolarHBondContact O-N 2.86Å; A322-Q325 PolarHBondContact O-N 2.52Å; A322-L326 VanDerWaalsContact O-CG 3.32Å; A322-L326 WeakPolarHBondContact O-CG 3.49Å; A322-L326 PolarHBondContact O-N 3.03Å
323	Q	95.4	Very high	95.1	Very high	83 Å²	83	81.5 Å²	81.5	39%	0.388	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-42	175.5	-68	170	-1.3	0	0	112.2	I319 S320 Q325 L326 F327 Y351	I319-Q323 VanDerWaalsContact O-CG 3.3Å; I319-Q323 WeakPolarHBondContact O-CG 3.35Å; I319-Q323 PolarHBondContact O-N 3.1Å; S320-Q323 PolarHBondContact O-N 2.86Å; Q323-Q325 VanDerWaalsContact C-N 3.33Å; Q323-L326 PolarHBondContact O-N 3.4Å; Q323-F327 WeakPolarHBondContact O-CB 3.15Å; Q323-F327 PolarHBondContact O-N 3.49Å; Q323-Y351 VanDerWaalsContact CB-OH 3.28Å; Q323-Y351 WeakPolarHBondContact CB-OH 3.28Å; Q323-Y351 PolarHBondContact OE1-OH 2.97Å; Q323-Y351 VanDerWaalsContact OE1-OH 3.08Å
324	T	95.6	Very high	95.1	Very high	17 Å²	17	83 Å²	83	10%	0.104	42%	0.423	C	S	.	.	H	α-helix	trans	-66.2	-36.7	174.7	55	0	0	0	0	111.7	S320 M321 F327 A328 Y351	S320-T324 WeakPolarHBondContact O-CG2 3.11Å; S320-T324 PolarHBondContact O-N 3.14Å; S320-T324 PolarHBondContact O-OG1 3.46Å; M321-T324 WeakPolarHBondContact CA-OG1 3.35Å; M321-T324 PolarHBondContact O-N 2.95Å; M321-T324 PolarHBondContact O-OG1 2.95Å; T324-F327 WeakPolarHBondContact O-CB 3.2Å; T324-F327 PolarHBondContact O-N 2.93Å; T324-A328 WeakPolarHBondContact O-CB 3.32Å; T324-A328 PolarHBondContact O-N 3.46Å; T324-Y351 HydrophobicContact CG2-CD1 3.29Å; T324-Y351 HydrophobicContact CG2-CD2 4.24Å; T324-Y351 HydrophobicContact CG2-CE1 3.46Å; T324-Y351 VanDerWaalsContact CG2-CE1 3.46Å; T324-Y351 HydrophobicContact CG2-CE2 4.44Å; T324-Y351 HydrophobicContact CG2-CG 3.68Å
325	Q	96.3	Very high	95	Very high	33 Å²	33	77.8 Å²	77.8	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-64.6	-43.4	174.9	-175.3	68.1	5.9	0	0	111.8	M321 A322 Q323 F327 A328 W329 L340	M321-Q325 VanDerWaalsContact O-CB 3.28Å; M321-Q325 WeakPolarHBondContact O-CB 3.42Å; M321-Q325 PolarHBondContact O-N 3Å; A322-Q325 PolarHBondContact O-N 2.52Å; Q323-Q325 VanDerWaalsContact C-N 3.33Å; Q325-F327 VanDerWaalsContact C-N 3.34Å; Q325-A328 VanDerWaalsContact O-CB 3.25Å; Q325-A328 WeakPolarHBondContact O-CB 3.46Å; Q325-A328 PolarHBondContact O-N 3.09Å; Q325-W329 HydrophobicContact CG-CD2 4.36Å; Q325-W329 HydrophobicContact CG-CH2 4.09Å; Q325-W329 HydrophobicContact CG-CZ2 3.76Å; Q325-W329 PolarHBondContact O-N 2.81Å; Q325-L340 HydrophobicContact CB-CD2 4.12Å
326	L	96.6	Very high	94.8	Very high	105 Å²	105	76 Å²	76	55%	0.55	41%	0.413	S	S	.	.	H	α-helix	trans	-62.1	-42.8	174	-71.5	173.2	0	0	0	111.3	A322 Q323 A328 W329 E330	A322-L326 VanDerWaalsContact O-CG 3.32Å; A322-L326 WeakPolarHBondContact O-CG 3.49Å; A322-L326 PolarHBondContact O-N 3.03Å; Q323-L326 PolarHBondContact O-N 3.4Å; L326-A328 VanDerWaalsContact C-N 3.29Å; L326-A328 PolarHBondContact O-N 3.46Å; L326-W329 HydrophobicContact CD2-CE3 3.81Å; L326-W329 HydrophobicContact CD2-CZ3 3.85Å; L326-W329 PolarHBondContact O-N 3.43Å; L326-E330 PolarHBondContact O-N 2.69Å
327	F	96.1	Very high	94.7	Very high	28 Å²	28	81.9 Å²	81.9	12%	0.123	43%	0.428	C	S	.	.	H	α-helix	trans	-60.9	-38.9	173.4	171.6	-103.2	0	0	0	112	Q323 T324 Q325 E330 A331 L347 L350 Y351 F354	Q323-F327 WeakPolarHBondContact O-CB 3.15Å; Q323-F327 PolarHBondContact O-N 3.49Å; T324-F327 WeakPolarHBondContact O-CB 3.2Å; T324-F327 PolarHBondContact O-N 2.93Å; Q325-F327 VanDerWaalsContact C-N 3.34Å; F327-E330 PolarHBondContact O-N 3.25Å; F327-A331 WeakPolarHBondContact O-CB 3.41Å; F327-A331 PolarHBondContact O-N 3.1Å; F327-L347 HydrophobicContact CD1-CD2 4.46Å; F327-L350 HydrophobicContact CE1-CB 3.99Å; F327-L350 HydrophobicContact CZ-CB 4.21Å; F327-Y351 HydrophobicContact CB-CD2 3.82Å; F327-Y351 HydrophobicContact CB-CE2 4.07Å; F327-Y351 AromaticContact CD1-CD2 3.81Å; F327-Y351 HydrophobicContact CD1-CD2 3.81Å; F327-Y351 HydrophobicContact CD1-CG 4.39Å; F327-Y351 HydrophobicContact CD2-CD2 4.27Å; F327-Y351 HydrophobicContact CE1-CD2 4.45Å; F327-Y351 AromaticContact CG-CD2 3.69Å; F327-Y351 HydrophobicContact CG-CD2 3.69Å; F327-Y351 HydrophobicContact CG-CE2 4.35Å; F327-F354 HydrophobicContact CD2-CB 4.42Å; F327-F354 AromaticContact CD2-CD1 3.96Å; F327-F354 HydrophobicContact CD2-CD1 3.96Å; F327-F354 HydrophobicContact CD2-CD2 4.31Å; F327-F354 HydrophobicContact CD2-CE1 4.27Å; F327-F354 AromaticContact CD2-CG 3.97Å; F327-F354 HydrophobicContact CD2-CG 3.97Å; F327-F354 HydrophobicContact CE2-CB 3.7Å; F327-F354 HydrophobicContact CE2-CD1 4.03Å; F327-F354 AromaticContact CE2-CD2 3.75Å; F327-F354 HydrophobicContact CE2-CD2 3.75Å; F327-F354 HydrophobicContact CE2-CE2 4.36Å; F327-F354 AromaticContact CE2-CG 3.54Å; F327-F354 HydrophobicContact CE2-CG 3.54Å; F327-F354 HydrophobicContact CZ-CB 3.96Å; F327-F354 HydrophobicContact CZ-CG 4.31Å
328	A	96	Very high	94.5	Very high	3 Å²	3	75.7 Å²	75.7	3%	0.025	40%	0.395	C	S	.	.	H	α-helix	trans	-60.4	-47.3	175.8	0	0	0	0	0	111.8	T324 Q325 L326 A331 Y332 L347	T324-A328 WeakPolarHBondContact O-CB 3.32Å; T324-A328 PolarHBondContact O-N 3.46Å; Q325-A328 VanDerWaalsContact O-CB 3.25Å; Q325-A328 WeakPolarHBondContact O-CB 3.46Å; Q325-A328 PolarHBondContact O-N 3.09Å; L326-A328 VanDerWaalsContact C-N 3.29Å; L326-A328 PolarHBondContact O-N 3.46Å; A328-A331 PolarHBondContact O-N 3.16Å; A328-Y332 VanDerWaalsContact O-CB 3.29Å; A328-Y332 WeakPolarHBondContact O-CB 3.45Å; A328-Y332 PolarHBondContact O-N 3.34Å; A328-L347 HydrophobicContact CB-CD1 3.29Å; A328-L347 HydrophobicContact CB-CG 4.36Å
329	W	95.6	Very high	94.5	Very high	143 Å²	143	77.1 Å²	77.1	54%	0.542	40%	0.397	S	S	.	.	H	α-helix	trans	-63.5	-44.3	177.5	-66.1	-26.8	0	0	0	111.7	Q325 L326 A331 Y332 D333	Q325-W329 HydrophobicContact CG-CD2 4.36Å; Q325-W329 HydrophobicContact CG-CH2 4.09Å; Q325-W329 HydrophobicContact CG-CZ2 3.76Å; Q325-W329 PolarHBondContact O-N 2.81Å; L326-W329 HydrophobicContact CD2-CE3 3.81Å; L326-W329 HydrophobicContact CD2-CZ3 3.85Å; L326-W329 PolarHBondContact O-N 3.43Å; W329-A331 VanDerWaalsContact C-N 3.33Å; W329-A331 PolarHBondContact O-N 3.28Å; W329-Y332 WeakPolarHBondContact O-CB 3.23Å; W329-Y332 PolarHBondContact O-N 2.97Å; W329-D333 VanDerWaalsContact O-CG 3.31Å; W329-D333 PolarHBondContact O-N 3.22Å
330	E	95.8	Very high	94.4	Very high	86 Å²	86	74.1 Å²	74.1	40%	0.402	38%	0.382	S	S	.	.	H	α-helix	trans	-62.7	-40.3	175.7	-172.4	-172.2	165.7	0	0	112.1	L326 F327 Y332 D333 K334	L326-E330 PolarHBondContact O-N 2.69Å; F327-E330 PolarHBondContact O-N 3.25Å; E330-Y332 VanDerWaalsContact C-N 3.34Å; E330-D333 PolarHBondContact O-N 3.23Å; E330-K334 HydrophobicContact CG-CD 4.46Å; E330-K334 WeakPolarHBondContact O-CB 3.23Å; E330-K334 VanDerWaalsContact O-CG 3.27Å; E330-K334 WeakPolarHBondContact O-CG 3.45Å; E330-K334 PolarHBondContact O-N 3.3Å; E330-K334 VanDerWaalsContact OE1-CE 3.31Å; E330-K334 WeakPolarHBondContact OE1-CE 3.1Å; E330-K334 IonicContact OE1-NZ 2.62Å; E330-K334 PolarHBondContact OE1-NZ 3.38Å
331	A	94.5	Very high	94.5	Very high	8 Å²	8	77.3 Å²	77.3	7%	0.066	39%	0.391	C	S	.	.	H	α-helix	trans	-68.6	-34.8	177.7	0	0	0	0	0	111.8	F327 A328 W329 K334 G335 S336 V338	F327-A331 WeakPolarHBondContact O-CB 3.41Å; F327-A331 PolarHBondContact O-N 3.1Å; A328-A331 PolarHBondContact O-N 3.16Å; W329-A331 VanDerWaalsContact C-N 3.33Å; W329-A331 PolarHBondContact O-N 3.28Å; A331-K334 PolarHBondContact O-N 3.13Å; A331-G335 PolarHBondContact O-N 3.2Å; A331-S336 VanDerWaalsContact C-OG 3.29Å; A331-S336 WeakPolarHBondContact CB-OG 3.43Å; A331-S336 PolarHBondContact O-N 3.23Å; A331-S336 PolarHBondContact O-OG 3.35Å; A331-V338 HydrophobicContact CB-CG2 3.7Å
332	Y	95	Very high	94.4	Very high	148 Å²	148	75.3 Å²	75.3	58%	0.58	39%	0.392	S	S	*	.	H	α-helix	trans	-68.1	-44.6	174.1	-172	-97.5	0	0	0	111.5	A328 W329 E330 K334 G335 S336	A328-Y332 VanDerWaalsContact O-CB 3.29Å; A328-Y332 WeakPolarHBondContact O-CB 3.45Å; A328-Y332 PolarHBondContact O-N 3.34Å; W329-Y332 WeakPolarHBondContact O-CB 3.23Å; W329-Y332 PolarHBondContact O-N 2.97Å; E330-Y332 VanDerWaalsContact C-N 3.34Å; Y332-K334 PolarHBondContact O-N 3.3Å; Y332-G335 WeakPolarHBondContact O-CA 3.17Å; Y332-G335 PolarHBondContact O-N 3.21Å; Y332-S336 WeakPolarHBondContact CA-O 2.87Å
333	D	94.9	Very high	94.3	Very high	138 Å²	138	75.8 Å²	75.8	74%	0.738	39%	0.388	S	S	*	.	H	α-helix	trans	-62.5	-32.3	174.7	-70.3	-23.6	0	0	0	112	W329 E330 G335	W329-D333 VanDerWaalsContact O-CG 3.31Å; W329-D333 PolarHBondContact O-N 3.22Å; E330-D333 PolarHBondContact O-N 3.23Å; D333-G335 PolarHBondContact O-N 3.38Å
334	K	93.6	Very high	94.3	Very high	148 Å²	148	74.9 Å²	74.9	64%	0.643	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.9	171.9	-73.3	173.7	-174	171.7	0	113.8	E330 A331 Y332	E330-K334 HydrophobicContact CG-CD 4.46Å; E330-K334 WeakPolarHBondContact O-CB 3.23Å; E330-K334 VanDerWaalsContact O-CG 3.27Å; E330-K334 WeakPolarHBondContact O-CG 3.45Å; E330-K334 PolarHBondContact O-N 3.3Å; E330-K334 VanDerWaalsContact OE1-CE 3.31Å; E330-K334 WeakPolarHBondContact OE1-CE 3.1Å; E330-K334 IonicContact OE1-NZ 2.62Å; E330-K334 PolarHBondContact OE1-NZ 3.38Å; A331-K334 PolarHBondContact O-N 3.13Å; Y332-K334 PolarHBondContact O-N 3.3Å
335	G	90.1	Very high	94.3	Very high	62 Å²	62	79.2 Å²	79.2	64%	0.639	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	11.1	176.3	0	0	0	0	0	115.3	A331 Y332 D333	A331-G335 PolarHBondContact O-N 3.2Å; Y332-G335 WeakPolarHBondContact O-CA 3.17Å; Y332-G335 PolarHBondContact O-N 3.21Å; D333-G335 PolarHBondContact O-N 3.38Å
336	S	88.2	Confident	94.2	Very high	51 Å²	51	82.3 Å²	82.3	36%	0.357	43%	0.428	S	S	.	.			trans	-87	122.1	167.6	65.6	0	0	0	0	110.1	A331 Y332 V338	A331-S336 VanDerWaalsContact C-OG 3.29Å; A331-S336 WeakPolarHBondContact CB-OG 3.43Å; A331-S336 PolarHBondContact O-N 3.23Å; A331-S336 PolarHBondContact O-OG 3.35Å; Y332-S336 WeakPolarHBondContact CA-O 2.87Å; S336-V338 VanDerWaalsContact C-N 3.26Å; S336-V338 PolarHBondContact O-N 3.4Å
337	E	90.3	Very high	94.2	Very high	169 Å²	169	77.3 Å²	77.3	79%	0.79	40%	0.402	S	S	*	.			trans	-76.7	77.8	179.7	-64.3	173.8	-178.2	0	0	110.3
338	V	91.6	Very high	94.2	Very high	6 Å²	6	79.4 Å²	79.4	4%	0.036	41%	0.412	C	S	.	.			trans	-126.8	135.4	175.6	-65.7	0	0	0	0	109.8	A331 S336 K346 L350	A331-V338 HydrophobicContact CB-CG2 3.7Å; S336-V338 VanDerWaalsContact C-N 3.26Å; S336-V338 PolarHBondContact O-N 3.4Å; V338-K346 HydrophobicContact CG1-CD 4.36Å; V338-L350 HydrophobicContact CG1-CD1 3.68Å
339	H	94.7	Very high	94.2	Very high	93 Å²	93	84.6 Å²	84.6	43%	0.431	44%	0.439	S	S	.	.			trans	-139.7	133.2	-175.1	-171.8	-85.7	0	0	0	109.9	Q341 A342 D343	H339-Q341 VanDerWaalsContact C-N 3.31Å; H339-Q341 PolarHBondContact CE1-OE1 3.04Å; H339-Q341 PolarHBondContact ND1-N 3.29Å; H339-Q341 PolarHBondContact ND1-OE1 2.99Å; H339-Q341 PolarHBondContact O-N 3.23Å; H339-A342 HydrophobicContact CB-CB 3.96Å; H339-A342 PolarHBondContact ND1-N 3.34Å; H339-A342 PolarHBondContact O-N 3.24Å; H339-D343 CarbonylContact O-C 3.45Å; H339-D343 PolarHBondContact O-N 3.19Å
340	L	95.2	Very high	94.1	Very high	22 Å²	22	81 Å²	81	12%	0.115	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-39.4	-172.1	-177	66.7	0	0	0	112.4	M321 Q325 P344 L347	M321-L340 HydrophobicContact CE-CD2 3.76Å; M321-L340 HydrophobicContact CG-CD2 4.02Å; Q325-L340 HydrophobicContact CB-CD2 4.12Å; L340-P344 VanDerWaalsContact O-CA 3.25Å; L340-P344 WeakPolarHBondContact O-CA 3.44Å; L340-P344 VanDerWaalsContact O-CB 3.25Å; L340-P344 WeakPolarHBondContact O-CB 3.49Å; L340-L347 HydrophobicContact CB-CD1 4.11Å; L340-L347 HydrophobicContact CD1-CD1 4.44Å; L340-L347 HydrophobicContact CD1-CD2 3.86Å
341	Q	95.6	Very high	94.2	Very high	117 Å²	117	78 Å²	78	55%	0.547	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-23.2	-178.5	-65	76.5	5.1	0	0	113.5	H339	H339-Q341 VanDerWaalsContact C-N 3.31Å; H339-Q341 PolarHBondContact CE1-OE1 3.04Å; H339-Q341 PolarHBondContact ND1-N 3.29Å; H339-Q341 PolarHBondContact ND1-OE1 2.99Å; H339-Q341 PolarHBondContact O-N 3.23Å
342	A	94.9	Very high	94.2	Very high	70 Å²	70	82.8 Å²	82.8	58%	0.579	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-47.8	-176.8	0	0	0	0	0	110.8	H339 P344	H339-A342 HydrophobicContact CB-CB 3.96Å; H339-A342 PolarHBondContact ND1-N 3.34Å; H339-A342 PolarHBondContact O-N 3.24Å; A342-P344 VanDerWaalsContact O-CD 3.3Å; A342-P344 WeakPolarHBondContact O-CD 3.46Å
343	D	94.8	Very high	94.3	Very high	62 Å²	62	78 Å²	78	33%	0.332	42%	0.422	S	S	.	.	S	Bend	trans	-122.3	58.9	-177.2	-70.2	-5.8	0	0	0	111	H339 T345 K346 L347	H339-D343 CarbonylContact O-C 3.45Å; H339-D343 PolarHBondContact O-N 3.19Å; D343-T345 PolarHBondContact O-N 3.47Å; D343-K346 HydrophobicContact CB-CB 4.1Å; D343-K346 HydrophobicContact CB-CD 4.16Å; D343-K346 PolarHBondContact O-N 3.3Å; D343-K346 IonicContact OD2-NZ 3.31Å; D343-K346 PolarHBondContact OD2-NZ 3.1Å; D343-L347 WeakPolarHBondContact O-CB 2.96Å; D343-L347 PolarHBondContact O-N 3.28Å
344	P	95.2	Very high	94.3	Very high	64 Å²	64	74.4 Å²	74.4	42%	0.416	40%	0.401	S	S	.	.	H	α-helix	trans	-59.5	-45.4	-170.7	20.3	-31.7	0	0	0	112.9	L340 A342 E348	L340-P344 VanDerWaalsContact O-CA 3.25Å; L340-P344 WeakPolarHBondContact O-CA 3.44Å; L340-P344 VanDerWaalsContact O-CB 3.25Å; L340-P344 WeakPolarHBondContact O-CB 3.49Å; A342-P344 VanDerWaalsContact O-CD 3.3Å; A342-P344 WeakPolarHBondContact O-CD 3.46Å; P344-E348 VanDerWaalsContact O-CB 3.28Å; P344-E348 WeakPolarHBondContact O-CB 3.37Å; P344-E348 PolarHBondContact O-N 3.13Å
345	T	95.7	Very high	94.4	Very high	107 Å²	107	72 Å²	72	66%	0.656	39%	0.39	S	S	*	.	H	α-helix	trans	-73.2	-38.1	-175.6	54	0	0	0	0	112.3	D343 E348 L349	D343-T345 PolarHBondContact O-N 3.47Å; T345-E348 PolarHBondContact O-N 3.48Å; T345-L349 WeakPolarHBondContact O-CG 3.49Å; T345-L349 PolarHBondContact O-N 3.4Å
346	K	94.8	Very high	94.8	Very high	98 Å²	98	73.4 Å²	73.4	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-45.6	174.6	178.5	-175.1	171.7	-167	0	110.6	V338 D343 E348 L349 L350	V338-K346 HydrophobicContact CG1-CD 4.36Å; D343-K346 HydrophobicContact CB-CB 4.1Å; D343-K346 HydrophobicContact CB-CD 4.16Å; D343-K346 PolarHBondContact O-N 3.3Å; D343-K346 IonicContact OD2-NZ 3.31Å; D343-K346 PolarHBondContact OD2-NZ 3.1Å; K346-E348 VanDerWaalsContact C-N 3.34Å; K346-L349 PolarHBondContact O-N 3.12Å; K346-L350 HydrophobicContact CG-CD1 4.43Å; K346-L350 WeakPolarHBondContact O-CG 3.32Å; K346-L350 PolarHBondContact O-N 3.49Å
347	L	95.6	Very high	95.1	Very high	1 Å²	1	77.6 Å²	77.6	1%	0.005	40%	0.398	C	S	.	.	H	α-helix	trans	-64.4	-39.5	176.4	-175.3	155	0	0	0	111.7	F327 A328 L340 D343 L350 Y351	F327-L347 HydrophobicContact CD1-CD2 4.46Å; A328-L347 HydrophobicContact CB-CD1 3.29Å; A328-L347 HydrophobicContact CB-CG 4.36Å; L340-L347 HydrophobicContact CB-CD1 4.11Å; L340-L347 HydrophobicContact CD1-CD1 4.44Å; L340-L347 HydrophobicContact CD1-CD2 3.86Å; D343-L347 WeakPolarHBondContact O-CB 2.96Å; D343-L347 PolarHBondContact O-N 3.28Å; L347-L350 PolarHBondContact O-N 3.31Å; L347-Y351 WeakPolarHBondContact O-CB 3.24Å; L347-Y351 PolarHBondContact O-N 3.36Å
348	E	95.3	Very high	95.4	Very high	72 Å²	72	73.6 Å²	73.6	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-42.9	176.5	-163.5	-83.5	157	0	0	112.2	P344 T345 K346 Y351 K352	P344-E348 VanDerWaalsContact O-CB 3.28Å; P344-E348 WeakPolarHBondContact O-CB 3.37Å; P344-E348 PolarHBondContact O-N 3.13Å; T345-E348 PolarHBondContact O-N 3.48Å; K346-E348 VanDerWaalsContact C-N 3.34Å; E348-Y351 PolarHBondContact O-N 3.17Å; E348-K352 PolarHBondContact O-N 3.48Å; E348-K352 WeakPolarHBondContact OE1-CD 3.35Å; E348-K352 WeakPolarHBondContact OE1-CE 3.23Å; E348-K352 IonicContact OE1-NZ 2.71Å; E348-K352 PolarHBondContact OE1-NZ 2.65Å; E348-K352 IonicContact OE2-NZ 3.7Å; E348-K352 PolarHBondContact OE2-NZ 3.26Å
349	L	96.2	Very high	95.6	Very high	112 Å²	112	79.4 Å²	79.4	59%	0.586	40%	0.404	S	S	*	.	H	α-helix	trans	-62.8	-42.6	173.2	-71.1	174.7	0	0	0	111.8	T345 K346 Y351 K352 S353	T345-L349 WeakPolarHBondContact O-CG 3.49Å; T345-L349 PolarHBondContact O-N 3.4Å; K346-L349 PolarHBondContact O-N 3.12Å; L349-Y351 VanDerWaalsContact C-N 3.32Å; L349-Y351 PolarHBondContact O-N 2.98Å; L349-K352 PolarHBondContact O-N 3.48Å; L349-S353 WeakPolarHBondContact O-CB 3.33Å; L349-S353 PolarHBondContact O-N 3.19Å
350	L	95.1	Very high	95.7	Very high	67 Å²	67	79.1 Å²	79.1	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-63.1	-40.5	174.4	-72.8	172.4	0	0	0	111.3	F327 V338 K346 L347 S353 F354	F327-L350 HydrophobicContact CE1-CB 3.99Å; F327-L350 HydrophobicContact CZ-CB 4.21Å; V338-L350 HydrophobicContact CG1-CD1 3.68Å; K346-L350 HydrophobicContact CG-CD1 4.43Å; K346-L350 WeakPolarHBondContact O-CG 3.32Å; K346-L350 PolarHBondContact O-N 3.49Å; L347-L350 PolarHBondContact O-N 3.31Å; L350-S353 CarbonylContact O-C 3.56Å; L350-S353 PolarHBondContact O-N 3.31Å; L350-S353 PolarHBondContact O-OG 3.46Å; L350-F354 WeakPolarHBondContact O-CB 3.32Å; L350-F354 PolarHBondContact O-N 3.42Å
351	Y	96.1	Very high	95.8	Very high	23 Å²	23	82.6 Å²	82.6	9%	0.09	42%	0.42	C	S	.	.	H	α-helix	trans	-67	-40.3	177.8	-174.8	-115.8	0	0	0	112.4	Q323 T324 F327 L347 E348 L349 F354 K355	Q323-Y351 VanDerWaalsContact CB-OH 3.28Å; Q323-Y351 WeakPolarHBondContact CB-OH 3.28Å; Q323-Y351 PolarHBondContact OE1-OH 2.97Å; Q323-Y351 VanDerWaalsContact OE1-OH 3.08Å; T324-Y351 HydrophobicContact CG2-CD1 3.29Å; T324-Y351 HydrophobicContact CG2-CD2 4.24Å; T324-Y351 HydrophobicContact CG2-CE1 3.46Å; T324-Y351 VanDerWaalsContact CG2-CE1 3.46Å; T324-Y351 HydrophobicContact CG2-CE2 4.44Å; T324-Y351 HydrophobicContact CG2-CG 3.68Å; F327-Y351 HydrophobicContact CB-CD2 3.82Å; F327-Y351 HydrophobicContact CB-CE2 4.07Å; F327-Y351 AromaticContact CD1-CD2 3.81Å; F327-Y351 HydrophobicContact CD1-CD2 3.81Å; F327-Y351 HydrophobicContact CD1-CG 4.39Å; F327-Y351 HydrophobicContact CD2-CD2 4.27Å; F327-Y351 HydrophobicContact CE1-CD2 4.45Å; F327-Y351 AromaticContact CG-CD2 3.69Å; F327-Y351 HydrophobicContact CG-CD2 3.69Å; F327-Y351 HydrophobicContact CG-CE2 4.35Å; L347-Y351 WeakPolarHBondContact O-CB 3.24Å; L347-Y351 PolarHBondContact O-N 3.36Å; E348-Y351 PolarHBondContact O-N 3.17Å; L349-Y351 VanDerWaalsContact C-N 3.32Å; L349-Y351 PolarHBondContact O-N 2.98Å; Y351-F354 HydrophobicContact CD2-CD1 4.3Å; Y351-F354 HydrophobicContact CE2-CD1 4.34Å; Y351-F354 WeakPolarHBondContact O-CB 3.16Å; Y351-F354 PolarHBondContact O-N 3.09Å; Y351-K355 HydrophobicContact CD1-CD 4.38Å; Y351-K355 HydrophobicContact CE1-CD 4.04Å; Y351-K355 HydrophobicContact CE1-CG 4.42Å; Y351-K355 PolarHBondContact O-N 3.4Å; Y351-K355 WeakPolarHBondContact OH-CE 3.01Å
352	K	96.3	Very high	95.8	Very high	108 Å²	108	82.1 Å²	82.1	47%	0.47	42%	0.417	S	S	.	.	H	α-helix	trans	-59.2	-46.3	169.8	-80.7	173.1	166.7	145.3	0	111.5	E348 L349 F354 K355 V356	E348-K352 PolarHBondContact O-N 3.48Å; E348-K352 WeakPolarHBondContact OE1-CD 3.35Å; E348-K352 WeakPolarHBondContact OE1-CE 3.23Å; E348-K352 IonicContact OE1-NZ 2.71Å; E348-K352 PolarHBondContact OE1-NZ 2.65Å; E348-K352 IonicContact OE2-NZ 3.7Å; E348-K352 PolarHBondContact OE2-NZ 3.26Å; L349-K352 PolarHBondContact O-N 3.48Å; K352-F354 VanDerWaalsContact C-N 3.26Å; K352-F354 PolarHBondContact O-N 3.46Å; K352-K355 PolarHBondContact O-N 3.49Å; K352-V356 PolarHBondContact O-N 3.47Å; K352-V356 VanDerWaalsContact O-N 3.11Å
353	S	96	Very high	95.7	Very high	47 Å²	47	81.7 Å²	81.7	33%	0.329	41%	0.413	S	S	.	.	H	α-helix	trans	-62.9	-36.4	176.6	82.9	0	0	0	0	111.9	L349 L350 K357	L349-S353 WeakPolarHBondContact O-CB 3.33Å; L349-S353 PolarHBondContact O-N 3.19Å; L350-S353 CarbonylContact O-C 3.56Å; L350-S353 PolarHBondContact O-N 3.31Å; L350-S353 PolarHBondContact O-OG 3.46Å; S353-K357 VanDerWaalsContact O-CG 3.31Å; S353-K357 WeakPolarHBondContact O-CG 3.44Å; S353-K357 PolarHBondContact O-N 2.83Å
354	F	95.4	Very high	95.8	Very high	64 Å²	64	84.6 Å²	84.6	28%	0.281	42%	0.424	S	S	.	.	H	α-helix	trans	-68	-40.3	175.9	174.7	-100.7	0	0	0	111.5	F327 L350 Y351 K352 K357 K358	F327-F354 HydrophobicContact CD2-CB 4.42Å; F327-F354 AromaticContact CD2-CD1 3.96Å; F327-F354 HydrophobicContact CD2-CD1 3.96Å; F327-F354 HydrophobicContact CD2-CD2 4.31Å; F327-F354 HydrophobicContact CD2-CE1 4.27Å; F327-F354 AromaticContact CD2-CG 3.97Å; F327-F354 HydrophobicContact CD2-CG 3.97Å; F327-F354 HydrophobicContact CE2-CB 3.7Å; F327-F354 HydrophobicContact CE2-CD1 4.03Å; F327-F354 AromaticContact CE2-CD2 3.75Å; F327-F354 HydrophobicContact CE2-CD2 3.75Å; F327-F354 HydrophobicContact CE2-CE2 4.36Å; F327-F354 AromaticContact CE2-CG 3.54Å; F327-F354 HydrophobicContact CE2-CG 3.54Å; F327-F354 HydrophobicContact CZ-CB 3.96Å; F327-F354 HydrophobicContact CZ-CG 4.31Å; L350-F354 WeakPolarHBondContact O-CB 3.32Å; L350-F354 PolarHBondContact O-N 3.42Å; Y351-F354 HydrophobicContact CD2-CD1 4.3Å; Y351-F354 HydrophobicContact CE2-CD1 4.34Å; Y351-F354 WeakPolarHBondContact O-CB 3.16Å; Y351-F354 PolarHBondContact O-N 3.09Å; K352-F354 VanDerWaalsContact C-N 3.26Å; K352-F354 PolarHBondContact O-N 3.46Å; F354-K357 CarbonylContact O-C 3.56Å; F354-K357 PolarHBondContact O-N 3.48Å; F354-K358 HydrophobicContact CZ-CD 4.4Å; F354-K358 VanDerWaalsContact O-CB 3.25Å; F354-K358 WeakPolarHBondContact O-CB 3.36Å; F354-K358 PolarHBondContact O-N 3.14Å
355	K	96	Very high	95.7	Very high	98 Å²	98	85.2 Å²	85.2	43%	0.426	42%	0.422	S	S	.	.	H	α-helix	trans	-59.3	-47.3	174	-81.5	-177.9	167.7	176.4	0	111.8	Y351 K352 K357 K358 E359	Y351-K355 HydrophobicContact CD1-CD 4.38Å; Y351-K355 HydrophobicContact CE1-CD 4.04Å; Y351-K355 HydrophobicContact CE1-CG 4.42Å; Y351-K355 PolarHBondContact O-N 3.4Å; Y351-K355 WeakPolarHBondContact OH-CE 3.01Å; K352-K355 PolarHBondContact O-N 3.49Å; K355-K357 PolarHBondContact O-N 3.31Å; K355-K358 WeakPolarHBondContact O-CB 3.41Å; K355-K358 PolarHBondContact O-N 3.02Å; K355-K358 VanDerWaalsContact O-N 3.09Å; K355-E359 PolarHBondContact O-N 3.22Å
356	V	97	Very high	95.5	Very high	91 Å²	91	86.3 Å²	86.3	55%	0.552	42%	0.418	S	S	*	.	H	α-helix	trans	-58.5	-50.5	175.7	177.2	0	0	0	0	110.3	K352 K358 E359 D360	K352-V356 PolarHBondContact O-N 3.47Å; K352-V356 VanDerWaalsContact O-N 3.11Å; V356-K358 PolarHBondContact O-N 3.2Å; V356-E359 PolarHBondContact O-N 3.03Å; V356-E359 VanDerWaalsContact O-N 3.14Å; V356-D360 VanDerWaalsContact O-CG 3.32Å; V356-D360 PolarHBondContact O-N 3.32Å
357	K	96.1	Very high	95.3	Very high	138 Å²	138	87 Å²	87	60%	0.6	42%	0.422	S	S	*	.	H	α-helix	trans	-60.5	-29.9	176.2	-71	175.5	-178.3	177.4	0	113.3	S353 F354 K355 F361	S353-K357 VanDerWaalsContact O-CG 3.31Å; S353-K357 WeakPolarHBondContact O-CG 3.44Å; S353-K357 PolarHBondContact O-N 2.83Å; F354-K357 CarbonylContact O-C 3.56Å; F354-K357 PolarHBondContact O-N 3.48Å; K355-K357 PolarHBondContact O-N 3.31Å; K357-F361 VanDerWaalsContact O-CB 3.27Å; K357-F361 WeakPolarHBondContact O-CB 3.47Å; K357-F361 PolarHBondContact O-N 3.29Å
358	K	96.3	Very high	95.2	Very high	85 Å²	85	88.8 Å²	88.8	37%	0.37	44%	0.435	S	S	.	.	H	α-helix	trans	-71.4	-41	178.2	-170.3	66.1	173.7	-175.1	0	110.9	F354 K355 V356 F361 K362	F354-K358 HydrophobicContact CZ-CD 4.4Å; F354-K358 VanDerWaalsContact O-CB 3.25Å; F354-K358 WeakPolarHBondContact O-CB 3.36Å; F354-K358 PolarHBondContact O-N 3.14Å; K355-K358 WeakPolarHBondContact O-CB 3.41Å; K355-K358 PolarHBondContact O-N 3.02Å; K355-K358 VanDerWaalsContact O-N 3.09Å; V356-K358 PolarHBondContact O-N 3.2Å; K358-F361 PolarHBondContact O-N 3.4Å; K358-K362 VanDerWaalsContact O-CG 3.25Å; K358-K362 WeakPolarHBondContact O-CG 3.47Å; K358-K362 PolarHBondContact O-N 3.19Å
359	E	96.1	Very high	94.9	Very high	128 Å²	128	89.7 Å²	89.7	60%	0.598	44%	0.441	S	S	*	.	H	α-helix	trans	-65.3	-44.1	173.6	-64.7	-51.1	138.2	0	0	111.3	K355 V356 F361 K362 A363	K355-E359 PolarHBondContact O-N 3.22Å; V356-E359 PolarHBondContact O-N 3.03Å; V356-E359 VanDerWaalsContact O-N 3.14Å; E359-F361 VanDerWaalsContact C-N 3.3Å; E359-F361 PolarHBondContact O-N 3.34Å; E359-K362 WeakPolarHBondContact O-CB 3.14Å; E359-K362 PolarHBondContact O-N 3.11Å; E359-A363 PolarHBondContact O-N 3.2Å
360	D	96.1	Very high	94.5	Very high	87 Å²	87	85.8 Å²	85.8	47%	0.465	42%	0.421	S	S	.	.	H	α-helix	trans	-58.1	-44.3	174.5	-61	-27.4	0	0	0	111.1	V356 K362 A363 Q364	V356-D360 VanDerWaalsContact O-CG 3.32Å; V356-D360 PolarHBondContact O-N 3.32Å; D360-K362 VanDerWaalsContact C-N 3.33Å; D360-K362 PolarHBondContact O-N 3.24Å; D360-A363 PolarHBondContact O-N 2.95Å; D360-Q364 WeakPolarHBondContact O-CG 3.45Å; D360-Q364 PolarHBondContact O-N 3.26Å
361	F	96.2	Very high	94.2	Very high	95 Å²	95	89.4 Å²	89.4	42%	0.417	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-34.3	175.8	-178.4	-101.6	0	0	0	112.9	K357 K358 E359 Q365	K357-F361 VanDerWaalsContact O-CB 3.27Å; K357-F361 WeakPolarHBondContact O-CB 3.47Å; K357-F361 PolarHBondContact O-N 3.29Å; K358-F361 PolarHBondContact O-N 3.4Å; E359-F361 VanDerWaalsContact C-N 3.3Å; E359-F361 PolarHBondContact O-N 3.34Å; F361-Q365 HydrophobicContact CD1-CG 4.42Å; F361-Q365 HydrophobicContact CE1-CG 4.04Å; F361-Q365 HydrophobicContact CZ-CG 4.17Å; F361-Q365 VanDerWaalsContact CZ-NE2 3.26Å; F361-Q365 WeakPolarHBondContact O-CB 3.34Å; F361-Q365 WeakPolarHBondContact O-CG 3.46Å; F361-Q365 PolarHBondContact O-N 3.45Å
362	K	95.9	Very high	93.9	Very high	108 Å²	108	96 Å²	96	47%	0.47	47%	0.465	S	S	.	.	H	α-helix	trans	-68.3	-40.5	174.4	-75.5	-71.3	-175.6	-179.5	0	111.5	K358 E359 D360 Q365 K366	K358-K362 VanDerWaalsContact O-CG 3.25Å; K358-K362 WeakPolarHBondContact O-CG 3.47Å; K358-K362 PolarHBondContact O-N 3.19Å; E359-K362 WeakPolarHBondContact O-CB 3.14Å; E359-K362 PolarHBondContact O-N 3.11Å; D360-K362 VanDerWaalsContact C-N 3.33Å; D360-K362 PolarHBondContact O-N 3.24Å; K362-Q365 PolarHBondContact O-N 3.36Å; K362-K366 WeakPolarHBondContact O-CB 3.19Å; K362-K366 PolarHBondContact O-N 2.98Å
363	A	94.6	Very high	93.4	Very high	60 Å²	60	100.3 Å²	100.3	50%	0.496	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-48	174.6	0	0	0	0	0	111.2	E359 D360 Q365 K366 E367	E359-A363 PolarHBondContact O-N 3.2Å; D360-A363 PolarHBondContact O-N 2.95Å; A363-Q365 VanDerWaalsContact C-N 3.35Å; A363-Q365 PolarHBondContact O-N 3.48Å; A363-K366 WeakPolarHBondContact O-CB 3.47Å; A363-K366 PolarHBondContact O-N 3.41Å; A363-K366 VanDerWaalsContact O-N 3.16Å; A363-E367 WeakPolarHBondContact O-CB 3.3Å; A363-E367 PolarHBondContact O-N 3.02Å
364	Q	95	Very high	92.6	Very high	123 Å²	123	100.5 Å²	100.5	58%	0.575	49%	0.489	S	S	*	.	H	α-helix	trans	-61.6	-40.1	175.3	-71.3	177.7	2.9	0	0	112.4	D360 E367 S368	D360-Q364 WeakPolarHBondContact O-CG 3.45Å; D360-Q364 PolarHBondContact O-N 3.26Å; Q364-E367 PolarHBondContact O-N 3.06Å; Q364-S368 WeakPolarHBondContact O-CB 3.17Å; Q364-S368 PolarHBondContact O-N 3.49Å; Q364-S368 PolarHBondContact O-OG 3.45Å
365	Q	93.9	Very high	91.8	Very high	78 Å²	78	99 Å²	99	36%	0.364	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-46.8	173.2	-86.3	-164.1	-1.8	0	0	111.4	F361 K362 A363 E367 S368 I369	F361-Q365 HydrophobicContact CD1-CG 4.42Å; F361-Q365 HydrophobicContact CE1-CG 4.04Å; F361-Q365 HydrophobicContact CZ-CG 4.17Å; F361-Q365 VanDerWaalsContact CZ-NE2 3.26Å; F361-Q365 WeakPolarHBondContact O-CB 3.34Å; F361-Q365 WeakPolarHBondContact O-CG 3.46Å; F361-Q365 PolarHBondContact O-N 3.45Å; K362-Q365 PolarHBondContact O-N 3.36Å; A363-Q365 VanDerWaalsContact C-N 3.35Å; A363-Q365 PolarHBondContact O-N 3.48Å; Q365-E367 VanDerWaalsContact C-N 3.33Å; Q365-E367 PolarHBondContact O-N 3.19Å; Q365-S368 PolarHBondContact O-N 2.96Å; Q365-S368 PolarHBondContact O-OG 2.83Å; Q365-I369 WeakPolarHBondContact O-CB 3.14Å; Q365-I369 WeakPolarHBondContact O-CD1 3.17Å; Q365-I369 WeakPolarHBondContact O-CG1 3.44Å; Q365-I369 PolarHBondContact O-N 2.87Å
366	K	91.1	Very high	90.7	Very high	130 Å²	130	100.5 Å²	100.5	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-58.2	-46	177.7	-176.7	-176.1	174.4	-174.6	0	110.9	K362 A363 I369 L370	K362-K366 WeakPolarHBondContact O-CB 3.19Å; K362-K366 PolarHBondContact O-N 2.98Å; A363-K366 WeakPolarHBondContact O-CB 3.47Å; A363-K366 PolarHBondContact O-N 3.41Å; A363-K366 VanDerWaalsContact O-N 3.16Å; K366-I369 PolarHBondContact O-N 3.41Å; K366-L370 VanDerWaalsContact O-CB 3.27Å; K366-L370 WeakPolarHBondContact O-CB 3.21Å; K366-L370 PolarHBondContact O-N 3.49Å
367	E	91.4	Very high	89.4	Confident	112 Å²	112	104.4 Å²	104.4	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-60.7	-49.6	175.9	-173.9	174.1	-160	0	0	111.5	A363 Q364 Q365 I369 L370 E371	A363-E367 WeakPolarHBondContact O-CB 3.3Å; A363-E367 PolarHBondContact O-N 3.02Å; Q364-E367 PolarHBondContact O-N 3.06Å; Q365-E367 VanDerWaalsContact C-N 3.33Å; Q365-E367 PolarHBondContact O-N 3.19Å; E367-I369 VanDerWaalsContact C-N 3.28Å; E367-I369 PolarHBondContact O-N 3.39Å; E367-L370 CarbonylContact O-C 3.58Å; E367-L370 WeakPolarHBondContact O-CA 3.46Å; E367-L370 WeakPolarHBondContact O-CB 3.48Å; E367-L370 PolarHBondContact O-N 3.02Å; E367-E371 WeakPolarHBondContact O-CG 3.39Å; E367-E371 PolarHBondContact O-N 3.27Å
368	S	92.8	Very high	88	Confident	39 Å²	39	105.9 Å²	105.9	27%	0.273	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-32	178.8	76.1	0	0	0	0	113.8	Q364 Q365 K372	Q364-S368 WeakPolarHBondContact O-CB 3.17Å; Q364-S368 PolarHBondContact O-N 3.49Å; Q364-S368 PolarHBondContact O-OG 3.45Å; Q365-S368 PolarHBondContact O-N 2.96Å; Q365-S368 PolarHBondContact O-OG 2.83Å; S368-K372 WeakPolarHBondContact O-CB 3.45Å; S368-K372 WeakPolarHBondContact O-CD 3.28Å; S368-K372 VanDerWaalsContact O-CG 3.24Å; S368-K372 WeakPolarHBondContact O-CG 3.27Å; S368-K372 PolarHBondContact O-N 3.4Å
369	I	89.8	Confident	86.8	Confident	91 Å²	91	106.7 Å²	106.7	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-70.4	-43.7	173.9	-70.8	165.3	0	0	0	108.7	Q365 K366 E367 E371 K372 Y373	Q365-I369 WeakPolarHBondContact O-CB 3.14Å; Q365-I369 WeakPolarHBondContact O-CD1 3.17Å; Q365-I369 WeakPolarHBondContact O-CG1 3.44Å; Q365-I369 PolarHBondContact O-N 2.87Å; K366-I369 PolarHBondContact O-N 3.41Å; E367-I369 VanDerWaalsContact C-N 3.28Å; E367-I369 PolarHBondContact O-N 3.39Å; I369-E371 PolarHBondContact O-N 3.03Å; I369-K372 PolarHBondContact O-N 3.26Å; I369-Y373 HydrophobicContact CG2-CD2 3.94Å; I369-Y373 WeakPolarHBondContact O-CD2 3.34Å; I369-Y373 PolarHBondContact O-N 3.05Å
370	L	88.3	Confident	85.7	Confident	29 Å²	29	106.7 Å²	106.7	15%	0.152	53%	0.532	C	S	.	.	H	α-helix	trans	-66.8	-36.6	-178.4	-163.3	142.1	0	0	0	112.4	K366 E367 G374 Q376 L379	K366-L370 VanDerWaalsContact O-CB 3.27Å; K366-L370 WeakPolarHBondContact O-CB 3.21Å; K366-L370 PolarHBondContact O-N 3.49Å; E367-L370 CarbonylContact O-C 3.58Å; E367-L370 WeakPolarHBondContact O-CA 3.46Å; E367-L370 WeakPolarHBondContact O-CB 3.48Å; E367-L370 PolarHBondContact O-N 3.02Å; L370-G374 VanDerWaalsContact O-CA 3.22Å; L370-G374 WeakPolarHBondContact O-CA 3.39Å; L370-G374 PolarHBondContact O-N 3.09Å; L370-Q376 HydrophobicContact CD1-CG 4.4Å; L370-Q376 HydrophobicContact CD2-CB 3.73Å; L370-Q376 HydrophobicContact CD2-CG 3.36Å; L370-Q376 HydrophobicContact CG-CG 4.47Å; L370-L379 HydrophobicContact CD1-CD1 3.37Å; L370-L379 HydrophobicContact CD1-CG 4.45Å
371	E	88	Confident	84.6	Confident	143 Å²	143	106.3 Å²	106.3	67%	0.668	54%	0.542	S	S	*	.	H	α-helix	trans	-65	-38.4	171.6	-71.6	179.5	164.7	0	0	112.8	E367 I369	E367-E371 WeakPolarHBondContact O-CG 3.39Å; E367-E371 PolarHBondContact O-N 3.27Å; I369-E371 PolarHBondContact O-N 3.03Å
372	K	89.2	Confident	83.5	Confident	162 Å²	162	104.7 Å²	104.7	70%	0.704	54%	0.54	S	S	*	.	H	α-helix	trans	-77.5	-37.6	-177.1	-76	174.6	-175.6	175.8	0	113.6	S368 I369	S368-K372 WeakPolarHBondContact O-CB 3.45Å; S368-K372 WeakPolarHBondContact O-CD 3.28Å; S368-K372 VanDerWaalsContact O-CG 3.24Å; S368-K372 WeakPolarHBondContact O-CG 3.27Å; S368-K372 PolarHBondContact O-N 3.4Å; I369-K372 PolarHBondContact O-N 3.26Å
373	Y	85.6	Confident	82.5	Confident	199 Å²	199	102.9 Å²	102.9	78%	0.78	54%	0.54	S	S	*	.	H	α-helix	trans	-106.9	-9.5	-172.8	-66.3	-79.9	0	0	0	113.3	I369	I369-Y373 HydrophobicContact CG2-CD2 3.94Å; I369-Y373 WeakPolarHBondContact O-CD2 3.34Å; I369-Y373 PolarHBondContact O-N 3.05Å
374	G	80.4	Confident	81.2	Confident	50 Å²	50	104.6 Å²	104.6	52%	0.515	55%	0.546	S	S	.	.			trans	67.7	176.3	-173.8	0	0	0	0	0	112.5	L370	L370-G374 VanDerWaalsContact O-CA 3.22Å; L370-G374 WeakPolarHBondContact O-CA 3.39Å; L370-G374 PolarHBondContact O-N 3.09Å
375	G	77.3	Confident	79.9	Confident	32 Å²	32	104.9 Å²	104.9	33%	0.33	55%	0.547	S	S	.	.			trans	114.3	15.2	176.5	0	0	0	0	0	116.1	E377 H378	G375-E377 PolarHBondContact O-N 3.32Å; G375-H378 PolarHBondContact O-N 3.46Å; G375-H378 VanDerWaalsContact O-N 3.12Å
376	Q	72.8	Confident	78.6	Confident	131 Å²	131	107.2 Å²	107.2	61%	0.612	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-54.3	-39	168.6	-127.3	154.1	21.7	0	0	111.2	L370 H378 L379	L370-Q376 HydrophobicContact CD1-CG 4.4Å; L370-Q376 HydrophobicContact CD2-CB 3.73Å; L370-Q376 HydrophobicContact CD2-CG 3.36Å; L370-Q376 HydrophobicContact CG-CG 4.47Å; Q376-H378 PolarHBondContact O-N 3.28Å; Q376-H378 VanDerWaalsContact O-N 3.16Å; Q376-L379 PolarHBondContact O-N 3.27Å; Q376-L379 VanDerWaalsContact O-N 3.09Å
377	E	70.1	Confident	77.5	Confident	172 Å²	172	106.2 Å²	106.2	80%	0.804	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-63.2	-17.6	178.4	-58.4	177.8	175.6	0	0	114.3	G375	G375-E377 PolarHBondContact O-N 3.32Å
378	H	67.6	Low	76.5	Confident	169 Å²	169	106.2 Å²	106.2	78%	0.782	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-97.2	-8.6	177.3	-64.8	-51.9	0	0	0	113.5	G375 Q376	G375-H378 PolarHBondContact O-N 3.46Å; G375-H378 VanDerWaalsContact O-N 3.12Å; Q376-H378 PolarHBondContact O-N 3.28Å; Q376-H378 VanDerWaalsContact O-N 3.16Å
379	L	70.9	Confident	75.2	Confident	103 Å²	103	108.7 Å²	108.7	54%	0.539	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-34.1	174.7	-73.3	177.6	0	0	0	111.9	L370 Q376 A381	L370-L379 HydrophobicContact CD1-CD1 3.37Å; L370-L379 HydrophobicContact CD1-CG 4.45Å; Q376-L379 PolarHBondContact O-N 3.27Å; Q376-L379 VanDerWaalsContact O-N 3.09Å; L379-A381 PolarHBondContact O-N 2.8Å; L379-A381 VanDerWaalsContact O-N 3.1Å
380	D	73.6	Confident	74	Confident	127 Å²	127	110.2 Å²	110.2	68%	0.679	59%	0.593	S	S	*	*	S	Bend	trans	-77.2	94.6	170.8	-66.9	-27.3	0	0	0	107.7	P382	D380-P382 VanDerWaalsContact O-CD 3.28Å; D380-P382 WeakPolarHBondContact O-CD 3.35Å; D380-P382 VanDerWaalsContact O-N 3.11Å
381	A	71.9	Confident	72.9	Confident	80 Å²	80	115.5 Å²	115.5	66%	0.661	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-54.6	120.9	172.3	0	0	0	0	0	107.9	L379	L379-A381 PolarHBondContact O-N 2.8Å; L379-A381 VanDerWaalsContact O-N 3.1Å
382	P	73.3	Confident	71.9	Confident	60 Å²	60	116.2 Å²	116.2	39%	0.39	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-54.3	149.8	173.7	-20.5	29.4	0	0	0	109.3	D380 L386 L387	D380-P382 VanDerWaalsContact O-CD 3.28Å; D380-P382 WeakPolarHBondContact O-CD 3.35Å; D380-P382 VanDerWaalsContact O-N 3.11Å; P382-L386 HydrophobicContact CB-CB 4.06Å; P382-L386 HydrophobicContact CB-CD1 4.45Å; P382-L387 HydrophobicContact CB-CG 4.31Å; P382-L387 HydrophobicContact CG-CD2 4.27Å; P382-L387 HydrophobicContact CG-CG 4.49Å; P382-L387 WeakPolarHBondContact O-CD1 3.48Å
383	P	74.4	Confident	70.7	Confident	70 Å²	70	114.5 Å²	114.5	46%	0.455	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-48.3	142.4	174.7	19.8	-32.3	0	0	0	110.2	E385 L386 L387	P383-E385 PolarHBondContact O-N 3.14Å; P383-L386 HydrophobicContact CG-CB 4.46Å; P383-L386 HydrophobicContact CG-CD1 3.78Å; P383-L386 HydrophobicContact CG-CG 4.08Å; P383-L386 PolarHBondContact O-N 3.25Å; P383-L387 PolarHBondContact O-N 3.03Å
384	P	67.7	Low	69.9	Low	97 Å²	97	113.1 Å²	113.1	63%	0.63	62%	0.623	S	S	*	*	H	α-helix	trans	-55.3	-27.7	-171.5	20.7	-32.5	0	0	0	113.2	L386 L387 L388	P384-L386 VanDerWaalsContact C-N 3.34Å; P384-L386 PolarHBondContact O-N 3.49Å; P384-L387 PolarHBondContact O-N 2.74Å; P384-L388 PolarHBondContact O-N 3.13Å
385	E	67.3	Low	69.8	Low	128 Å²	128	112.5 Å²	112.5	60%	0.598	61%	0.609	S	S	*	*	H	α-helix	trans	-55.9	-42.8	171.9	-61.6	172.8	-160.9	0	0	112.9	P383 A389	P383-E385 PolarHBondContact O-N 3.14Å; E385-A389 PolarHBondContact O-N 3.4Å
386	L	67.8	Low	69.9	Low	127 Å²	127	113.5 Å²	113.5	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-78.5	-28.2	177.9	-69.4	177.5	0	0	0	112.5	P382 P383 P384	P382-L386 HydrophobicContact CB-CB 4.06Å; P382-L386 HydrophobicContact CB-CD1 4.45Å; P383-L386 HydrophobicContact CG-CB 4.46Å; P383-L386 HydrophobicContact CG-CD1 3.78Å; P383-L386 HydrophobicContact CG-CG 4.08Å; P383-L386 PolarHBondContact O-N 3.25Å; P384-L386 VanDerWaalsContact C-N 3.34Å; P384-L386 PolarHBondContact O-N 3.49Å
387	L	67.5	Low	70.2	Confident	109 Å²	109	114.5 Å²	114.5	57%	0.571	61%	0.605	S	S	*	*	H	α-helix	trans	-73.6	-37.4	177.2	-76.4	172	0	0	0	112.6	P382 P383 P384	P382-L387 HydrophobicContact CB-CG 4.31Å; P382-L387 HydrophobicContact CG-CD2 4.27Å; P382-L387 HydrophobicContact CG-CG 4.49Å; P382-L387 WeakPolarHBondContact O-CD1 3.48Å; P383-L387 PolarHBondContact O-N 3.03Å; P384-L387 PolarHBondContact O-N 2.74Å
388	L	71.3	Confident	70.5	Confident	113 Å²	113	107.4 Å²	107.4	59%	0.592	57%	0.574	S	S	*	*	H	α-helix	trans	-86.2	-11.1	177.9	-95	67.5	0	0	0	113	P384 Q390	P384-L388 PolarHBondContact O-N 3.13Å; L388-Q390 HydrophobicContact CB-CB 4.28Å; L388-Q390 HydrophobicContact CB-CG 4.3Å; L388-Q390 WeakPolarHBondContact O-CG 3.38Å; L388-Q390 PolarHBondContact O-N 3.32Å
389	A	64.9	Low	70.8	Confident	90 Å²	90	111.6 Å²	111.6	74%	0.744	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.6	28.2	-173	0	0	0	0	0	112.9	E385	E385-A389 PolarHBondContact O-N 3.4Å
390	Q	64.5	Low	71	Confident	123 Å²	123	115.1 Å²	115.1	58%	0.575	60%	0.596	S	S	*	*			trans	-103.3	116.8	178.1	-75.5	177.4	-4.1	0	0	107.2	L388	L388-Q390 HydrophobicContact CB-CB 4.28Å; L388-Q390 HydrophobicContact CB-CG 4.3Å; L388-Q390 WeakPolarHBondContact O-CG 3.38Å; L388-Q390 PolarHBondContact O-N 3.32Å
391	T	64.3	Low	71.1	Confident	141 Å²	141	111.5 Å²	111.5	87%	0.865	59%	0.589	S	S	*	*			trans	-85.9	5.3	174.6	54	0	0	0	0	112.5
392	E	67.9	Low	71.1	Confident	158 Å²	158	111.8 Å²	111.8	74%	0.738	58%	0.582	S	S	*	*			trans	-124.3	110.3	-171	-63.7	-176.4	180	0	0	109.9	Y394	E392-Y394 PolarHBondContact O-N 2.98Å
393	D	63.9	Low	71.3	Confident	125 Å²	125	111 Å²	111	67%	0.668	58%	0.577	S	S	*	*			trans	-73.3	112.8	168.4	-72.2	-29.8	0	0	0	109.1	V395	D393-V395 PolarHBondContact O-N 3.16Å; D393-V395 VanDerWaalsContact O-N 3.11Å
394	Y	68.9	Low	71.1	Confident	170 Å²	170	112.8 Å²	112.8	67%	0.667	58%	0.581	S	S	*	*			trans	-71.7	106.4	177.7	-177.5	-107.5	0	0	0	110.7	E392 E396 G406	E392-Y394 PolarHBondContact O-N 2.98Å; Y394-E396 HydrophobicContact CD1-CG 4.02Å; Y394-E396 HydrophobicContact CE1-CG 3.23Å; Y394-E396 WeakPolarHBondContact CE1-OE1 3.49Å; Y394-G406 VanDerWaalsContact O-CA 3.28Å; Y394-G406 WeakPolarHBondContact O-CA 3.25Å
395	V	77.3	Confident	71.2	Confident	38 Å²	38	114 Å²	114	23%	0.23	58%	0.577	C	S	.	*			trans	-106.1	111.3	177.9	-176.6	0	0	0	0	110.3	D393 Y397 V403 K405	D393-V395 PolarHBondContact O-N 3.16Å; D393-V395 VanDerWaalsContact O-N 3.11Å; V395-Y397 HydrophobicContact CB-CE2 4.06Å; V395-Y397 HydrophobicContact CG1-CD2 4.29Å; V395-Y397 HydrophobicContact CG1-CE1 4.19Å; V395-Y397 HydrophobicContact CG1-CE2 3.74Å; V395-Y397 WeakPolarHBondContact O-CD2 3.34Å; V395-V403 HydrophobicContact CG1-CB 4.12Å; V395-V403 HydrophobicContact CG1-CG1 3.48Å; V395-V403 VanDerWaalsContact CG1-CG1 3.48Å; V395-V403 HydrophobicContact CG1-CG2 3.57Å; V395-K405 CarbonylContact C-O 3.57Å; V395-K405 WeakPolarHBondContact CA-O 3.47Å
396	E	79.7	Confident	71.2	Confident	52 Å²	52	110.1 Å²	110.1	24%	0.243	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.3	119.6	173.7	-67.1	179.1	-178.6	0	0	109.5	Y394 V403 I404 K405	Y394-E396 HydrophobicContact CD1-CG 4.02Å; Y394-E396 HydrophobicContact CE1-CG 3.23Å; Y394-E396 WeakPolarHBondContact CE1-OE1 3.49Å; E396-V403 CarbonylContact O-C 3.59Å; E396-V403 WeakPolarHBondContact O-CA 3.29Å; E396-I404 HydrophobicContact CB-CB 4.47Å; E396-I404 PolarHBondContact O-N 3.2Å; E396-K405 HydrophobicContact CB-CB 4.19Å; E396-K405 HydrophobicContact CG-CB 4.19Å; E396-K405 PolarHBondContact N-O 2.86Å; E396-K405 IonicContact OE1-NZ 3.23Å; E396-K405 PolarHBondContact OE1-NZ 2.85Å; E396-K405 WeakPolarHBondContact OE2-CD 3.37Å; E396-K405 IonicContact OE2-NZ 3.89Å; E396-K405 PolarHBondContact OE2-NZ 3.4Å
397	Y	79.7	Confident	71.1	Confident	153 Å²	153	110.5 Å²	110.5	60%	0.6	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.8	136.3	171.8	-61.8	-92.1	0	0	0	110.7	V395 T402 V403	V395-Y397 HydrophobicContact CB-CE2 4.06Å; V395-Y397 HydrophobicContact CG1-CD2 4.29Å; V395-Y397 HydrophobicContact CG1-CE1 4.19Å; V395-Y397 HydrophobicContact CG1-CE2 3.74Å; V395-Y397 WeakPolarHBondContact O-CD2 3.34Å; Y397-T402 CarbonylContact C-O 3.59Å; Y397-V403 HydrophobicContact CD1-CG2 3.85Å; Y397-V403 HydrophobicContact CE1-CG2 3.58Å
398	S	76.8	Confident	70.8	Confident	23 Å²	23	114.3 Å²	114.3	16%	0.161	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-64.4	161.9	165.5	87	0	0	0	0	110.1	H400 G401 T402	S398-H400 PolarHBondContact O-N 3.37Å; S398-H400 PolarHBondContact OG-N 2.8Å; S398-H400 VanDerWaalsContact OG-N 3.14Å; S398-G401 PolarHBondContact O-N 2.98Å; S398-T402 WeakPolarHBondContact CB-O 3.42Å; S398-T402 WeakPolarHBondContact CB-OG1 3.42Å; S398-T402 PolarHBondContact N-O 2.86Å; S398-T402 PolarHBondContact OG-N 3.14Å; S398-T402 PolarHBondContact OG-OG1 2.92Å
399	R	73.4	Confident	70.5	Confident	257 Å²	257	118.6 Å²	118.6	97%	0.97	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-16	173.7	-65.4	-177.9	-178.2	177.3	0.8	113.5
400	H	74.9	Confident	70.4	Confident	176 Å²	176	118.9 Å²	118.9	82%	0.815	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	6.5	176.5	-60.4	-70.3	0	0	0	113.3	S398 T402	S398-H400 PolarHBondContact O-N 3.37Å; S398-H400 PolarHBondContact OG-N 2.8Å; S398-H400 VanDerWaalsContact OG-N 3.14Å; H400-T402 VanDerWaalsContact C-N 3.35Å
401	G	75.9	Confident	70.6	Confident	51 Å²	51	120.6 Å²	120.6	53%	0.526	61%	0.611	S	S	.	*	S	Bend	trans	80.6	8.6	178.4	0	0	0	0	0	114.9	S398	S398-G401 PolarHBondContact O-N 2.98Å
402	T	72.6	Confident	70.5	Confident	86 Å²	86	118.5 Å²	118.5	53%	0.528	61%	0.609	S	S	.	*			trans	-87	133.8	176.1	56.6	0	0	0	0	110.9	Y397 S398 H400 I404	Y397-T402 CarbonylContact C-O 3.59Å; S398-T402 WeakPolarHBondContact CB-O 3.42Å; S398-T402 WeakPolarHBondContact CB-OG1 3.42Å; S398-T402 PolarHBondContact N-O 2.86Å; S398-T402 PolarHBondContact OG-N 3.14Å; S398-T402 PolarHBondContact OG-OG1 2.92Å; H400-T402 VanDerWaalsContact C-N 3.35Å; T402-I404 PolarHBondContact O-N 3.17Å
403	V	77	Confident	70.1	Confident	45 Å²	45	116 Å²	116	27%	0.273	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70	125	178.8	175.8	0	0	0	0	110.4	V395 E396 Y397 Q407	V395-V403 HydrophobicContact CG1-CB 4.12Å; V395-V403 HydrophobicContact CG1-CG1 3.48Å; V395-V403 VanDerWaalsContact CG1-CG1 3.48Å; V395-V403 HydrophobicContact CG1-CG2 3.57Å; E396-V403 CarbonylContact O-C 3.59Å; E396-V403 WeakPolarHBondContact O-CA 3.29Å; Y397-V403 HydrophobicContact CD1-CG2 3.85Å; Y397-V403 HydrophobicContact CE1-CG2 3.58Å; V403-Q407 HydrophobicContact CG1-CB 4Å; V403-Q407 HydrophobicContact CG1-CG 3.96Å
404	I	70.8	Confident	70.5	Confident	107 Å²	107	112.9 Å²	112.9	55%	0.549	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.9	-39.9	-179.9	-58.9	173.3	0	0	0	111.1	E396 T402	E396-I404 HydrophobicContact CB-CB 4.47Å; E396-I404 PolarHBondContact O-N 3.2Å; T402-I404 PolarHBondContact O-N 3.17Å
405	K	67.9	Low	70.6	Confident	123 Å²	123	114.4 Å²	114.4	54%	0.535	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-141.2	150.6	177.6	-68.7	-172.4	-162.2	144.6	0	110.3	V395 E396	V395-K405 CarbonylContact C-O 3.57Å; V395-K405 WeakPolarHBondContact CA-O 3.47Å; E396-K405 HydrophobicContact CB-CB 4.19Å; E396-K405 HydrophobicContact CG-CB 4.19Å; E396-K405 PolarHBondContact N-O 2.86Å; E396-K405 IonicContact OE1-NZ 3.23Å; E396-K405 PolarHBondContact OE1-NZ 2.85Å; E396-K405 WeakPolarHBondContact OE2-CD 3.37Å; E396-K405 IonicContact OE2-NZ 3.89Å; E396-K405 PolarHBondContact OE2-NZ 3.4Å
406	G	67.5	Low	70	Confident	46 Å²	46	121.2 Å²	121.2	47%	0.474	63%	0.628	S	S	.	*	S	Bend	trans	105.2	-13.3	172	0	0	0	0	0	115.8	Y394	Y394-G406 VanDerWaalsContact O-CA 3.28Å; Y394-G406 WeakPolarHBondContact O-CA 3.25Å
407	Q	65.7	Low	69.4	Low	134 Å²	134	127 Å²	127	63%	0.626	66%	0.655	S	S	*	*	S	Bend	trans	-95	126.3	169.6	-85.6	-178.6	-19.4	0	0	110.7	V403 K409	V403-Q407 HydrophobicContact CG1-CB 4Å; V403-Q407 HydrophobicContact CG1-CG 3.96Å; Q407-K409 PolarHBondContact O-N 3.35Å
408	E	61.3	Low	68.8	Low	190 Å²	190	124.7 Å²	124.7	89%	0.888	65%	0.65	S	S	*	*			trans	-53.6	128.6	163.1	-64.6	-168.2	151.3	0	0	108.4	A410	E408-A410 PolarHBondContact O-N 2.84Å
409	K	65.1	Low	68.5	Low	203 Å²	203	129 Å²	129	88%	0.883	67%	0.671	S	S	*	*			trans	-60.5	112.4	-178.8	-72.9	179.9	179.4	177	0	108.4	Q407 I411	Q407-K409 PolarHBondContact O-N 3.35Å; K409-I411 PolarHBondContact O-N 3.08Å
410	A	62.4	Low	68.5	Low	95 Å²	95	119.6 Å²	119.6	79%	0.785	64%	0.642	S	S	*	*			trans	-53	129.6	172.4	0	0	0	0	0	109.3	E408 A412	E408-A410 PolarHBondContact O-N 2.84Å; A410-A412 PolarHBondContact O-N 2.89Å
411	I	68.8	Low	68.6	Low	159 Å²	159	117.6 Å²	117.6	82%	0.815	63%	0.631	S	S	*	*			trans	-59.4	124.9	175.9	-59.1	161.5	0	0	0	106.6	K409 C413	K409-I411 PolarHBondContact O-N 3.08Å; I411-C413 PolarHBondContact O-N 3.43Å
412	A	62.2	Low	68.6	Low	98 Å²	98	117.1 Å²	117.1	81%	0.81	62%	0.616	S	S	*	*			trans	-65.5	102.2	-174.7	0	0	0	0	0	110.7	A410	A410-A412 PolarHBondContact O-N 2.89Å
413	C	59.4	Low	68.6	Low	105 Å²	105	115.7 Å²	115.7	71%	0.709	61%	0.605	S	S	*	*			trans	-72.5	141.4	167.9	-60.5	0	0	0	0	109.7	I411	I411-C413 PolarHBondContact O-N 3.43Å
414	S	73.8	Confident	68.7	Low	59 Å²	59	120.7 Å²	120.7	41%	0.413	63%	0.631	S	S	.	*			trans	-70.3	168.5	175	76.2	0	0	0	0	112.3	Y416 E418	S414-Y416 PolarHBondContact O-N 2.76Å; S414-E418 WeakPolarHBondContact CB-OE1 3.39Å; S414-E418 PolarHBondContact N-OE1 2.95Å; S414-E418 VanDerWaalsContact N-OE1 3.08Å; S414-E418 PolarHBondContact OG-OE1 3.35Å
415	K	70.4	Confident	69	Low	203 Å²	203	115.8 Å²	115.8	88%	0.883	61%	0.605	S	S	*	*	S	Bend	trans	-60.4	-13.7	179	-177.6	175.2	177	-179.2	0	113.7
416	Y	65.5	Low	69.7	Low	181 Å²	181	114.6 Å²	114.6	71%	0.71	61%	0.609	S	S	*	*	S	Bend	trans	-100.8	147.1	-179	-59.8	-77	0	0	0	109.7	S414 E418	S414-Y416 PolarHBondContact O-N 2.76Å; Y416-E418 PolarHBondContact O-N 3.4Å
417	E	66.3	Low	70.4	Confident	174 Å²	174	114.1 Å²	114.1	81%	0.813	60%	0.598	S	S	*	*			trans	-62.4	102.4	174.4	-60.1	177.6	170.3	0	0	109.2	V420	E417-V420 HydrophobicContact CB-CG2 3.47Å; E417-V420 VanDerWaalsContact CB-CG2 3.47Å
418	E	66.9	Low	71.4	Confident	103 Å²	103	111 Å²	111	48%	0.481	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	150.1	174.7	-67.9	176.6	-175.4	0	0	109.6	S414 Y416 V420	S414-E418 WeakPolarHBondContact CB-OE1 3.39Å; S414-E418 PolarHBondContact N-OE1 2.95Å; S414-E418 VanDerWaalsContact N-OE1 3.08Å; S414-E418 PolarHBondContact OG-OE1 3.35Å; Y416-E418 PolarHBondContact O-N 3.4Å; E418-V420 VanDerWaalsContact C-N 3.3Å; E418-V420 PolarHBondContact O-N 3.18Å
419	D	70.6	Confident	72.3	Confident	114 Å²	114	105.1 Å²	105.1	61%	0.61	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.9	21.4	175.1	-61.2	-45.3	0	0	0	117.7	K421 I428	D419-K421 PolarHBondContact O-N 2.85Å; D419-I428 HydrophobicContact CB-CD1 4.49Å; D419-I428 WeakPolarHBondContact OD1-CD1 3.21Å
420	V	72.7	Confident	73.1	Confident	60 Å²	60	96.8 Å²	96.8	36%	0.364	53%	0.525	S	S	.	.			trans	-70.9	102	171.3	-172.4	0	0	0	0	110.9	E417 E418 I422	E417-V420 HydrophobicContact CB-CG2 3.47Å; E417-V420 VanDerWaalsContact CB-CG2 3.47Å; E418-V420 VanDerWaalsContact C-N 3.3Å; E418-V420 PolarHBondContact O-N 3.18Å; V420-I422 HydrophobicContact CG1-CG1 3.93Å; V420-I422 PolarHBondContact O-N 3.46Å
421	K	77.9	Confident	74.1	Confident	134 Å²	134	94.6 Å²	94.6	58%	0.583	50%	0.504	S	S	*	.			trans	-84.1	103.4	174.3	-69.5	175	-171.5	172.4	0	109.9	D419 H425 T426	D419-K421 PolarHBondContact O-N 2.85Å; K421-H425 WeakPolarHBondContact CB-O 3.5Å; K421-H425 WeakPolarHBondContact CG-O 3.37Å; K421-T426 WeakPolarHBondContact CE-O 3.45Å
422	I	76.4	Confident	74.7	Confident	41 Å²	41	89.2 Å²	89.2	21%	0.21	47%	0.474	C	S	.	.			trans	-91	139.7	-178	-52.6	160	0	0	0	109.1	V420 N424 H425 F449	V420-I422 HydrophobicContact CG1-CG1 3.93Å; V420-I422 PolarHBondContact O-N 3.46Å; I422-N424 PolarHBondContact O-N 2.85Å; I422-H425 PolarHBondContact O-CD2 3.09Å; I422-H425 VanDerWaalsContact O-CD2 3.22Å; I422-H425 PolarHBondContact O-N 3.02Å; I422-F449 HydrophobicContact CD1-CD1 4.32Å; I422-F449 HydrophobicContact CD1-CE1 3.84Å; I422-F449 HydrophobicContact CG2-CD1 3.61Å; I422-F449 HydrophobicContact CG2-CE1 4.01Å
423	N	71.9	Confident	75.7	Confident	56 Å²	56	90.8 Å²	90.8	30%	0.299	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	51.5	170.5	-61.9	-10	0	0	0	115.4	H425 F449 Y451 C452	N423-H425 VanDerWaalsContact C-N 3.28Å; N423-H425 PolarHBondContact O-CD2 3.5Å; N423-H425 PolarHBondContact O-N 3.37Å; N423-F449 PolarHBondContact ND2-O 3.5Å; N423-Y451 HydrophobicContact CB-CD1 3.98Å; N423-Y451 HydrophobicContact CB-CE1 4.18Å; N423-Y451 HydrophobicContact CB-CG 4.47Å; N423-C452 PolarHBondContact O-N 2.74Å
424	N	78.9	Confident	76.7	Confident	150 Å²	150	89.4 Å²	89.4	80%	0.802	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	22.9	175.8	-71.4	-5.8	0	0	0	116.1	I422	I422-N424 PolarHBondContact O-N 2.85Å
425	H	77.9	Confident	76.9	Confident	3 Å²	3	94.6 Å²	94.6	1%	0.014	46%	0.459	C	S	.	.			trans	-78	140	168.4	-73.2	-90.8	0	0	0	111.2	K421 I422 N423 C427 Y440 C442 S450 C452	K421-H425 WeakPolarHBondContact CB-O 3.5Å; K421-H425 WeakPolarHBondContact CG-O 3.37Å; I422-H425 PolarHBondContact O-CD2 3.09Å; I422-H425 VanDerWaalsContact O-CD2 3.22Å; I422-H425 PolarHBondContact O-N 3.02Å; N423-H425 VanDerWaalsContact C-N 3.28Å; N423-H425 PolarHBondContact O-CD2 3.5Å; N423-H425 PolarHBondContact O-N 3.37Å; H425-C427 VanDerWaalsContact C-N 3.34Å; H425-Y440 HydrophobicContact CB-CD1 4.13Å; H425-Y440 HydrophobicContact CB-CE1 4.29Å; H425-Y440 AromaticContact CD2-CE2 3.92Å; H425-Y440 AromaticContact CD2-CZ 3.97Å; H425-Y440 AromaticContact CE1-CD2 3.34Å; H425-Y440 WeakPolarHBondContact CE1-CD2 3.45Å; H425-Y440 AromaticContact CE1-CE2 3.73Å; H425-Y440 AromaticContact CE1-CG 3.71Å; H425-Y440 AromaticContact CG-CD1 3.92Å; H425-Y440 AromaticContact CG-CG 3.93Å; H425-Y440 AromaticContact ND1-CD1 3.91Å; H425-Y440 AromaticContact ND1-CD2 3.6Å; H425-Y440 AromaticContact ND1-CG 3.45Å; H425-Y440 AromaticContact NE2-CD2 3.71Å; H425-Y440 AromaticContact NE2-CE2 3.58Å; H425-C442 PolarHBondContact ND1-SG 3.27Å; H425-S450 PolarHBondContact CD2-O 2.82Å; H425-S450 VanDerWaalsContact CD2-O 3.31Å; H425-S450 PolarHBondContact NE2-O 3.07Å; H425-C452 HydrophobicContact CB-CB 4.48Å; H425-C452 VanDerWaalsContact CE1-CA 3.41Å; H425-C452 WeakPolarHBondContact CE1-CA 3.47Å; H425-C452 WeakPolarHBondContact ND1-CB 3.13Å; H425-C452 PolarHBondContact ND1-SG 2.76Å; H425-C452 PolarHBondContact NE2-N 3.19Å
426	T	81.4	Confident	77.5	Confident	99 Å²	99	87.4 Å²	87.4	61%	0.607	44%	0.443	S	S	*	.	S	Bend	trans	-83.4	-12	176.4	53.7	0	0	0	0	113.2	K421 C442	K421-T426 WeakPolarHBondContact CE-O 3.45Å; T426-C442 WeakPolarHBondContact OG1-CB 3.34Å
427	C	82.4	Confident	78.5	Confident	36 Å²	36	85.2 Å²	85.2	24%	0.243	44%	0.437	C	S	.	.	S	Bend	trans	-127.5	151.4	179.2	-55.7	0	0	0	0	110.9	H425 S431 Y440 K441	H425-C427 VanDerWaalsContact C-N 3.34Å; C427-S431 WeakPolarHBondContact CB-OG 3.38Å; C427-Y440 WeakPolarHBondContact O-CD1 3.42Å; C427-K441 HydrophobicContact CB-CB 4.09Å
428	I	86.1	Confident	79.5	Confident	67 Å²	67	83.7 Å²	83.7	34%	0.344	42%	0.424	S	S	.	.			trans	-69.3	154.4	178.9	-52.2	151.5	0	0	0	111	D419 G430 S431	D419-I428 HydrophobicContact CB-CD1 4.49Å; D419-I428 WeakPolarHBondContact OD1-CD1 3.21Å; I428-G430 PolarHBondContact O-N 2.89Å; I428-S431 WeakPolarHBondContact O-CB 3.09Å; I428-S431 PolarHBondContact O-N 3.05Å; I428-S431 VanDerWaalsContact O-N 3.14Å; I428-S431 PolarHBondContact O-OG 3.13Å
429	W	80.8	Confident	80.5	Confident	68 Å²	68	78.8 Å²	78.8	26%	0.258	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	127.1	168.9	179.4	-98.6	0	0	0	111.5	W438 Y440 F446 V447 K448	W429-W438 VanDerWaalsContact CH2-O 3.29Å; W429-W438 WeakPolarHBondContact CH2-O 3.31Å; W429-W438 WeakPolarHBondContact CZ2-O 3.47Å; W429-Y440 VanDerWaalsContact CA-CE1 3.46Å; W429-Y440 HydrophobicContact CB-CD1 4.2Å; W429-Y440 HydrophobicContact CB-CE1 3.57Å; W429-Y440 HydrophobicContact CD2-CE1 4.46Å; W429-Y440 HydrophobicContact CD2-CE2 4.46Å; W429-Y440 HydrophobicContact CE3-CD1 4.09Å; W429-Y440 AromaticContact CE3-CD2 3.55Å; W429-Y440 HydrophobicContact CE3-CD2 3.55Å; W429-Y440 AromaticContact CE3-CE1 3.82Å; W429-Y440 HydrophobicContact CE3-CE1 3.82Å; W429-Y440 AromaticContact CE3-CE2 3.28Å; W429-Y440 HydrophobicContact CE3-CE2 3.28Å; W429-Y440 AromaticContact CE3-CG 3.97Å; W429-Y440 HydrophobicContact CE3-CG 3.97Å; W429-Y440 AromaticContact CE3-CZ 3.42Å; W429-Y440 VanDerWaalsContact CE3-CZ 3.42Å; W429-Y440 HydrophobicContact CG-CE1 4.44Å; W429-Y440 AromaticContact CZ3-CD2 3.75Å; W429-Y440 HydrophobicContact CZ3-CD2 3.75Å; W429-Y440 AromaticContact CZ3-CE2 3.61Å; W429-Y440 HydrophobicContact CZ3-CE2 3.61Å; W429-Y440 HydrophobicContact CZ3-CG 4.48Å; W429-Y440 VanDerWaalsContact N-CE1 3.34Å; W429-F446 WeakPolarHBondContact CH2-O 3.27Å; W429-V447 WeakPolarHBondContact CZ3-O 3.43Å; W429-K448 HydrophobicContact CD2-CB 3.95Å; W429-K448 HydrophobicContact CD2-CD 4.33Å; W429-K448 HydrophobicContact CD2-CG 3.7Å; W429-K448 HydrophobicContact CE3-CB 4.12Å; W429-K448 HydrophobicContact CE3-CG 4.17Å; W429-K448 HydrophobicContact CG-CD 4.28Å; W429-K448 HydrophobicContact CG-CG 3.97Å; W429-K448 VanDerWaalsContact CH2-CA 3.48Å; W429-K448 HydrophobicContact CH2-CB 3.75Å; W429-K448 HydrophobicContact CZ2-CB 3.61Å; W429-K448 HydrophobicContact CZ2-CG 4.2Å; W429-K448 HydrophobicContact CZ3-CB 4.03Å
430	G	81.6	Confident	81.3	Confident	27 Å²	27	73.4 Å²	73.4	28%	0.278	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.6	-2	-173.3	0	0	0	0	0	113.9	I428 Y432 W438 G439	I428-G430 PolarHBondContact O-N 2.89Å; G430-Y432 PolarHBondContact O-N 3.36Å; G430-W438 VanDerWaalsContact O-CE3 3.27Å; G430-W438 WeakPolarHBondContact O-CZ3 3.37Å; G430-G439 PolarHBondContact N-O 3.33Å
431	S	84.1	Confident	81.8	Confident	49 Å²	49	76.4 Å²	76.4	34%	0.343	38%	0.38	S	S	.	.	S	Bend	trans	-69.6	-10	171.1	56	0	0	0	0	114.2	C427 I428 G439 K441	C427-S431 WeakPolarHBondContact CB-OG 3.38Å; I428-S431 WeakPolarHBondContact O-CB 3.09Å; I428-S431 PolarHBondContact O-N 3.05Å; I428-S431 VanDerWaalsContact O-N 3.14Å; I428-S431 PolarHBondContact O-OG 3.13Å; S431-G439 PolarHBondContact N-O 3.21Å; S431-K441 WeakPolarHBondContact OG-CB 3.48Å; S431-K441 PolarHBondContact OG-N 3.47Å
432	Y	82	Confident	82	Confident	47 Å²	47	70.7 Å²	70.7	18%	0.184	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.8	177.7	-176	-113.3	0	0	0	111.3	G430 K434 W438 G439 H444 F446	G430-Y432 PolarHBondContact O-N 3.36Å; Y432-K434 HydrophobicContact CE1-CB 4.13Å; Y432-W438 CarbonylContact O-C 3.4Å; Y432-W438 WeakPolarHBondContact O-CA 3.45Å; Y432-G439 PolarHBondContact N-O 3.37Å; Y432-G439 VanDerWaalsContact N-O 3.09Å; Y432-G439 PolarHBondContact O-N 3.48Å; Y432-H444 HydrophobicContact CD1-CB 4.26Å; Y432-H444 AromaticContact CD1-CD2 3.97Å; Y432-H444 AromaticContact CD2-CD2 3.68Å; Y432-H444 AromaticContact CD2-NE2 3.76Å; Y432-H444 HydrophobicContact CE1-CB 3.82Å; Y432-H444 AromaticContact CE1-CD2 3.83Å; Y432-H444 AromaticContact CE1-CG 3.69Å; Y432-H444 AromaticContact CE2-CD2 3.54Å; Y432-H444 AromaticContact CE2-CE1 3.73Å; Y432-H444 AromaticContact CE2-NE2 3.38Å; Y432-H444 WeakPolarHBondContact CE2-NE2 3.37Å; Y432-H444 AromaticContact CG-CD2 3.9Å; Y432-H444 AromaticContact CZ-CD2 3.62Å; Y432-H444 AromaticContact CZ-CE1 3.78Å; Y432-H444 AromaticContact CZ-CG 3.59Å; Y432-H444 AromaticContact CZ-ND1 3.68Å; Y432-H444 AromaticContact CZ-NE2 3.77Å; Y432-H444 PolarHBondContact OH-ND1 3.17Å; Y432-F446 AromaticContact CD1-CE1 3.9Å; Y432-F446 HydrophobicContact CD1-CE1 3.9Å; Y432-F446 HydrophobicContact CD1-CZ 4.31Å; Y432-F446 AromaticContact CE1-CE1 3.74Å; Y432-F446 HydrophobicContact CE1-CE1 3.74Å; Y432-F446 AromaticContact CE1-CZ 3.71Å; Y432-F446 HydrophobicContact CE1-CZ 3.71Å
433	W	82.1	Confident	82.2	Confident	131 Å²	131	68.9 Å²	68.9	50%	0.496	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127.1	-179.7	174.7	-102.4	0	0	0	110.3	G436 K437 W438	W433-G436 WeakPolarHBondContact CH2-O 3.46Å; W433-G436 VanDerWaalsContact CZ2-CA 3.43Å; W433-G436 WeakPolarHBondContact CZ3-O 3.37Å; W433-K437 VanDerWaalsContact CE3-O 3.27Å; W433-W438 HydrophobicContact CB-CE3 3.91Å; W433-W438 HydrophobicContact CB-CH2 4.34Å; W433-W438 HydrophobicContact CB-CZ3 3.78Å; W433-W438 HydrophobicContact CD2-CD2 4.24Å; W433-W438 HydrophobicContact CD2-CE3 4.36Å; W433-W438 HydrophobicContact CD2-CH2 4.36Å; W433-W438 HydrophobicContact CD2-CZ2 4.21Å; W433-W438 HydrophobicContact CD2-CZ3 4.44Å; W433-W438 HydrophobicContact CE3-CB 4.36Å; W433-W438 AromaticContact CE3-CD1 3.73Å; W433-W438 AromaticContact CE3-CD2 3.28Å; W433-W438 HydrophobicContact CE3-CD2 3.28Å; W433-W438 AromaticContact CE3-CE2 3.28Å; W433-W438 AromaticContact CE3-CE3 3.77Å; W433-W438 HydrophobicContact CE3-CE3 3.77Å; W433-W438 AromaticContact CE3-CG 3.56Å; W433-W438 HydrophobicContact CE3-CG 3.56Å; W433-W438 HydrophobicContact CE3-CH2 4.23Å; W433-W438 AromaticContact CE3-CZ2 3.78Å; W433-W438 HydrophobicContact CE3-CZ2 3.78Å; W433-W438 HydrophobicContact CE3-CZ3 4.22Å; W433-W438 AromaticContact CE3-NE1 3.56Å; W433-W438 HydrophobicContact CG-CE3 4.49Å; W433-W438 HydrophobicContact CG-CH2 4.46Å; W433-W438 HydrophobicContact CG-CZ3 4.33Å; W433-W438 AromaticContact CZ3-CD1 3.37Å; W433-W438 AromaticContact CZ3-CD2 3.75Å; W433-W438 HydrophobicContact CZ3-CD2 3.75Å; W433-W438 AromaticContact CZ3-CE2 3.41Å; W433-W438 VanDerWaalsContact CZ3-CE2 3.41Å; W433-W438 AromaticContact CZ3-CG 3.71Å; W433-W438 HydrophobicContact CZ3-CG 3.71Å; W433-W438 HydrophobicContact CZ3-CZ2 4.06Å; W433-W438 AromaticContact CZ3-NE1 3.16Å
434	K	80.8	Confident	82.7	Confident	76 Å²	76	68 Å²	68	33%	0.33	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	135	172.1	-167.8	179.4	176.2	-172.9	0	109.2	Y432 G436 K437 F446	Y432-K434 HydrophobicContact CE1-CB 4.13Å; K434-G436 VanDerWaalsContact C-N 3.32Å; K434-G436 PolarHBondContact O-N 3.36Å; K434-G436 VanDerWaalsContact O-N 3.15Å; K434-K437 PolarHBondContact N-O 3.42Å; K434-K437 PolarHBondContact O-N 3.12Å; K434-F446 HydrophobicContact CB-CE1 3.94Å; K434-F446 HydrophobicContact CB-CZ 3.78Å; K434-F446 HydrophobicContact CD-CZ 4.41Å
435	E	77.6	Confident	82.8	Confident	167 Å²	167	62.3 Å²	62.3	78%	0.78	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	43.1	172.8	-68.2	168.7	-150.6	0	0	115.7	K437	E435-K437 PolarHBondContact O-N 3.32Å
436	G	84.2	Confident	83.2	Confident	53 Å²	53	65.9 Å²	65.9	55%	0.546	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	3	175.4	0	0	0	0	0	115.1	W433 K434	W433-G436 WeakPolarHBondContact CH2-O 3.46Å; W433-G436 VanDerWaalsContact CZ2-CA 3.43Å; W433-G436 WeakPolarHBondContact CZ3-O 3.37Å; K434-G436 VanDerWaalsContact C-N 3.32Å; K434-G436 PolarHBondContact O-N 3.36Å; K434-G436 VanDerWaalsContact O-N 3.15Å
437	K	86.1	Confident	83.3	Confident	135 Å²	135	65.7 Å²	65.7	59%	0.587	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.1	-179.5	-63	175.1	-174.8	172.6	0	111.2	W433 K434 E435 F446	W433-K437 VanDerWaalsContact CE3-O 3.27Å; K434-K437 PolarHBondContact N-O 3.42Å; K434-K437 PolarHBondContact O-N 3.12Å; E435-K437 PolarHBondContact O-N 3.32Å; K437-F446 HydrophobicContact CB-CB 4.36Å; K437-F446 HydrophobicContact CB-CD1 3.71Å; K437-F446 HydrophobicContact CB-CE1 4.29Å; K437-F446 HydrophobicContact CB-CG 4.16Å
438	W	86	Confident	83.1	Confident	141 Å²	141	69.1 Å²	69.1	53%	0.534	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143.8	172.1	-67.1	104.1	0	0	0	110.3	W429 G430 Y432 W433	W429-W438 VanDerWaalsContact CH2-O 3.29Å; W429-W438 WeakPolarHBondContact CH2-O 3.31Å; W429-W438 WeakPolarHBondContact CZ2-O 3.47Å; G430-W438 VanDerWaalsContact O-CE3 3.27Å; G430-W438 WeakPolarHBondContact O-CZ3 3.37Å; Y432-W438 CarbonylContact O-C 3.4Å; Y432-W438 WeakPolarHBondContact O-CA 3.45Å; W433-W438 HydrophobicContact CB-CE3 3.91Å; W433-W438 HydrophobicContact CB-CH2 4.34Å; W433-W438 HydrophobicContact CB-CZ3 3.78Å; W433-W438 HydrophobicContact CD2-CD2 4.24Å; W433-W438 HydrophobicContact CD2-CE3 4.36Å; W433-W438 HydrophobicContact CD2-CH2 4.36Å; W433-W438 HydrophobicContact CD2-CZ2 4.21Å; W433-W438 HydrophobicContact CD2-CZ3 4.44Å; W433-W438 HydrophobicContact CE3-CB 4.36Å; W433-W438 AromaticContact CE3-CD1 3.73Å; W433-W438 AromaticContact CE3-CD2 3.28Å; W433-W438 HydrophobicContact CE3-CD2 3.28Å; W433-W438 AromaticContact CE3-CE2 3.28Å; W433-W438 AromaticContact CE3-CE3 3.77Å; W433-W438 HydrophobicContact CE3-CE3 3.77Å; W433-W438 AromaticContact CE3-CG 3.56Å; W433-W438 HydrophobicContact CE3-CG 3.56Å; W433-W438 HydrophobicContact CE3-CH2 4.23Å; W433-W438 AromaticContact CE3-CZ2 3.78Å; W433-W438 HydrophobicContact CE3-CZ2 3.78Å; W433-W438 HydrophobicContact CE3-CZ3 4.22Å; W433-W438 AromaticContact CE3-NE1 3.56Å; W433-W438 HydrophobicContact CG-CE3 4.49Å; W433-W438 HydrophobicContact CG-CH2 4.46Å; W433-W438 HydrophobicContact CG-CZ3 4.33Å; W433-W438 AromaticContact CZ3-CD1 3.37Å; W433-W438 AromaticContact CZ3-CD2 3.75Å; W433-W438 HydrophobicContact CZ3-CD2 3.75Å; W433-W438 AromaticContact CZ3-CE2 3.41Å; W433-W438 VanDerWaalsContact CZ3-CE2 3.41Å; W433-W438 AromaticContact CZ3-CG 3.71Å; W433-W438 HydrophobicContact CZ3-CG 3.71Å; W433-W438 HydrophobicContact CZ3-CZ2 4.06Å; W433-W438 AromaticContact CZ3-NE1 3.16Å
439	G	88.4	Confident	82.9	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	-170.9	-179.8	0	0	0	0	0	113.1	G430 S431 Y432 S445	G430-G439 PolarHBondContact N-O 3.33Å; S431-G439 PolarHBondContact N-O 3.21Å; Y432-G439 PolarHBondContact N-O 3.37Å; Y432-G439 VanDerWaalsContact N-O 3.09Å; Y432-G439 PolarHBondContact O-N 3.48Å; G439-S445 CarbonylContact C-O 3.56Å; G439-S445 WeakPolarHBondContact CA-O 3.46Å
440	Y	86.9	Confident	82.9	Confident	1 Å²	1	69.6 Å²	69.6	0%	0.004	34%	0.343	C	S	.	.			trans	-94.5	131.2	176.5	-62.1	-75.1	0	0	0	111.8	H425 C427 W429 C442 H444 S445 F449	H425-Y440 HydrophobicContact CB-CD1 4.13Å; H425-Y440 HydrophobicContact CB-CE1 4.29Å; H425-Y440 AromaticContact CD2-CE2 3.92Å; H425-Y440 AromaticContact CD2-CZ 3.97Å; H425-Y440 AromaticContact CE1-CD2 3.34Å; H425-Y440 WeakPolarHBondContact CE1-CD2 3.45Å; H425-Y440 AromaticContact CE1-CE2 3.73Å; H425-Y440 AromaticContact CE1-CG 3.71Å; H425-Y440 AromaticContact CG-CD1 3.92Å; H425-Y440 AromaticContact CG-CG 3.93Å; H425-Y440 AromaticContact ND1-CD1 3.91Å; H425-Y440 AromaticContact ND1-CD2 3.6Å; H425-Y440 AromaticContact ND1-CG 3.45Å; H425-Y440 AromaticContact NE2-CD2 3.71Å; H425-Y440 AromaticContact NE2-CE2 3.58Å; C427-Y440 WeakPolarHBondContact O-CD1 3.42Å; W429-Y440 VanDerWaalsContact CA-CE1 3.46Å; W429-Y440 HydrophobicContact CB-CD1 4.2Å; W429-Y440 HydrophobicContact CB-CE1 3.57Å; W429-Y440 HydrophobicContact CD2-CE1 4.46Å; W429-Y440 HydrophobicContact CD2-CE2 4.46Å; W429-Y440 HydrophobicContact CE3-CD1 4.09Å; W429-Y440 AromaticContact CE3-CD2 3.55Å; W429-Y440 HydrophobicContact CE3-CD2 3.55Å; W429-Y440 AromaticContact CE3-CE1 3.82Å; W429-Y440 HydrophobicContact CE3-CE1 3.82Å; W429-Y440 AromaticContact CE3-CE2 3.28Å; W429-Y440 HydrophobicContact CE3-CE2 3.28Å; W429-Y440 AromaticContact CE3-CG 3.97Å; W429-Y440 HydrophobicContact CE3-CG 3.97Å; W429-Y440 AromaticContact CE3-CZ 3.42Å; W429-Y440 VanDerWaalsContact CE3-CZ 3.42Å; W429-Y440 HydrophobicContact CG-CE1 4.44Å; W429-Y440 AromaticContact CZ3-CD2 3.75Å; W429-Y440 HydrophobicContact CZ3-CD2 3.75Å; W429-Y440 AromaticContact CZ3-CE2 3.61Å; W429-Y440 HydrophobicContact CZ3-CE2 3.61Å; W429-Y440 HydrophobicContact CZ3-CG 4.48Å; W429-Y440 VanDerWaalsContact N-CE1 3.34Å; Y440-C442 VanDerWaalsContact C-N 3.31Å; Y440-C442 PolarHBondContact O-N 2.95Å; Y440-H444 VanDerWaalsContact O-CA 3.22Å; Y440-H444 WeakPolarHBondContact O-CA 3.39Å; Y440-H444 PolarHBondContact O-N 3.24Å; Y440-S445 PolarHBondContact N-O 3.34Å; Y440-F449 PolarHBondContact OH-N 3.12Å
441	K	83.7	Confident	82.9	Confident	124 Å²	124	76.6 Å²	76.6	54%	0.539	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-29.7	178.1	-173.5	178.5	178.5	-177.7	0	114	C427 S431 K458	C427-K441 HydrophobicContact CB-CB 4.09Å; S431-K441 WeakPolarHBondContact OG-CB 3.48Å; S431-K441 PolarHBondContact OG-N 3.47Å; K441-K458 WeakPolarHBondContact O-CE 3.43Å
442	C	82.9	Confident	82.9	Confident	14 Å²	14	76 Å²	76	10%	0.095	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-37.4	-178.9	46.4	0	0	0	0	113.2	H425 T426 Y440 C452 K458	H425-C442 PolarHBondContact ND1-SG 3.27Å; T426-C442 WeakPolarHBondContact OG1-CB 3.34Å; Y440-C442 VanDerWaalsContact C-N 3.31Å; Y440-C442 PolarHBondContact O-N 2.95Å; C442-C452 PolarHBondContact SG-SG 2.86Å; C442-K458 WeakPolarHBondContact O-CE 3.46Å; C442-K458 PolarHBondContact O-NZ 2.85Å
443	C	79.4	Confident	82.7	Confident	2 Å²	2	77.8 Å²	77.8	1%	0.014	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-0.6	-169.4	-74	0	0	0	0	113.8	S445 C452 T453 G454	C443-S445 PolarHBondContact O-N 3.06Å; C443-C452 HydrophobicContact CB-CB 4.46Å; C443-C452 WeakPolarHBondContact CB-SG 3.41Å; C443-C452 VanDerWaalsContact SG-C 3.54Å; C443-C452 WeakPolarHBondContact SG-CA 3.35Å; C443-C452 WeakPolarHBondContact SG-CB 3.36Å; C443-C452 CovalentContact SG-SG 2.07Å; C443-C452 PolarHBondContact SG-SG 3.02Å; C443-T453 PolarHBondContact SG-N 3.04Å; C443-G454 VanDerWaalsContact SG-CA 3.5Å; C443-G454 PolarHBondContact SG-N 2.47Å
444	H	83.7	Confident	82.5	Confident	39 Å²	39	73.1 Å²	73.1	18%	0.181	37%	0.367	C	S	.	.			trans	50.5	19.9	-173.7	-68.6	-179.4	0	0	0	115	Y432 Y440	Y432-H444 HydrophobicContact CD1-CB 4.26Å; Y432-H444 AromaticContact CD1-CD2 3.97Å; Y432-H444 AromaticContact CD2-CD2 3.68Å; Y432-H444 AromaticContact CD2-NE2 3.76Å; Y432-H444 HydrophobicContact CE1-CB 3.82Å; Y432-H444 AromaticContact CE1-CD2 3.83Å; Y432-H444 AromaticContact CE1-CG 3.69Å; Y432-H444 AromaticContact CE2-CD2 3.54Å; Y432-H444 AromaticContact CE2-CE1 3.73Å; Y432-H444 AromaticContact CE2-NE2 3.38Å; Y432-H444 WeakPolarHBondContact CE2-NE2 3.37Å; Y432-H444 AromaticContact CG-CD2 3.9Å; Y432-H444 AromaticContact CZ-CD2 3.62Å; Y432-H444 AromaticContact CZ-CE1 3.78Å; Y432-H444 AromaticContact CZ-CG 3.59Å; Y432-H444 AromaticContact CZ-ND1 3.68Å; Y432-H444 AromaticContact CZ-NE2 3.77Å; Y432-H444 PolarHBondContact OH-ND1 3.17Å; Y440-H444 VanDerWaalsContact O-CA 3.22Å; Y440-H444 WeakPolarHBondContact O-CA 3.39Å; Y440-H444 PolarHBondContact O-N 3.24Å
445	S	81.3	Confident	82.3	Confident	29 Å²	29	76.7 Å²	76.7	20%	0.203	39%	0.385	C	S	.	.			trans	-75.8	131.2	177.3	-177.5	0	0	0	0	110.7	G439 Y440 C443 V447 S450	G439-S445 CarbonylContact C-O 3.56Å; G439-S445 WeakPolarHBondContact CA-O 3.46Å; Y440-S445 PolarHBondContact N-O 3.34Å; C443-S445 PolarHBondContact O-N 3.06Å; S445-V447 PolarHBondContact OG-N 3.17Å; S445-S450 PolarHBondContact OG-OG 3.3Å; S445-S450 VanDerWaalsContact OG-OG 3.09Å
446	F	85.4	Confident	82.1	Confident	78 Å²	78	71.4 Å²	71.4	34%	0.342	37%	0.37	S	S	.	.			trans	-94.4	16.1	174.1	-54.1	-72.3	0	0	0	113.3	W429 Y432 K434 K437	W429-F446 WeakPolarHBondContact CH2-O 3.27Å; Y432-F446 AromaticContact CD1-CE1 3.9Å; Y432-F446 HydrophobicContact CD1-CE1 3.9Å; Y432-F446 HydrophobicContact CD1-CZ 4.31Å; Y432-F446 AromaticContact CE1-CE1 3.74Å; Y432-F446 HydrophobicContact CE1-CE1 3.74Å; Y432-F446 AromaticContact CE1-CZ 3.71Å; Y432-F446 HydrophobicContact CE1-CZ 3.71Å; K434-F446 HydrophobicContact CB-CE1 3.94Å; K434-F446 HydrophobicContact CB-CZ 3.78Å; K434-F446 HydrophobicContact CD-CZ 4.41Å; K437-F446 HydrophobicContact CB-CB 4.36Å; K437-F446 HydrophobicContact CB-CD1 3.71Å; K437-F446 HydrophobicContact CB-CE1 4.29Å; K437-F446 HydrophobicContact CB-CG 4.16Å
447	V	82.9	Confident	81.5	Confident	95 Å²	95	69.4 Å²	69.4	58%	0.576	35%	0.349	S	S	*	.	S	Bend	trans	-110.5	118	177.1	-176.7	0	0	0	0	110.2	W429 S445 S450	W429-V447 WeakPolarHBondContact CZ3-O 3.43Å; S445-V447 PolarHBondContact OG-N 3.17Å; V447-S450 PolarHBondContact O-N 3.18Å; V447-S450 PolarHBondContact O-OG 2.87Å; V447-S450 VanDerWaalsContact O-OG 3.06Å
448	K	79.4	Confident	81	Confident	109 Å²	109	66.2 Å²	66.2	47%	0.474	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	136.5	179.2	-162.8	177.6	177.7	-178.2	0	108.4	W429	W429-K448 HydrophobicContact CD2-CB 3.95Å; W429-K448 HydrophobicContact CD2-CD 4.33Å; W429-K448 HydrophobicContact CD2-CG 3.7Å; W429-K448 HydrophobicContact CE3-CB 4.12Å; W429-K448 HydrophobicContact CE3-CG 4.17Å; W429-K448 HydrophobicContact CG-CD 4.28Å; W429-K448 HydrophobicContact CG-CG 3.97Å; W429-K448 VanDerWaalsContact CH2-CA 3.48Å; W429-K448 HydrophobicContact CH2-CB 3.75Å; W429-K448 HydrophobicContact CZ2-CB 3.61Å; W429-K448 HydrophobicContact CZ2-CG 4.2Å; W429-K448 HydrophobicContact CZ3-CB 4.03Å
449	F	81.5	Confident	80.3	Confident	118 Å²	118	65.9 Å²	65.9	52%	0.518	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	10.3	-175.5	-51.9	-80.6	0	0	0	117.5	I422 N423 Y440	I422-F449 HydrophobicContact CD1-CD1 4.32Å; I422-F449 HydrophobicContact CD1-CE1 3.84Å; I422-F449 HydrophobicContact CG2-CD1 3.61Å; I422-F449 HydrophobicContact CG2-CE1 4.01Å; N423-F449 PolarHBondContact ND2-O 3.5Å; Y440-F449 PolarHBondContact OH-N 3.12Å
450	S	80.9	Confident	79.3	Confident	27 Å²	27	70.7 Å²	70.7	19%	0.189	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-63.6	154.5	168.4	60.2	0	0	0	0	111.4	H425 S445 V447	H425-S450 PolarHBondContact CD2-O 2.82Å; H425-S450 VanDerWaalsContact CD2-O 3.31Å; H425-S450 PolarHBondContact NE2-O 3.07Å; S445-S450 PolarHBondContact OG-OG 3.3Å; S445-S450 VanDerWaalsContact OG-OG 3.09Å; V447-S450 PolarHBondContact O-N 3.18Å; V447-S450 PolarHBondContact O-OG 2.87Å; V447-S450 VanDerWaalsContact O-OG 3.06Å
451	Y	81.9	Confident	78.3	Confident	173 Å²	173	72.1 Å²	72.1	68%	0.678	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-73.8	143.8	166.4	-74.4	-82.1	0	0	0	109.7	N423 T453	N423-Y451 HydrophobicContact CB-CD1 3.98Å; N423-Y451 HydrophobicContact CB-CE1 4.18Å; N423-Y451 HydrophobicContact CB-CG 4.47Å; Y451-T453 PolarHBondContact O-N 3.49Å
452	C	82.6	Confident	77.3	Confident	38 Å²	38	71 Å²	71	26%	0.257	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-68.9	123.5	-179.9	-151.4	0	0	0	0	110.8	N423 H425 C442 C443 G454	N423-C452 PolarHBondContact O-N 2.74Å; H425-C452 HydrophobicContact CB-CB 4.48Å; H425-C452 VanDerWaalsContact CE1-CA 3.41Å; H425-C452 WeakPolarHBondContact CE1-CA 3.47Å; H425-C452 WeakPolarHBondContact ND1-CB 3.13Å; H425-C452 PolarHBondContact ND1-SG 2.76Å; H425-C452 PolarHBondContact NE2-N 3.19Å; C442-C452 PolarHBondContact SG-SG 2.86Å; C443-C452 HydrophobicContact CB-CB 4.46Å; C443-C452 WeakPolarHBondContact CB-SG 3.41Å; C443-C452 VanDerWaalsContact SG-C 3.54Å; C443-C452 WeakPolarHBondContact SG-CA 3.35Å; C443-C452 WeakPolarHBondContact SG-CB 3.36Å; C443-C452 CovalentContact SG-SG 2.07Å; C443-C452 PolarHBondContact SG-SG 3.02Å; C452-G454 PolarHBondContact O-N 3.38Å
453	T	77.8	Confident	76.1	Confident	83 Å²	83	74.4 Å²	74.4	51%	0.509	40%	0.396	S	S	.	.			trans	-84.8	11.3	176.8	47.5	0	0	0	0	113.8	C443 Y451 G457	C443-T453 PolarHBondContact SG-N 3.04Å; Y451-T453 PolarHBondContact O-N 3.49Å; T453-G457 PolarHBondContact O-N 3.32Å; T453-G457 WeakPolarHBondContact OG1-CA 3.32Å
454	G	79.4	Confident	75	Confident	34 Å²	34	81.4 Å²	81.4	35%	0.351	43%	0.429	S	S	.	.	H	α-helix	trans	52.9	-147.4	-174.2	0	0	0	0	0	114.3	C443 C452 A456 G457	C443-G454 VanDerWaalsContact SG-CA 3.5Å; C443-G454 PolarHBondContact SG-N 2.47Å; C452-G454 PolarHBondContact O-N 3.38Å; G454-A456 VanDerWaalsContact C-N 3.29Å; G454-A456 PolarHBondContact O-N 3.09Å; G454-G457 PolarHBondContact O-N 2.82Å
455	E	76.3	Confident	73.5	Confident	151 Å²	151	83 Å²	83	71%	0.706	45%	0.449	S	S	*	.	H	α-helix	trans	-67.7	-27.2	178.3	-62.9	-177.8	155	0	0	112.7	G457 K458 E459	E455-G457 PolarHBondContact O-N 3.39Å; E455-K458 WeakPolarHBondContact O-CB 3.42Å; E455-K458 PolarHBondContact O-N 2.94Å; E455-E459 PolarHBondContact O-N 3.05Å
456	A	73.7	Confident	71.7	Confident	56 Å²	56	86.2 Å²	86.2	46%	0.463	47%	0.471	S	S	.	.	H	α-helix	trans	-60.1	-32.3	176.4	0	0	0	0	0	112.7	G454 K458 E459 I460	G454-A456 VanDerWaalsContact C-N 3.29Å; G454-A456 PolarHBondContact O-N 3.09Å; A456-K458 VanDerWaalsContact C-N 3.33Å; A456-K458 PolarHBondContact O-N 3.05Å; A456-E459 PolarHBondContact O-N 3.28Å; A456-I460 WeakPolarHBondContact O-CG1 3.4Å; A456-I460 PolarHBondContact O-N 3.13Å; A456-I460 VanDerWaalsContact O-N 3.16Å
457	G	71.4	Confident	69.2	Low	10 Å²	10	89.9 Å²	89.9	10%	0.103	49%	0.493	C	S	.	.	H	α-helix	trans	-66.3	-32.3	173.8	0	0	0	0	0	113.9	T453 G454 E455 A461	T453-G457 PolarHBondContact O-N 3.32Å; T453-G457 WeakPolarHBondContact OG1-CA 3.32Å; G454-G457 PolarHBondContact O-N 2.82Å; E455-G457 PolarHBondContact O-N 3.39Å; G457-A461 WeakPolarHBondContact O-CB 3.48Å; G457-A461 PolarHBondContact O-N 3.28Å
458	K	75.5	Confident	67.3	Low	68 Å²	68	91 Å²	91	30%	0.296	50%	0.503	S	S	.	.	H	α-helix	trans	-72.2	-38.3	176.5	-68.1	176.5	175.7	160.6	0	111.4	K441 C442 E455 A456 N462	K441-K458 WeakPolarHBondContact O-CE 3.43Å; C442-K458 WeakPolarHBondContact O-CE 3.46Å; C442-K458 PolarHBondContact O-NZ 2.85Å; E455-K458 WeakPolarHBondContact O-CB 3.42Å; E455-K458 PolarHBondContact O-N 2.94Å; A456-K458 VanDerWaalsContact C-N 3.33Å; A456-K458 PolarHBondContact O-N 3.05Å; K458-N462 WeakPolarHBondContact O-CB 3.5Å; K458-N462 PolarHBondContact O-N 2.92Å; K458-N462 PolarHBondContact O-ND2 3.21Å
459	E	71.6	Confident	65	Low	135 Å²	135	95.3 Å²	95.3	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-46.2	177.9	-65.6	-173.9	166.3	0	0	111	E455 A456 A461 N462 T463	E455-E459 PolarHBondContact O-N 3.05Å; A456-E459 PolarHBondContact O-N 3.28Å; E459-A461 PolarHBondContact O-N 2.86Å; E459-N462 PolarHBondContact O-N 2.97Å; E459-N462 VanDerWaalsContact O-N 3.16Å; E459-T463 WeakPolarHBondContact O-CG2 3.49Å; E459-T463 PolarHBondContact O-N 3.37Å; E459-T463 PolarHBondContact O-OG1 2.95Å
460	I	66.8	Low	62.7	Low	101 Å²	101	97.3 Å²	97.3	52%	0.518	54%	0.541	S	S	.	.	H	α-helix	trans	-60.9	-47.1	177.6	-64.2	165.3	0	0	0	111.2	A456 N462 T463 E464	A456-I460 WeakPolarHBondContact O-CG1 3.4Å; A456-I460 PolarHBondContact O-N 3.13Å; A456-I460 VanDerWaalsContact O-N 3.16Å; I460-N462 PolarHBondContact O-N 3.45Å; I460-T463 VanDerWaalsContact CA-OG1 3.3Å; I460-T463 WeakPolarHBondContact CA-OG1 3.49Å; I460-T463 PolarHBondContact O-N 3.35Å; I460-T463 VanDerWaalsContact O-N 3.09Å; I460-T463 PolarHBondContact O-OG1 2.99Å; I460-E464 PolarHBondContact O-N 2.96Å
461	A	65.1	Low	60.5	Low	30 Å²	30	103.2 Å²	103.2	25%	0.248	57%	0.565	C	S	.	*	H	α-helix	trans	-65.1	-25.6	178.6	0	0	0	0	0	113.6	G457 E459	G457-A461 WeakPolarHBondContact O-CB 3.48Å; G457-A461 PolarHBondContact O-N 3.28Å; E459-A461 PolarHBondContact O-N 2.86Å
462	N	63.1	Low	58.4	Low	100 Å²	100	100.7 Å²	100.7	54%	0.535	57%	0.57	S	S	.	*	H	α-helix	trans	-79.8	-35.8	172.1	-74.5	-18.4	0	0	0	111.7	K458 E459 I460 A465	K458-N462 WeakPolarHBondContact O-CB 3.5Å; K458-N462 PolarHBondContact O-N 2.92Å; K458-N462 PolarHBondContact O-ND2 3.21Å; E459-N462 PolarHBondContact O-N 2.97Å; E459-N462 VanDerWaalsContact O-N 3.16Å; I460-N462 PolarHBondContact O-N 3.45Å; N462-A465 WeakPolarHBondContact O-CB 3.22Å; N462-A465 PolarHBondContact O-N 3.4Å
463	T	57.6	Low	55.9	Low	87 Å²	87	108.3 Å²	108.3	53%	0.534	59%	0.594	S	S	.	*	H	α-helix	trans	-72.4	-35.2	177.7	54.9	0	0	0	0	113.5	E459 I460 A465 S466	E459-T463 WeakPolarHBondContact O-CG2 3.49Å; E459-T463 PolarHBondContact O-N 3.37Å; E459-T463 PolarHBondContact O-OG1 2.95Å; I460-T463 VanDerWaalsContact CA-OG1 3.3Å; I460-T463 WeakPolarHBondContact CA-OG1 3.49Å; I460-T463 PolarHBondContact O-N 3.35Å; I460-T463 VanDerWaalsContact O-N 3.09Å; I460-T463 PolarHBondContact O-OG1 2.99Å; T463-A465 PolarHBondContact O-N 3.31Å; T463-S466 PolarHBondContact O-N 3.5Å
464	E	56.4	Low	53.5	Low	148 Å²	148	110.5 Å²	110.5	69%	0.692	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-63.8	-20.6	172.9	-78.2	-175.7	161	0	0	112.5	I460 S466	I460-E464 PolarHBondContact O-N 2.96Å; E464-S466 VanDerWaalsContact C-N 3.28Å; E464-S466 PolarHBondContact O-N 2.95Å
465	A	53.4	Low	51.1	Low	73 Å²	73	116.2 Å²	116.2	60%	0.603	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-81.9	0.4	173.7	0	0	0	0	0	113.9	N462 T463	N462-A465 WeakPolarHBondContact O-CB 3.22Å; N462-A465 PolarHBondContact O-N 3.4Å; T463-A465 PolarHBondContact O-N 3.31Å
466	S	42.9	Very low	49.2	Very low	96 Å²	96	115.6 Å²	115.6	67%	0.671	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-125.4	19.4	-174.3	-74.4	0	0	0	0	115.2	T463 E464 P468	T463-S466 PolarHBondContact O-N 3.5Å; E464-S466 VanDerWaalsContact C-N 3.28Å; E464-S466 PolarHBondContact O-N 2.95Å; S466-P468 WeakPolarHBondContact O-CD 3.31Å
467	L	33.1	Very low	47	Very low	155 Å²	155	121.3 Å²	121.3	81%	0.812	63%	0.634	S	S	*	*			trans	-102.1	114.6	169	-76.4	166.6	0	0	0	111.1
468	P	42.5	Very low	45.6	Very low	119 Å²	119	128 Å²	128	77%	0.773	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-91.5	138.4	172.1	28	-17.9	0	0	0	111.6	S466	S466-P468 WeakPolarHBondContact O-CD 3.31Å
469	E	32.1	Very low	43.9	Very low	199 Å²	199	130.6 Å²	130.6	93%	0.93	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-91.8	148.2	172	-153.1	161.4	-165.4	0	0	110.4
470	D	31.6	Very low	42.3	Very low	160 Å²	160	132.7 Å²	132.7	86%	0.856	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-62.3	157.8	-148.7	-84.9	-49.4	0	0	0	120.6
471	Q	35.7	Very low	41.4	Very low	151 Å²	151	133.8 Å²	133.8	71%	0.706	71%	0.709	S	S	*	*			trans	-79.7	-175.4	-175.1	-51.4	174	-13.9	0	0	115.1
472	P	38.5	Very low	40.9	Very low	121 Å²	121	139.4 Å²	139.4	79%	0.786	73%	0.727	S	S	*	*				-127.4	135.1	73.2	7	17.2	0	0	0	114.2
473	R	29	Very low	40.6	Very low	198 Å²	198	138.8 Å²	138.8	75%	0.747	73%	0.728	S	S	*	*				68.4	130.4	95.3	-74.1	-164.5	-162	178	4.2	114.2
474	D	27.9	Very low	40.3	Very low	129 Å²	129	141.9 Å²	141.9	69%	0.69	74%	0.74	S	S	*	*			cis	-156.8	132	14	-80.2	-37.5	0	0	0	106.4
475	E	28.5	Very low	40.3	Very low	154 Å²	154	142 Å²	142	72%	0.72	74%	0.743	S	S	*	*				105.9	119.6	101	-80.9	-94.9	138.4	0	0	113.5
476	E	36.2	Very low	40.8	Very low	137 Å²	137	143.5 Å²	143.5	64%	0.64	74%	0.737	S	S	*	*			trans	46.3	118.5	147.2	-54.3	-165.8	158.9	0	0	121.2
477	H	28.4	Very low	41.8	Very low	177 Å²	177	142.4 Å²	142.4	82%	0.819	72%	0.723	S	S	*	*				177.7	148.6	110.3	-91.3	-62.3	0	0	0	112.6
478	L	42.6	Very low	43.3	Very low	151 Å²	151	140.4 Å²	140.4	79%	0.791	71%	0.709	S	S	*	*			trans	-53.1	161.9	173.8	-74.8	118.9	0	0	0	115.2
479	T	38.7	Very low	44.3	Very low	122 Å²	122	140.8 Å²	140.8	75%	0.748	70%	0.701	S	S	*	*			trans	85.3	137.3	166.7	80.3	0	0	0	0	114.1
480	K	38.4	Very low	45.8	Very low	179 Å²	179	136.9 Å²	136.9	78%	0.778	68%	0.682	S	S	*	*			cis	-158.4	164.6	36.7	-72.4	172	-177.7	165.4	0	109.8	K482	K480-K482 PolarHBondContact O-N 3.46Å
481	P	48.1	Very low	47.3	Very low	124 Å²	124	136.1 Å²	136.1	81%	0.805	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-59.5	136.5	170.9	25.2	-34	0	0	0	111.8
482	K	53.3	Low	48.1	Very low	147 Å²	147	134.6 Å²	134.6	64%	0.639	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-58	140.8	-177.6	-65.5	179.8	178.2	-177.9	0	111.7	K480	K480-K482 PolarHBondContact O-N 3.46Å
483	T	57.3	Low	48.7	Very low	88 Å²	88	136 Å²	136	54%	0.54	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-81.3	151.5	-179	59.2	0	0	0	0	111.6	M485 E486	T483-M485 PolarHBondContact O-N 3.34Å; T483-E486 PolarHBondContact O-N 3.43Å
484	L	52.3	Low	49.8	Very low	151 Å²	151	131.9 Å²	131.9	79%	0.791	65%	0.651	S	S	*	*	H	α-helix	trans	-54.9	-22.2	-176.3	-117.1	155	0	0	0	114.3	H488	L484-H488 PolarHBondContact O-N 2.96Å
485	M	56	Low	50.9	Low	152 Å²	152	134 Å²	134	75%	0.749	65%	0.654	S	S	*	*	H	α-helix	trans	-72.6	-36.1	176.8	-72.7	-170.9	-178	0	0	113.2	T483 H488 Q489	T483-M485 PolarHBondContact O-N 3.34Å; M485-H488 PolarHBondContact O-N 3.44Å; M485-Q489 WeakPolarHBondContact O-CG 3.31Å; M485-Q489 PolarHBondContact O-N 2.91Å; M485-Q489 VanDerWaalsContact O-N 3.12Å
486	E	62.6	Low	51.6	Low	104 Å²	104	135 Å²	135	49%	0.486	66%	0.656	S	S	.	*	H	α-helix	trans	-71	-38.9	179.3	-69.3	176.6	148.1	0	0	111	T483 H488 Q489 E490	T483-E486 PolarHBondContact O-N 3.43Å; E486-H488 VanDerWaalsContact C-N 3.28Å; E486-H488 PolarHBondContact O-N 3.49Å; E486-Q489 PolarHBondContact O-N 2.98Å; E486-E490 PolarHBondContact O-N 2.91Å; E486-E490 VanDerWaalsContact O-N 3.13Å
487	I	65.7	Low	52	Low	73 Å²	73	137 Å²	137	37%	0.374	66%	0.662	S	S	.	*	H	α-helix	trans	-65.7	-32.5	176	-58.7	171.8	0	0	0	111	K491	I487-K491 WeakPolarHBondContact O-CG 3.43Å; I487-K491 PolarHBondContact O-N 3.45Å
488	H	63.5	Low	52.6	Low	113 Å²	113	138.1 Å²	138.1	52%	0.523	67%	0.665	S	S	.	*	H	α-helix	trans	-74.2	-37.7	177.1	-167.1	74.8	0	0	0	112.4	L484 M485 E486 K491 Q492	L484-H488 PolarHBondContact O-N 2.96Å; M485-H488 PolarHBondContact O-N 3.44Å; E486-H488 VanDerWaalsContact C-N 3.28Å; E486-H488 PolarHBondContact O-N 3.49Å; H488-K491 PolarHBondContact O-N 2.95Å; H488-Q492 PolarHBondContact CD2-NE2 2.89Å; H488-Q492 PolarHBondContact NE2-NE2 2.99Å; H488-Q492 PolarHBondContact O-N 3.5Å; H488-Q492 VanDerWaalsContact O-N 3.13Å
489	Q	64.7	Low	52.4	Low	127 Å²	127	139.6 Å²	139.6	59%	0.593	67%	0.665	S	S	*	*	H	α-helix	trans	-67.7	-34.9	176.9	-74.7	-178.1	7.2	0	0	112.7	M485 E486 Q492 K493	M485-Q489 WeakPolarHBondContact O-CG 3.31Å; M485-Q489 PolarHBondContact O-N 2.91Å; M485-Q489 VanDerWaalsContact O-N 3.12Å; E486-Q489 PolarHBondContact O-N 2.98Å; Q489-Q492 PolarHBondContact O-N 3.39Å; Q489-K493 PolarHBondContact O-N 3.3Å
490	E	62.8	Low	52.3	Low	117 Å²	117	142 Å²	142	55%	0.547	67%	0.667	S	S	.	*	H	α-helix	trans	-67.2	-43	173.3	-77.9	-177.8	156.8	0	0	111.9	E486 Q492 K493 D494	E486-E490 PolarHBondContact O-N 2.91Å; E486-E490 VanDerWaalsContact O-N 3.13Å; E490-Q492 VanDerWaalsContact C-N 3.28Å; E490-Q492 PolarHBondContact O-N 3.37Å; E490-K493 PolarHBondContact O-N 3.35Å; E490-K493 VanDerWaalsContact O-N 3.1Å; E490-D494 PolarHBondContact O-N 2.78Å
491	K	62.7	Low	52.1	Low	143 Å²	143	143.1 Å²	143.1	62%	0.622	67%	0.672	S	S	*	*	H	α-helix	trans	-65.4	-27.4	176.9	-74.8	-176.5	178.7	179.8	0	113.7	I487 H488 K495	I487-K491 WeakPolarHBondContact O-CG 3.43Å; I487-K491 PolarHBondContact O-N 3.45Å; H488-K491 PolarHBondContact O-N 2.95Å; K491-K495 PolarHBondContact O-N 2.89Å
492	Q	52.8	Low	51.3	Low	120 Å²	120	147 Å²	147	56%	0.561	68%	0.676	S	S	*	*	H	α-helix	trans	-75	-31.2	173.1	-73.3	-160	17.6	0	0	112.9	H488 Q489 E490 K496	H488-Q492 PolarHBondContact CD2-NE2 2.89Å; H488-Q492 PolarHBondContact NE2-NE2 2.99Å; H488-Q492 PolarHBondContact O-N 3.5Å; H488-Q492 VanDerWaalsContact O-N 3.13Å; Q489-Q492 PolarHBondContact O-N 3.39Å; E490-Q492 VanDerWaalsContact C-N 3.28Å; E490-Q492 PolarHBondContact O-N 3.37Å; Q492-K496 PolarHBondContact O-N 3.08Å
493	K	51.9	Low	50.2	Low	149 Å²	149	144.9 Å²	144.9	65%	0.648	68%	0.68	S	S	*	*	H	α-helix	trans	-71.2	-36.3	176.5	-75.7	177.6	178.3	175.4	0	112.2	Q489 E490 K496 K497	Q489-K493 PolarHBondContact O-N 3.3Å; E490-K493 PolarHBondContact O-N 3.35Å; E490-K493 VanDerWaalsContact O-N 3.1Å; K493-K496 PolarHBondContact O-N 2.65Å; K493-K497 PolarHBondContact O-N 3.3Å
494	D	51.1	Low	48.8	Very low	112 Å²	112	146.2 Å²	146.2	60%	0.599	69%	0.693	S	S	*	*	H	α-helix	trans	-72.6	-30.9	178	-77.1	-22.3	0	0	0	113.7	E490 K496 K497	E490-D494 PolarHBondContact O-N 2.78Å; D494-K496 VanDerWaalsContact C-N 3.31Å; D494-K496 PolarHBondContact O-N 3.23Å; D494-K497 PolarHBondContact O-N 3.47Å
495	K	50.4	Low	47.6	Very low	175 Å²	175	146.7 Å²	146.7	76%	0.761	70%	0.696	S	S	*	*	H	α-helix	trans	-67.2	-29.3	171.9	-81.1	-173.8	174.3	-175.6	0	113	K491	K491-K495 PolarHBondContact O-N 2.89Å
496	K	44.5	Very low	46.8	Very low	175 Å²	175	144.4 Å²	144.4	76%	0.761	70%	0.695	S	S	*	*	H	α-helix	trans	-73.1	-28	176.4	-91.6	-178.6	173.4	178	0	113.3	Q492 K493 D494	Q492-K496 PolarHBondContact O-N 3.08Å; K493-K496 PolarHBondContact O-N 2.65Å; D494-K496 VanDerWaalsContact C-N 3.31Å; D494-K496 PolarHBondContact O-N 3.23Å
497	K	44	Very low	45.8	Very low	178 Å²	178	146 Å²	146	77%	0.774	71%	0.707	S	S	*	*	H	α-helix	trans	-79	-22.2	-179.5	-82.4	-177.9	175.5	176.9	0	114.7	K493 D494 K499	K493-K497 PolarHBondContact O-N 3.3Å; D494-K497 PolarHBondContact O-N 3.47Å; K497-K499 PolarHBondContact O-N 3.34Å
498	K	41.7	Very low	45.1	Very low	200 Å²	200	147.2 Å²	147.2	87%	0.87	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-3.4	-179.5	-96.5	-176.9	176.3	178.3	0	115.7
499	K	37.7	Very low	44.5	Very low	183 Å²	183	148.2 Å²	148.2	80%	0.796	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-1.5	-176.4	-118.2	178.1	-177.6	174.4	0	116	K497	K497-K499 PolarHBondContact O-N 3.34Å
500	H	37.2	Very low	43.9	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.796	71%	0.714	S	S	*	*			trans	-108.9	81	178.7	-84.5	-73.4	0	0	0	112.6
501	K	33.9	Very low	43.7	Very low	202 Å²	202	143.4 Å²	143.4	88%	0.878	71%	0.713	S	S	*	*			trans	-176.9	88.2	143.8	-108	175.1	179.3	177.5	0	111.5
502	K	30.7	Very low	43.7	Very low	206 Å²	206	142.8 Å²	142.8	90%	0.896	71%	0.712	S	S	*	*	S	Bend	trans	-179	107.4	133.9	-102.6	175.7	178.5	179.4	0	111
503	S	31.3	Very low	44.5	Very low	103 Å²	103	143 Å²	143	72%	0.72	71%	0.711	S	S	*	*			trans	34.8	112.5	143.7	60.2	0	0	0	0	118.2
504	S	28.1	Very low	45.5	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	71%	0.708	S	S	*	*				111.5	109.5	67.5	72.3	0	0	0	0	110.4
505	N	26.9	Very low	46.7	Very low	161 Å²	161	141.6 Å²	141.6	86%	0.861	70%	0.7	S	S	*	*			trans	130.7	112.5	133.1	-134.7	15.7	0	0	0	114.1
506	S	39.6	Very low	48	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	69%	0.69	S	S	*	*	S	Bend	trans	36.7	84.9	153.3	-170.9	0	0	0	0	120
507	D	41.7	Very low	49.8	Very low	136 Å²	136	137.2 Å²	137.2	73%	0.727	69%	0.685	S	S	*	*			trans	179.7	80.7	132.3	-116.7	-33.4	0	0	0	111.2
508	S	50.9	Low	51.7	Low	99 Å²	99	134.4 Å²	134.4	69%	0.692	67%	0.673	S	S	*	*	H	α-helix	trans	-85.5	-16	-169.9	-172.2	0	0	0	0	114.9
509	E	49.5	Very low	53.8	Low	134 Å²	134	127.1 Å²	127.1	63%	0.626	64%	0.643	S	S	*	*	H	α-helix	trans	-88.1	-25.7	-175.5	-79.8	-98.1	156.5	0	0	113.1	K513	E509-K513 WeakPolarHBondContact O-CD 3.47Å; E509-K513 WeakPolarHBondContact O-CG 3.39Å; E509-K513 IonicContact OE2-NZ 2.73Å; E509-K513 PolarHBondContact OE2-NZ 2.9Å
510	G	53.4	Low	56.1	Low	32 Å²	32	124.8 Å²	124.8	33%	0.33	63%	0.633	S	S	.	*	H	α-helix	trans	-81.7	-32.1	-178.5	0	0	0	0	0	114.1	K514	G510-K514 WeakPolarHBondContact O-CB 3.34Å; G510-K514 VanDerWaalsContact O-CG 3.29Å; G510-K514 WeakPolarHBondContact O-CG 3.17Å; G510-K514 PolarHBondContact O-N 3.41Å; G510-K514 VanDerWaalsContact O-N 3.15Å
511	E	57.5	Low	58.6	Low	111 Å²	111	124.4 Å²	124.4	52%	0.519	63%	0.629	S	S	.	*	H	α-helix	trans	-68.8	-41.3	-179.9	-88.7	-96	142.1	0	0	112.8	K515	E511-K515 WeakPolarHBondContact O-CG 3.48Å; E511-K515 PolarHBondContact O-N 3.36Å; E511-K515 VanDerWaalsContact O-N 3.13Å; E511-K515 IonicContact OE2-NZ 3.32Å; E511-K515 PolarHBondContact OE2-NZ 2.94Å; E511-K515 VanDerWaalsContact OE2-NZ 3.09Å
512	E	63	Low	61.1	Low	130 Å²	130	115.3 Å²	115.3	61%	0.607	59%	0.591	S	S	*	*	H	α-helix	trans	-70.6	-39.9	178	-78.9	-170	156.8	0	0	112.3	K514 K515 Q516	E512-K514 VanDerWaalsContact C-N 3.34Å; E512-K514 PolarHBondContact O-N 3.12Å; E512-K515 PolarHBondContact O-N 2.86Å; E512-Q516 WeakPolarHBondContact O-CG 3.33Å; E512-Q516 PolarHBondContact O-N 3.36Å
513	K	69.8	Low	63.7	Low	124 Å²	124	107.5 Å²	107.5	54%	0.539	56%	0.56	S	S	.	*	H	α-helix	trans	-62	-41.9	175.3	-71.1	172.6	-170.5	156.9	0	111.3	E509 Q516 E517	E509-K513 WeakPolarHBondContact O-CD 3.47Å; E509-K513 WeakPolarHBondContact O-CG 3.39Å; E509-K513 IonicContact OE2-NZ 2.73Å; E509-K513 PolarHBondContact OE2-NZ 2.9Å; K513-Q516 PolarHBondContact O-N 3.21Å; K513-E517 WeakPolarHBondContact O-CB 3.5Å; K513-E517 PolarHBondContact O-N 3.39Å
514	K	72.6	Confident	66.4	Low	131 Å²	131	107.8 Å²	107.8	57%	0.57	55%	0.553	S	S	*	*	H	α-helix	trans	-63.4	-40.7	175.2	-76.2	174.8	-177.6	176.9	0	112.7	G510 E512 E517 K518	G510-K514 WeakPolarHBondContact O-CB 3.34Å; G510-K514 VanDerWaalsContact O-CG 3.29Å; G510-K514 WeakPolarHBondContact O-CG 3.17Å; G510-K514 PolarHBondContact O-N 3.41Å; G510-K514 VanDerWaalsContact O-N 3.15Å; E512-K514 VanDerWaalsContact C-N 3.34Å; E512-K514 PolarHBondContact O-N 3.12Å; K514-E517 PolarHBondContact O-N 2.97Å; K514-K518 VanDerWaalsContact O-CG 3.25Å; K514-K518 WeakPolarHBondContact O-CG 3.41Å; K514-K518 PolarHBondContact O-N 3.36Å
515	K	75.8	Confident	69.2	Low	102 Å²	102	105.2 Å²	105.2	44%	0.443	54%	0.538	S	S	.	.	H	α-helix	trans	-66.7	-41.4	175.9	-74.7	172.6	-173	153.2	0	112.1	E511 E512 K518 L519	E511-K515 WeakPolarHBondContact O-CG 3.48Å; E511-K515 PolarHBondContact O-N 3.36Å; E511-K515 VanDerWaalsContact O-N 3.13Å; E511-K515 IonicContact OE2-NZ 3.32Å; E511-K515 PolarHBondContact OE2-NZ 2.94Å; E511-K515 VanDerWaalsContact OE2-NZ 3.09Å; E512-K515 PolarHBondContact O-N 2.86Å; K515-K518 PolarHBondContact O-N 3.11Å; K515-L519 WeakPolarHBondContact O-CB 3.4Å; K515-L519 PolarHBondContact O-N 3.1Å
516	Q	77.4	Confident	71.9	Confident	118 Å²	118	98.9 Å²	98.9	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-64.7	-38.4	174.7	-73.3	-177.9	3.7	0	0	112.4	E512 K513 K520	E512-Q516 WeakPolarHBondContact O-CG 3.33Å; E512-Q516 PolarHBondContact O-N 3.36Å; K513-Q516 PolarHBondContact O-N 3.21Å; Q516-K520 WeakPolarHBondContact O-CB 3.37Å; Q516-K520 VanDerWaalsContact O-CG 3.31Å; Q516-K520 WeakPolarHBondContact O-CG 3.48Å; Q516-K520 PolarHBondContact O-N 3.2Å
517	E	83.5	Confident	74	Confident	140 Å²	140	98 Å²	98	65%	0.654	49%	0.488	S	S	*	.	H	α-helix	trans	-67	-43.2	176.9	-168.9	-179.9	176.6	0	0	111.8	K513 K514 K520 K521	K513-E517 WeakPolarHBondContact O-CB 3.5Å; K513-E517 PolarHBondContact O-N 3.39Å; K514-E517 PolarHBondContact O-N 2.97Å; E517-K520 PolarHBondContact O-N 3.04Å; E517-K521 WeakPolarHBondContact O-CB 3.25Å; E517-K521 PolarHBondContact O-N 2.71Å
518	K	84.4	Confident	76.2	Confident	118 Å²	118	94.3 Å²	94.3	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-66.2	-40	175.3	-68	173.7	-179.8	-175.3	0	112.7	K514 K515 K521 A522 E558	K514-K518 VanDerWaalsContact O-CG 3.25Å; K514-K518 WeakPolarHBondContact O-CG 3.41Å; K514-K518 PolarHBondContact O-N 3.36Å; K515-K518 PolarHBondContact O-N 3.11Å; K518-K521 WeakPolarHBondContact O-CB 3.29Å; K518-K521 PolarHBondContact O-N 2.8Å; K518-A522 WeakPolarHBondContact O-CB 3.49Å; K518-A522 PolarHBondContact O-N 3.29Å; K518-E558 VanDerWaalsContact CB-CD 3.47Å; K518-E558 WeakPolarHBondContact CB-OE2 3.38Å; K518-E558 WeakPolarHBondContact CD-OE1 3.27Å; K518-E558 WeakPolarHBondContact CD-OE2 3.26Å
519	L	84.9	Confident	77.7	Confident	47 Å²	47	96 Å²	96	25%	0.246	47%	0.468	C	S	.	.	H	α-helix	trans	-63.3	-41	173.9	-176.1	67	0	0	0	111.7	K515 K521 A522 L523 E561	K515-L519 WeakPolarHBondContact O-CB 3.4Å; K515-L519 PolarHBondContact O-N 3.1Å; L519-K521 VanDerWaalsContact C-N 3.34Å; L519-K521 PolarHBondContact O-N 3.09Å; L519-A522 PolarHBondContact O-N 3.04Å; L519-L523 HydrophobicContact CG-CD1 4.41Å; L519-L523 WeakPolarHBondContact O-CB 3.48Å; L519-L523 WeakPolarHBondContact O-CG 3.38Å; L519-L523 PolarHBondContact O-N 3.11Å; L519-E561 HydrophobicContact CD1-CB 4.16Å; L519-E561 HydrophobicContact CD1-CG 4.18Å
520	K	86.9	Confident	79.4	Confident	135 Å²	135	93 Å²	93	59%	0.587	46%	0.455	S	S	*	.	H	α-helix	trans	-62.3	-40.8	173.1	-76.9	176.4	-178	179.8	0	111.9	Q516 E517 L523 N524	Q516-K520 WeakPolarHBondContact O-CB 3.37Å; Q516-K520 VanDerWaalsContact O-CG 3.31Å; Q516-K520 WeakPolarHBondContact O-CG 3.48Å; Q516-K520 PolarHBondContact O-N 3.2Å; E517-K520 PolarHBondContact O-N 3.04Å; K520-L523 PolarHBondContact O-N 3.43Å; K520-N524 PolarHBondContact O-N 3.35Å
521	K	88.7	Confident	80.9	Confident	163 Å²	163	96.6 Å²	96.6	71%	0.709	47%	0.467	S	S	*	.	H	α-helix	trans	-63.5	-42.3	175.2	-170.9	176.9	179.2	179.3	0	111.7	E517 K518 L519 N524 A525	E517-K521 WeakPolarHBondContact O-CB 3.25Å; E517-K521 PolarHBondContact O-N 2.71Å; K518-K521 WeakPolarHBondContact O-CB 3.29Å; K518-K521 PolarHBondContact O-N 2.8Å; L519-K521 VanDerWaalsContact C-N 3.34Å; L519-K521 PolarHBondContact O-N 3.09Å; K521-N524 PolarHBondContact O-N 3.06Å; K521-A525 WeakPolarHBondContact O-CB 3.34Å; K521-A525 PolarHBondContact O-N 2.99Å
522	A	86.4	Confident	82.1	Confident	11 Å²	11	96.5 Å²	96.5	9%	0.091	47%	0.466	C	S	.	.	H	α-helix	trans	-65.6	-40	175.6	0	0	0	0	0	112.4	K518 L519 A525 E526 E559 A562	K518-A522 WeakPolarHBondContact O-CB 3.49Å; K518-A522 PolarHBondContact O-N 3.29Å; L519-A522 PolarHBondContact O-N 3.04Å; A522-A525 PolarHBondContact O-N 3.47Å; A522-E526 PolarHBondContact O-N 3.36Å; A522-E559 HydrophobicContact CB-CG 4.23Å; A522-A562 HydrophobicContact CB-CB 3.91Å
523	L	86.4	Confident	83	Confident	43 Å²	43	93.4 Å²	93.4	23%	0.225	46%	0.456	C	S	.	.	H	α-helix	trans	-63.3	-44	174.8	-78.3	170.5	0	0	0	112.4	L519 K520 A525 E526 E527 A562 M565 K566	L519-L523 HydrophobicContact CG-CD1 4.41Å; L519-L523 WeakPolarHBondContact O-CB 3.48Å; L519-L523 WeakPolarHBondContact O-CG 3.38Å; L519-L523 PolarHBondContact O-N 3.11Å; K520-L523 PolarHBondContact O-N 3.43Å; L523-A525 VanDerWaalsContact C-N 3.34Å; L523-E526 PolarHBondContact O-N 2.89Å; L523-E527 WeakPolarHBondContact O-CB 3.35Å; L523-E527 PolarHBondContact O-N 2.93Å; L523-A562 HydrophobicContact CD2-CB 3.83Å; L523-A562 HydrophobicContact CG-CB 4.05Å; L523-M565 HydrophobicContact CD2-CB 4.35Å; L523-K566 HydrophobicContact CD2-CG 4.14Å
524	N	87.2	Confident	83.6	Confident	108 Å²	108	93.5 Å²	93.5	58%	0.578	46%	0.456	S	S	*	.	H	α-helix	trans	-66.2	-37.3	176.5	-72.2	-9.6	0	0	0	111.9	K520 K521 E527 A528	K520-N524 PolarHBondContact O-N 3.35Å; K521-N524 PolarHBondContact O-N 3.06Å; N524-E527 PolarHBondContact O-N 3.04Å; N524-A528 WeakPolarHBondContact O-CB 3.35Å; N524-A528 PolarHBondContact O-N 2.65Å
525	A	86.7	Confident	84.2	Confident	61 Å²	61	93.3 Å²	93.3	50%	0.504	46%	0.457	S	S	.	.	H	α-helix	trans	-66.2	-42.4	176.5	0	0	0	0	0	112.1	K521 A522 L523 A528 R529	K521-A525 WeakPolarHBondContact O-CB 3.34Å; K521-A525 PolarHBondContact O-N 2.99Å; A522-A525 PolarHBondContact O-N 3.47Å; L523-A525 VanDerWaalsContact C-N 3.34Å; A525-A528 PolarHBondContact O-N 3.15Å; A525-R529 WeakPolarHBondContact O-CB 3.38Å; A525-R529 PolarHBondContact O-N 2.93Å
526	E	83.6	Confident	84.4	Confident	28 Å²	28	90.2 Å²	90.2	13%	0.131	45%	0.446	C	S	.	.	H	α-helix	trans	-70.1	-34.5	177.4	-166.4	60.4	-161.4	0	0	111.7	A522 L523 R529 L530 Y563	A522-E526 PolarHBondContact O-N 3.36Å; L523-E526 PolarHBondContact O-N 2.89Å; E526-R529 WeakPolarHBondContact O-CB 3.36Å; E526-R529 PolarHBondContact O-N 3.35Å; E526-R529 IonicContact OE1-CZ 2.71Å; E526-R529 IonicContact OE1-NH1 2.69Å; E526-R529 PolarHBondContact OE1-NH1 3.46Å; E526-R529 VanDerWaalsContact OE1-NH1 3.08Å; E526-R529 WeakPolarHBondContact OE2-CD 3.41Å; E526-R529 IonicContact OE2-NH1 2.82Å; E526-R529 PolarHBondContact OE2-NH1 3Å; E526-L530 WeakPolarHBondContact O-CG 3.47Å; E526-L530 PolarHBondContact O-N 3.48Å; E526-Y563 WeakPolarHBondContact OE1-CD2 3.43Å
527	E	84.8	Confident	84.4	Confident	86 Å²	86	90.6 Å²	90.6	40%	0.402	45%	0.449	S	S	.	.	H	α-helix	trans	-66.1	-42.6	173.3	-175.6	152.8	-151.4	0	0	112.4	L523 N524 R529 L530 L531 K566	L523-E527 WeakPolarHBondContact O-CB 3.35Å; L523-E527 PolarHBondContact O-N 2.93Å; N524-E527 PolarHBondContact O-N 3.04Å; E527-R529 VanDerWaalsContact C-N 3.32Å; E527-R529 PolarHBondContact O-N 2.91Å; E527-L530 PolarHBondContact O-N 2.91Å; E527-L531 WeakPolarHBondContact O-CG 3.16Å; E527-L531 PolarHBondContact O-N 2.92Å; E527-K566 IonicContact OE1-NZ 3.7Å; E527-K566 PolarHBondContact OE1-NZ 2.81Å; E527-K566 IonicContact OE2-NZ 2.75Å; E527-K566 PolarHBondContact OE2-NZ 3.07Å
528	A	86.3	Confident	84.3	Confident	59 Å²	59	91.9 Å²	91.9	49%	0.488	46%	0.455	S	S	.	.	H	α-helix	trans	-62.2	-39.4	172.4	0	0	0	0	0	112	N524 A525 L531 H532	N524-A528 WeakPolarHBondContact O-CB 3.35Å; N524-A528 PolarHBondContact O-N 2.65Å; A525-A528 PolarHBondContact O-N 3.15Å; A528-L531 PolarHBondContact O-N 3.42Å; A528-H532 WeakPolarHBondContact O-CB 3.43Å; A528-H532 PolarHBondContact O-N 2.96Å
529	R	83.9	Confident	84.2	Confident	134 Å²	134	90.1 Å²	90.1	51%	0.506	45%	0.451	S	S	.	.	H	α-helix	trans	-62.7	-44.8	174.6	-174.5	-170.1	176	-160	4	111.7	A525 E526 E527 L531 H532 V533	A525-R529 WeakPolarHBondContact O-CB 3.38Å; A525-R529 PolarHBondContact O-N 2.93Å; E526-R529 WeakPolarHBondContact O-CB 3.36Å; E526-R529 PolarHBondContact O-N 3.35Å; E526-R529 IonicContact OE1-CZ 2.71Å; E526-R529 IonicContact OE1-NH1 2.69Å; E526-R529 PolarHBondContact OE1-NH1 3.46Å; E526-R529 VanDerWaalsContact OE1-NH1 3.08Å; E526-R529 WeakPolarHBondContact OE2-CD 3.41Å; E526-R529 IonicContact OE2-NH1 2.82Å; E526-R529 PolarHBondContact OE2-NH1 3Å; E527-R529 VanDerWaalsContact C-N 3.32Å; E527-R529 PolarHBondContact O-N 2.91Å; R529-L531 VanDerWaalsContact C-N 3.34Å; R529-L531 PolarHBondContact O-N 3.2Å; R529-H532 PolarHBondContact O-N 3.35Å; R529-V533 VanDerWaalsContact O-CG2 3.27Å; R529-V533 WeakPolarHBondContact O-CG2 3.44Å; R529-V533 PolarHBondContact O-N 2.87Å
530	L	84.1	Confident	83.8	Confident	71 Å²	71	93.6 Å²	93.6	37%	0.372	47%	0.469	S	S	.	.	H	α-helix	trans	-64.4	-37.7	177.3	-74.1	172.8	0	0	0	112.2	E526 E527 V533 K534 K566	E526-L530 WeakPolarHBondContact O-CG 3.47Å; E526-L530 PolarHBondContact O-N 3.48Å; E527-L530 PolarHBondContact O-N 2.91Å; L530-V533 PolarHBondContact O-N 3.29Å; L530-K534 WeakPolarHBondContact O-CG 3.34Å; L530-K534 PolarHBondContact O-N 2.86Å; L530-K566 HydrophobicContact CD1-CB 4.22Å
531	L	85.5	Confident	83.1	Confident	108 Å²	108	95 Å²	95	57%	0.565	48%	0.478	S	S	*	.	H	α-helix	trans	-65	-45.7	173.9	-72.2	171.4	0	0	0	111.7	E527 A528 R529 V533 K534 E535	E527-L531 WeakPolarHBondContact O-CG 3.16Å; E527-L531 PolarHBondContact O-N 2.92Å; A528-L531 PolarHBondContact O-N 3.42Å; R529-L531 VanDerWaalsContact C-N 3.34Å; R529-L531 PolarHBondContact O-N 3.2Å; L531-V533 VanDerWaalsContact C-N 3.33Å; L531-V533 PolarHBondContact O-N 3.33Å; L531-K534 WeakPolarHBondContact O-CB 3.48Å; L531-K534 PolarHBondContact O-N 2.99Å; L531-E535 WeakPolarHBondContact O-CB 3.35Å; L531-E535 PolarHBondContact O-N 3.42Å
532	H	82.4	Confident	82.5	Confident	110 Å²	110	99.1 Å²	99.1	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-38.9	176.4	-177	-115.7	0	0	0	112.3	A528 R529 E535 I536	A528-H532 WeakPolarHBondContact O-CB 3.43Å; A528-H532 PolarHBondContact O-N 2.96Å; R529-H532 PolarHBondContact O-N 3.35Å; H532-E535 PolarHBondContact O-N 3.41Å; H532-I536 WeakPolarHBondContact CE1-CD1 3.05Å; H532-I536 WeakPolarHBondContact O-CG1 3.37Å; H532-I536 PolarHBondContact O-N 3.34Å
533	V	81.3	Confident	82	Confident	65 Å²	65	106.2 Å²	106.2	39%	0.394	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-43.4	173.3	170.1	0	0	0	0	111	R529 L530 L531 E535 I536 M537	R529-V533 VanDerWaalsContact O-CG2 3.27Å; R529-V533 WeakPolarHBondContact O-CG2 3.44Å; R529-V533 PolarHBondContact O-N 2.87Å; L530-V533 PolarHBondContact O-N 3.29Å; L531-V533 VanDerWaalsContact C-N 3.33Å; L531-V533 PolarHBondContact O-N 3.33Å; V533-E535 VanDerWaalsContact C-N 3.32Å; V533-E535 PolarHBondContact O-N 3.34Å; V533-I536 PolarHBondContact O-N 3.16Å; V533-M537 HydrophobicContact CG1-CG 4.32Å; V533-M537 HydrophobicContact CG1-SD 4.08Å; V533-M537 WeakPolarHBondContact O-CB 3.35Å; V533-M537 VanDerWaalsContact O-CG 3.28Å; V533-M537 WeakPolarHBondContact O-CG 3.26Å; V533-M537 PolarHBondContact O-N 2.95Å
534	K	83.7	Confident	81.8	Confident	126 Å²	126	108.5 Å²	108.5	55%	0.548	52%	0.524	S	S	.	.	H	α-helix	trans	-60.7	-41.5	175.1	-77.1	177.2	-178.8	-178.5	0	111.7	L530 L531 M537 Q538	L530-K534 WeakPolarHBondContact O-CG 3.34Å; L530-K534 PolarHBondContact O-N 2.86Å; L531-K534 WeakPolarHBondContact O-CB 3.48Å; L531-K534 PolarHBondContact O-N 2.99Å; K534-M537 PolarHBondContact O-N 2.93Å; K534-Q538 WeakPolarHBondContact O-CG 3.31Å; K534-Q538 PolarHBondContact O-N 2.98Å; K534-Q538 VanDerWaalsContact O-N 3.13Å
535	E	84	Confident	81.2	Confident	126 Å²	126	107.7 Å²	107.7	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-43.9	177	-169.5	174.3	-172.7	0	0	111.8	L531 H532 V533 M537 Q538 L539	L531-E535 WeakPolarHBondContact O-CB 3.35Å; L531-E535 PolarHBondContact O-N 3.42Å; H532-E535 PolarHBondContact O-N 3.41Å; V533-E535 VanDerWaalsContact C-N 3.32Å; V533-E535 PolarHBondContact O-N 3.34Å; E535-M537 VanDerWaalsContact C-N 3.35Å; E535-M537 PolarHBondContact O-N 3.38Å; E535-Q538 PolarHBondContact O-N 2.84Å; E535-L539 PolarHBondContact O-N 3.19Å
536	I	81.2	Confident	80.3	Confident	38 Å²	38	114.8 Å²	114.8	20%	0.195	54%	0.539	C	S	.	.	H	α-helix	trans	-65.3	-37.6	174.6	-69.7	170.4	0	0	0	111.6	H532 V533 Q538 L539 R544	H532-I536 WeakPolarHBondContact CE1-CD1 3.05Å; H532-I536 WeakPolarHBondContact O-CG1 3.37Å; H532-I536 PolarHBondContact O-N 3.34Å; V533-I536 PolarHBondContact O-N 3.16Å; I536-Q538 PolarHBondContact O-N 2.94Å; I536-L539 WeakPolarHBondContact O-CB 3.39Å; I536-L539 PolarHBondContact O-N 2.99Å; I536-L539 VanDerWaalsContact O-N 3.12Å; I536-R544 HydrophobicContact CG2-CB 4.44Å; I536-R544 HydrophobicContact CG2-CG 4.02Å; I536-R544 PolarHBondContact O-NE 3.15Å
537	M	77.6	Confident	79.2	Confident	126 Å²	126	120.6 Å²	120.6	62%	0.621	57%	0.571	S	S	*	*	H	α-helix	trans	-67.9	-22.4	177.1	-74.7	-173.9	89	0	0	112.9	V533 K534 E535 L539 R544	V533-M537 HydrophobicContact CG1-CG 4.32Å; V533-M537 HydrophobicContact CG1-SD 4.08Å; V533-M537 WeakPolarHBondContact O-CB 3.35Å; V533-M537 VanDerWaalsContact O-CG 3.28Å; V533-M537 WeakPolarHBondContact O-CG 3.26Å; V533-M537 PolarHBondContact O-N 2.95Å; K534-M537 PolarHBondContact O-N 2.93Å; E535-M537 VanDerWaalsContact C-N 3.35Å; E535-M537 PolarHBondContact O-N 3.38Å; M537-L539 VanDerWaalsContact C-N 3.35Å; M537-R544 PolarHBondContact O-NH2 2.73Å
538	Q	81.3	Confident	77.9	Confident	167 Å²	167	121 Å²	121	78%	0.78	58%	0.584	S	S	*	*	H	α-helix	trans	-77.8	-19.2	172.2	-71.4	174.2	11.5	0	0	113.1	K534 E535 I536	K534-Q538 WeakPolarHBondContact O-CG 3.31Å; K534-Q538 PolarHBondContact O-N 2.98Å; K534-Q538 VanDerWaalsContact O-N 3.13Å; E535-Q538 PolarHBondContact O-N 2.84Å; I536-Q538 PolarHBondContact O-N 2.94Å
539	L	80.6	Confident	76.4	Confident	81 Å²	81	124.4 Å²	124.4	42%	0.424	60%	0.598	S	S	.	*	S	Bend	trans	-79	142.7	174.5	-64	172.5	0	0	0	111.3	E535 I536 M537 R544	E535-L539 PolarHBondContact O-N 3.19Å; I536-L539 WeakPolarHBondContact O-CB 3.39Å; I536-L539 PolarHBondContact O-N 2.99Å; I536-L539 VanDerWaalsContact O-N 3.12Å; M537-L539 VanDerWaalsContact C-N 3.35Å; L539-R544 HydrophobicContact CB-CG 4.39Å; L539-R544 PolarHBondContact O-NE 3.28Å; L539-R544 PolarHBondContact O-NH2 3.49Å; L539-R544 VanDerWaalsContact O-NH2 3.09Å
540	D	76.6	Confident	75.1	Confident	120 Å²	120	126.5 Å²	126.5	64%	0.642	61%	0.607	S	S	*	*			trans	-53.4	141.3	173.4	-101.1	-25.7	0	0	0	111.9	R542 K543 R544	D540-R542 PolarHBondContact O-N 3.21Å; D540-K543 PolarHBondContact O-N 2.93Å; D540-R544 PolarHBondContact O-N 3.07Å
541	E	73.5	Confident	73.6	Confident	163 Å²	163	131.1 Å²	131.1	76%	0.762	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-53.2	-33.5	-174.4	-65.9	-176.2	159.7	0	0	114	K543	E541-K543 VanDerWaalsContact C-N 3.34Å; E541-K543 PolarHBondContact O-N 2.92Å
542	R	76.4	Confident	72.3	Confident	251 Å²	251	132.7 Å²	132.7	95%	0.947	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-75.2	-18.6	178.4	-74.4	-179.6	168.9	179.5	-3.2	114.6	D540	D540-R542 PolarHBondContact O-N 3.21Å
543	K	75.3	Confident	71.9	Confident	159 Å²	159	136.6 Å²	136.6	69%	0.691	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-101.3	-4.2	-179.1	-65.7	-176.6	-178.5	175.2	0	112.6	D540 E541	D540-K543 PolarHBondContact O-N 2.93Å; E541-K543 VanDerWaalsContact C-N 3.34Å; E541-K543 PolarHBondContact O-N 2.92Å
544	R	81.3	Confident	71.5	Confident	92 Å²	92	142 Å²	142	35%	0.347	67%	0.672	S	S	.	*	S	Bend	trans	-72	123.4	176.6	-66.1	-177.1	-173.6	169.1	4.7	109.8	I536 M537 L539 D540	I536-R544 HydrophobicContact CG2-CB 4.44Å; I536-R544 HydrophobicContact CG2-CG 4.02Å; I536-R544 PolarHBondContact O-NE 3.15Å; M537-R544 PolarHBondContact O-NH2 2.73Å; L539-R544 HydrophobicContact CB-CG 4.39Å; L539-R544 PolarHBondContact O-NE 3.28Å; L539-R544 PolarHBondContact O-NH2 3.49Å; L539-R544 VanDerWaalsContact O-NH2 3.09Å; D540-R544 PolarHBondContact O-N 3.07Å
545	P	76.1	Confident	71.2	Confident	91 Å²	91	139.6 Å²	139.6	59%	0.591	67%	0.67	S	S	*	*			trans	-65.5	143.1	176.2	26.5	-32.5	0	0	0	110.7	N547	P545-N547 PolarHBondContact O-N 2.82Å
546	Y	66.7	Low	71.2	Confident	209 Å²	209	135.9 Å²	135.9	82%	0.82	66%	0.656	S	S	*	*			trans	-79.8	113.5	-179.4	-159.9	-94.9	0	0	0	110	S548	Y546-S548 VanDerWaalsContact C-N 3.25Å; Y546-S548 PolarHBondContact O-N 3.29Å
547	N	61.6	Low	71.2	Confident	151 Å²	151	142.6 Å²	142.6	81%	0.807	69%	0.686	S	S	*	*			trans	-70.7	77.1	176.6	-92.5	0.9	0	0	0	110.8	P545	P545-N547 PolarHBondContact O-N 2.82Å
548	S	56.2	Low	71.5	Confident	94 Å²	94	138.9 Å²	138.9	66%	0.657	67%	0.667	S	S	*	*			trans	-93.8	-7	177.3	47.5	0	0	0	0	114	Y546	Y546-S548 VanDerWaalsContact C-N 3.25Å; Y546-S548 PolarHBondContact O-N 3.29Å
549	V	55.7	Low	71.6	Confident	131 Å²	131	135.5 Å²	135.5	79%	0.794	65%	0.652	S	S	*	*			trans	-123.4	95	-178	-170.2	0	0	0	0	108.6
550	Y	57.4	Low	71.7	Confident	177 Å²	177	135.2 Å²	135.2	69%	0.694	65%	0.649	S	S	*	*			trans	-118.9	123.1	163.2	-172.5	-101.6	0	0	0	107.5	T552	Y550-T552 HydrophobicContact CD1-CG2 4.46Å; Y550-T552 PolarHBondContact O-N 3.45Å
551	E	52.5	Low	72	Confident	169 Å²	169	134.4 Å²	134.4	79%	0.79	64%	0.641	S	S	*	*			trans	-68.7	110.3	167.5	-74.2	-179.1	168.9	0	0	107.8	R553	E551-R553 VanDerWaalsContact C-N 3.27Å; E551-R553 PolarHBondContact O-N 2.9Å
552	T	57.4	Low	72.6	Confident	141 Å²	141	126.7 Å²	126.7	87%	0.865	61%	0.605	S	S	*	*			trans	-69.4	84.6	175.4	39.5	0	0	0	0	110	Y550	Y550-T552 HydrophobicContact CD1-CG2 4.46Å; Y550-T552 PolarHBondContact O-N 3.45Å
553	R	73.3	Confident	72.9	Confident	191 Å²	191	119.7 Å²	119.7	72%	0.721	58%	0.58	S	S	*	*			trans	-105.5	137	168.6	-176.1	178.1	175.6	175	0	109.5	E551 P555	E551-R553 VanDerWaalsContact C-N 3.27Å; E551-R553 PolarHBondContact O-N 2.9Å; R553-P555 WeakPolarHBondContact O-CD 3.36Å
554	E	72.4	Confident	73.2	Confident	178 Å²	178	120.4 Å²	120.4	83%	0.832	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-62.6	126.1	173.4	-66.1	-174.3	170.2	0	0	110.3
555	P	78.3	Confident	73.1	Confident	76 Å²	76	123 Å²	123	49%	0.494	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-60.8	137.4	178.7	-25.7	35.3	0	0	0	112.3	R553 M560	R553-P555 WeakPolarHBondContact O-CD 3.36Å; P555-M560 HydrophobicContact CB-CG 3.87Å; P555-M560 HydrophobicContact CB-SD 3.98Å; P555-M560 HydrophobicContact CG-SD 4.41Å
556	T	84.9	Confident	73.2	Confident	49 Å²	49	122 Å²	122	30%	0.301	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-69.8	157.1	176.3	59.5	0	0	0	0	111.5	E558 E559 M560	T556-E558 PolarHBondContact O-N 3.2Å; T556-E558 VanDerWaalsContact O-N 3.17Å; T556-E559 PolarHBondContact N-OE2 2.9Å; T556-E559 PolarHBondContact O-N 3.38Å; T556-E559 VanDerWaalsContact O-N 3.14Å; T556-E559 WeakPolarHBondContact OG1-CG 3.44Å; T556-E559 PolarHBondContact OG1-OE2 3.4Å; T556-M560 WeakPolarHBondContact O-CG 3.3Å; T556-M560 PolarHBondContact O-N 2.91Å
557	E	80.5	Confident	73.8	Confident	178 Å²	178	119.8 Å²	119.8	83%	0.832	57%	0.573	S	S	*	*	H	α-helix	trans	-55.7	-35	179.9	-67.1	-172.6	159.5	0	0	112.6	E561	E557-E561 WeakPolarHBondContact O-CB 3.45Å; E557-E561 PolarHBondContact O-N 2.87Å
558	E	84.1	Confident	74.1	Confident	48 Å²	48	118.4 Å²	118.4	22%	0.224	56%	0.561	C	S	.	*	H	α-helix	trans	-73.1	-37.9	180	-63.6	163.1	163.9	0	0	111.9	K518 T556 E561 A562	K518-E558 VanDerWaalsContact CB-CD 3.47Å; K518-E558 WeakPolarHBondContact CB-OE2 3.38Å; K518-E558 WeakPolarHBondContact CD-OE1 3.27Å; K518-E558 WeakPolarHBondContact CD-OE2 3.26Å; T556-E558 PolarHBondContact O-N 3.2Å; T556-E558 VanDerWaalsContact O-N 3.17Å; E558-E561 PolarHBondContact O-N 2.92Å; E558-A562 WeakPolarHBondContact O-CB 3.36Å; E558-A562 PolarHBondContact O-N 3.42Å
559	E	83.2	Confident	74.8	Confident	97 Å²	97	122.5 Å²	122.5	45%	0.453	56%	0.562	S	S	.	*	H	α-helix	trans	-67.7	-39	173.1	-72.2	163.5	161.2	0	0	111.5	A522 T556 E561 A562 Y563	A522-E559 HydrophobicContact CB-CG 4.23Å; T556-E559 PolarHBondContact N-OE2 2.9Å; T556-E559 PolarHBondContact O-N 3.38Å; T556-E559 VanDerWaalsContact O-N 3.14Å; T556-E559 WeakPolarHBondContact OG1-CG 3.44Å; T556-E559 PolarHBondContact OG1-OE2 3.4Å; E559-E561 VanDerWaalsContact C-N 3.34Å; E559-A562 PolarHBondContact O-N 3Å; E559-Y563 WeakPolarHBondContact O-CB 3.43Å; E559-Y563 PolarHBondContact O-N 3.35Å
560	M	82.2	Confident	75.2	Confident	75 Å²	75	121.8 Å²	121.8	37%	0.369	56%	0.56	S	S	.	*	H	α-helix	trans	-65.8	-36.4	174.7	-73.2	-70.5	-74.6	0	0	112.2	P555 T556 R564	P555-M560 HydrophobicContact CB-CG 3.87Å; P555-M560 HydrophobicContact CB-SD 3.98Å; P555-M560 HydrophobicContact CG-SD 4.41Å; T556-M560 WeakPolarHBondContact O-CG 3.3Å; T556-M560 PolarHBondContact O-N 2.91Å; M560-R564 WeakPolarHBondContact O-CB 3.45Å; M560-R564 WeakPolarHBondContact O-CD 3.28Å; M560-R564 WeakPolarHBondContact O-CG 3.26Å; M560-R564 PolarHBondContact O-N 3.37Å
561	E	83.4	Confident	75.6	Confident	102 Å²	102	120.5 Å²	120.5	48%	0.477	57%	0.566	S	S	.	*	H	α-helix	trans	-70.8	-43.9	174.6	-171.8	166.5	-149.9	0	0	111.7	L519 E557 E558 E559 Y563 R564 M565	L519-E561 HydrophobicContact CD1-CB 4.16Å; L519-E561 HydrophobicContact CD1-CG 4.18Å; E557-E561 WeakPolarHBondContact O-CB 3.45Å; E557-E561 PolarHBondContact O-N 2.87Å; E558-E561 PolarHBondContact O-N 2.92Å; E559-E561 VanDerWaalsContact C-N 3.34Å; E561-Y563 VanDerWaalsContact C-N 3.35Å; E561-Y563 PolarHBondContact O-N 2.99Å; E561-R564 PolarHBondContact O-N 2.66Å; E561-M565 VanDerWaalsContact O-CG 3.3Å; E561-M565 WeakPolarHBondContact O-CG 3.36Å; E561-M565 PolarHBondContact O-N 3.09Å
562	A	85.3	Confident	76.6	Confident	1 Å²	1	115.6 Å²	115.6	1%	0.008	55%	0.545	C	S	.	.	H	α-helix	trans	-58.6	-45	173.8	0	0	0	0	0	112.1	A522 L523 E558 E559 R564 M565 K566	A522-A562 HydrophobicContact CB-CB 3.91Å; L523-A562 HydrophobicContact CD2-CB 3.83Å; L523-A562 HydrophobicContact CG-CB 4.05Å; E558-A562 WeakPolarHBondContact O-CB 3.36Å; E558-A562 PolarHBondContact O-N 3.42Å; E559-A562 PolarHBondContact O-N 3Å; A562-R564 PolarHBondContact O-N 3.33Å; A562-M565 PolarHBondContact O-N 3.47Å; A562-K566 PolarHBondContact O-N 3.16Å
563	Y	82.7	Confident	77.1	Confident	104 Å²	104	114.3 Å²	114.3	41%	0.408	54%	0.539	S	S	.	.	H	α-helix	trans	-60.7	-44.3	174.5	179.8	-101.8	0	0	0	111.9	E526 E559 E561 M565 K566 R567	E526-Y563 WeakPolarHBondContact OE1-CD2 3.43Å; E559-Y563 WeakPolarHBondContact O-CB 3.43Å; E559-Y563 PolarHBondContact O-N 3.35Å; E561-Y563 VanDerWaalsContact C-N 3.35Å; E561-Y563 PolarHBondContact O-N 2.99Å; Y563-M565 VanDerWaalsContact C-N 3.3Å; Y563-M565 PolarHBondContact O-N 3.01Å; Y563-K566 PolarHBondContact O-N 3.18Å; Y563-R567 WeakPolarHBondContact O-CB 3.41Å; Y563-R567 PolarHBondContact O-N 3.24Å
564	R	82.5	Confident	76.9	Confident	174 Å²	174	110.9 Å²	110.9	66%	0.657	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-34.4	177.4	-75.4	169	-173.7	171.2	5.8	113	M560 E561 A562	M560-R564 WeakPolarHBondContact O-CB 3.45Å; M560-R564 WeakPolarHBondContact O-CD 3.28Å; M560-R564 WeakPolarHBondContact O-CG 3.26Å; M560-R564 PolarHBondContact O-N 3.37Å; E561-R564 PolarHBondContact O-N 2.66Å; A562-R564 PolarHBondContact O-N 3.33Å
565	M	78.4	Confident	76.6	Confident	146 Å²	146	104.2 Å²	104.2	72%	0.719	51%	0.507	S	S	*	.	H	α-helix	trans	-74.3	-36.6	179	-72.2	-73	-78.3	0	0	112.7	L523 E561 A562 Y563	L523-M565 HydrophobicContact CD2-CB 4.35Å; E561-M565 VanDerWaalsContact O-CG 3.3Å; E561-M565 WeakPolarHBondContact O-CG 3.36Å; E561-M565 PolarHBondContact O-N 3.09Å; A562-M565 PolarHBondContact O-N 3.47Å; Y563-M565 VanDerWaalsContact C-N 3.3Å; Y563-M565 PolarHBondContact O-N 3.01Å
566	K	77.9	Confident	75.9	Confident	71 Å²	71	106.1 Å²	106.1	31%	0.309	52%	0.523	S	S	.	.	H	α-helix	trans	-93.8	-11.3	-178.9	-71.5	-78.4	-165.4	167.2	0	113.9	L523 E527 L530 A562 Y563 Q568	L523-K566 HydrophobicContact CD2-CG 4.14Å; E527-K566 IonicContact OE1-NZ 3.7Å; E527-K566 PolarHBondContact OE1-NZ 2.81Å; E527-K566 IonicContact OE2-NZ 2.75Å; E527-K566 PolarHBondContact OE2-NZ 3.07Å; L530-K566 HydrophobicContact CD1-CB 4.22Å; A562-K566 PolarHBondContact O-N 3.16Å; Y563-K566 PolarHBondContact O-N 3.18Å; K566-Q568 PolarHBondContact O-N 2.84Å
567	R	79.1	Confident	75	Confident	163 Å²	163	112.8 Å²	112.8	62%	0.615	55%	0.548	S	S	*	.			trans	-63.1	107.4	176.8	178.6	177.4	174.5	-163.9	-1.2	110.1	Y563 R569	Y563-R567 WeakPolarHBondContact O-CB 3.41Å; Y563-R567 PolarHBondContact O-N 3.24Å; R567-R569 PolarHBondContact O-N 3.38Å
568	Q	68.3	Low	74.4	Confident	122 Å²	122	110.1 Å²	110.1	57%	0.57	54%	0.539	S	S	*	.			trans	-62.2	134.4	167.4	-68.8	-173.9	-25.4	0	0	109.5	K566 P570	K566-Q568 PolarHBondContact O-N 2.84Å; Q568-P570 VanDerWaalsContact O-CD 3.32Å; Q568-P570 WeakPolarHBondContact O-CD 3.14Å
569	R	71.6	Confident	73.2	Confident	180 Å²	180	111.3 Å²	111.3	68%	0.679	56%	0.564	S	S	*	*			trans	-99.9	100.4	174.1	-66.6	-176	-176.2	-173.7	2.3	107.4	R567 D571 D572	R567-R569 PolarHBondContact O-N 3.38Å; R569-D571 PolarHBondContact O-N 3.44Å; R569-D572 HydrophobicContact CB-CB 4.06Å; R569-D572 PolarHBondContact O-N 3.48Å
570	P	64.1	Low	71.7	Confident	115 Å²	115	116.6 Å²	116.6	75%	0.747	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-19.9	-179.3	26.5	-34.5	0	0	0	112.5	Q568	Q568-P570 VanDerWaalsContact O-CD 3.32Å; Q568-P570 WeakPolarHBondContact O-CD 3.14Å
571	D	66.3	Low	71.2	Confident	151 Å²	151	118.7 Å²	118.7	81%	0.807	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	7.5	-179.7	-49.7	-50.2	0	0	0	113.7	R569 P573	R569-D571 PolarHBondContact O-N 3.44Å; D571-P573 VanDerWaalsContact O-CD 3.32Å; D571-P573 WeakPolarHBondContact O-CD 3.18Å
572	D	72.1	Confident	70.5	Confident	66 Å²	66	119.5 Å²	119.5	35%	0.353	61%	0.606	S	S	.	*			trans	-85.8	111.4	178.1	-170.7	-16.7	0	0	0	110.8	R569 M574 A575	R569-D572 HydrophobicContact CB-CB 4.06Å; R569-D572 PolarHBondContact O-N 3.48Å; D572-M574 PolarHBondContact O-N 2.8Å; D572-M574 VanDerWaalsContact O-N 3.09Å; D572-M574 PolarHBondContact OD1-N 2.74Å; D572-A575 HydrophobicContact CB-CB 4.29Å; D572-A575 VanDerWaalsContact O-CB 3.24Å; D572-A575 WeakPolarHBondContact O-CB 3.31Å; D572-A575 PolarHBondContact O-N 3.28Å
573	P	67.9	Low	69.7	Low	114 Å²	114	126.1 Å²	126.1	74%	0.74	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-12.3	-178.8	28.1	-35.5	0	0	0	113.6	D571	D571-P573 VanDerWaalsContact O-CD 3.32Å; D571-P573 WeakPolarHBondContact O-CD 3.18Å
574	M	69.5	Low	68.9	Low	118 Å²	118	127.4 Å²	127.4	58%	0.581	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-9.9	173.1	-65.4	-164.4	70.9	0	0	113.7	D572 S576 F577 L578	D572-M574 PolarHBondContact O-N 2.8Å; D572-M574 VanDerWaalsContact O-N 3.09Å; D572-M574 PolarHBondContact OD1-N 2.74Å; M574-S576 VanDerWaalsContact C-N 3.31Å; M574-S576 PolarHBondContact O-N 3.23Å; M574-F577 PolarHBondContact O-N 2.82Å; M574-L578 HydrophobicContact CB-CD1 4.49Å; M574-L578 PolarHBondContact O-N 2.75Å
575	A	66.1	Low	68.1	Low	38 Å²	38	124.5 Å²	124.5	31%	0.314	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.2	-39.5	-178	0	0	0	0	0	112.4	D572 F577 L578	D572-A575 HydrophobicContact CB-CB 4.29Å; D572-A575 VanDerWaalsContact O-CB 3.24Å; D572-A575 WeakPolarHBondContact O-CB 3.31Å; D572-A575 PolarHBondContact O-N 3.28Å; A575-F577 PolarHBondContact O-N 3.18Å; A575-L578 PolarHBondContact O-N 3.16Å
576	S	64.9	Low	67.4	Low	116 Å²	116	123.1 Å²	123.1	81%	0.811	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-22.4	176.5	-53.8	0	0	0	0	113.8	M574	M574-S576 VanDerWaalsContact C-N 3.31Å; M574-S576 PolarHBondContact O-N 3.23Å
577	F	64.1	Low	66.7	Low	190 Å²	190	126.8 Å²	126.8	83%	0.833	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-24.1	178.5	-98.1	-87.7	0	0	0	113.2	M574 A575	M574-F577 PolarHBondContact O-N 2.82Å; A575-F577 PolarHBondContact O-N 3.18Å
578	L	68.6	Low	65.7	Low	121 Å²	121	124 Å²	124	63%	0.634	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-1	-176.5	-70.3	168.3	0	0	0	113.7	M574 A575 Q580	M574-L578 HydrophobicContact CB-CD1 4.49Å; M574-L578 PolarHBondContact O-N 2.75Å; A575-L578 PolarHBondContact O-N 3.16Å; L578-Q580 PolarHBondContact O-N 3.39Å
579	G	58.3	Low	65.5	Low	74 Å²	74	124.2 Å²	124.2	76%	0.763	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.3	38.7	172.6	0	0	0	0	0	114.4
580	Q	52.4	Low	64.9	Low	207 Å²	207	119.1 Å²	119.1	97%	0.967	69%	0.686	S	S	*	*			trans	-106.2	0	173.2	-76	-168	-1.2	0	0	113.1	L578	L578-Q580 PolarHBondContact O-N 3.39Å

Retrieved 580 of 580 residues in 131.8 ms (Link to these results)

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