G4M0R9_SCHMA Loading...

26S protease regulatory subunit 6a, putative

AlphaFold DB , UniProt , Accession G4M0R9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 428 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	46.4	Very low	239 Å²	239	154.2 Å²	154.2	100%	1.177	79%	0.786	S	S	*	*				0	94.3	0	-69.6	179.7	-167.5	0	0	107.8
2	T	37.1	Very low	47.3	Very low	129 Å²	129	151.8 Å²	151.8	79%	0.791	78%	0.776	S	S	*	*			trans	172.2	93.5	149.1	29.9	0	0	0	0	106.5	T4	T2-T4 PolarHBondContact O-N 3.35Å
3	S	36.1	Very low	48	Very low	116 Å²	116	144.7 Å²	144.7	81%	0.811	74%	0.744	S	S	*	*			trans	-58.5	96.9	160.1	47.2	0	0	0	0	108.3	I5	S3-I5 PolarHBondContact O-N 3.08Å
4	T	46.7	Very low	49.1	Very low	133 Å²	133	143 Å²	143	82%	0.816	74%	0.737	S	S	*	*			trans	-81.9	99.1	167.4	1.6	0	0	0	0	106.6	T2 E6	T2-T4 PolarHBondContact O-N 3.35Å; T4-E6 PolarHBondContact O-N 3.26Å
5	I	47.2	Very low	49.9	Very low	142 Å²	142	145 Å²	145	73%	0.728	74%	0.742	S	S	*	*			trans	-40.4	123.7	172.4	-66.2	157.6	0	0	0	109.1	S3 R7	S3-I5 PolarHBondContact O-N 3.08Å; I5-R7 PolarHBondContact O-N 3.36Å
6	E	42.3	Very low	50.7	Low	192 Å²	192	140.4 Å²	140.4	90%	0.897	73%	0.733	S	S	*	*			trans	-57.7	86.6	166	-69	178	162.8	0	0	107.8	T4	T4-E6 PolarHBondContact O-N 3.26Å
7	R	49.8	Very low	51.4	Low	185 Å²	185	138.4 Å²	138.4	70%	0.698	72%	0.72	S	S	*	*			trans	-63.6	126.9	162.8	-75.1	-174.6	178.2	-174	-0.8	106.1	I5 I9 D12	I5-R7 PolarHBondContact O-N 3.36Å; R7-I9 PolarHBondContact O-N 2.89Å; R7-I9 VanDerWaalsContact O-N 3.14Å; R7-D12 IonicContact NH1-OD2 2.57Å
8	P	49.1	Very low	52.2	Low	74 Å²	74	134.4 Å²	134.4	48%	0.481	70%	0.703	S	S	.	*			trans	-56.9	125.4	172	24.2	-30.4	0	0	0	107.4	W10 D11	P8-W10 PolarHBondContact O-N 3.41Å; P8-D11 WeakPolarHBondContact CG-OD2 3.26Å; P8-D11 PolarHBondContact O-N 3.22Å
9	I	56.3	Low	53	Low	154 Å²	154	131.9 Å²	131.9	79%	0.79	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	-7.2	-174.6	-68.9	160.7	0	0	0	113.5	R7	R7-I9 PolarHBondContact O-N 2.89Å; R7-I9 VanDerWaalsContact O-N 3.14Å
10	W	56	Low	53.8	Low	207 Å²	207	129.9 Å²	129.9	78%	0.784	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-5.3	-170.1	-52.1	94.7	0	0	0	114.4	P8	P8-W10 PolarHBondContact O-N 3.41Å
11	D	55.4	Low	54.6	Low	125 Å²	125	126.5 Å²	126.5	67%	0.668	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-18.2	-176.8	-82.3	-9.4	0	0	0	113.9	P8	P8-D11 WeakPolarHBondContact CG-OD2 3.26Å; P8-D11 PolarHBondContact O-N 3.22Å
12	D	56.8	Low	56.2	Low	126 Å²	126	122.5 Å²	122.5	67%	0.674	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	39.7	-178.2	-70.2	-36.8	0	0	0	111.4	R7 D14	R7-D12 IonicContact NH1-OD2 2.57Å; D12-D14 PolarHBondContact O-N 3.44Å
13	V	56.8	Low	58.2	Low	59 Å²	59	125.8 Å²	125.8	36%	0.358	64%	0.64	S	S	.	*			trans	-81.4	103.9	171.7	-169.6	0	0	0	0	108	E15 M17 V18	V13-E15 PolarHBondContact O-N 3.29Å; V13-M17 HydrophobicContact CG1-CB 4.33Å; V13-M17 HydrophobicContact CG1-CE 4.49Å; V13-V18 HydrophobicContact CB-CG2 4.44Å; V13-V18 HydrophobicContact CG1-CG2 3.63Å
14	D	63	Low	59.9	Low	121 Å²	121	122.2 Å²	122.2	65%	0.647	61%	0.611	S	S	*	*			trans	-47.6	127.6	172.6	-83	-38	0	0	0	109.9	D12 A16 M17 V18	D12-D14 PolarHBondContact O-N 3.44Å; D14-A16 PolarHBondContact O-N 3.24Å; D14-M17 HydrophobicContact CB-CB 4.27Å; D14-M17 WeakPolarHBondContact O-CA 3.24Å; D14-M17 VanDerWaalsContact O-CB 3.29Å; D14-M17 WeakPolarHBondContact O-CB 3.47Å; D14-M17 PolarHBondContact O-N 2.69Å; D14-V18 PolarHBondContact O-N 2.87Å; D14-V18 VanDerWaalsContact O-N 3.16Å
15	E	61.8	Low	61.5	Low	173 Å²	173	118.5 Å²	118.5	81%	0.808	59%	0.591	S	S	*	*	H	α-helix	trans	-52.7	-30.5	175.8	-77	-176.2	160.5	0	0	111.3	V13 M17 V18 D19	V13-E15 PolarHBondContact O-N 3.29Å; E15-M17 PolarHBondContact O-N 3.08Å; E15-V18 PolarHBondContact O-N 2.95Å; E15-D19 PolarHBondContact O-N 3.07Å
16	A	61.9	Low	63.1	Low	72 Å²	72	117.3 Å²	117.3	60%	0.595	59%	0.59	S	S	*	*	H	α-helix	trans	-63	-37.7	173	0	0	0	0	0	113.1	D14 D19 E20	D14-A16 PolarHBondContact O-N 3.24Å; A16-D19 PolarHBondContact O-N 3.27Å; A16-E20 WeakPolarHBondContact O-CB 3.42Å; A16-E20 PolarHBondContact O-N 3.27Å
17	M	62.7	Low	65.1	Low	106 Å²	106	115.6 Å²	115.6	52%	0.522	58%	0.582	S	S	.	*	H	α-helix	trans	-70.7	-36.6	175.9	-138.1	-175.7	93.2	0	0	110.6	V13 D14 E15 E20 V21	V13-M17 HydrophobicContact CG1-CB 4.33Å; V13-M17 HydrophobicContact CG1-CE 4.49Å; D14-M17 HydrophobicContact CB-CB 4.27Å; D14-M17 WeakPolarHBondContact O-CA 3.24Å; D14-M17 VanDerWaalsContact O-CB 3.29Å; D14-M17 WeakPolarHBondContact O-CB 3.47Å; D14-M17 PolarHBondContact O-N 2.69Å; E15-M17 PolarHBondContact O-N 3.08Å; M17-E20 PolarHBondContact O-N 3.48Å; M17-V21 VanDerWaalsContact O-CB 3.24Å; M17-V21 WeakPolarHBondContact O-CB 3.36Å; M17-V21 WeakPolarHBondContact O-CG2 3.3Å; M17-V21 PolarHBondContact O-N 2.84Å
18	V	65.6	Low	66.7	Low	67 Å²	67	111.3 Å²	111.3	41%	0.406	57%	0.57	S	S	.	*	H	α-helix	trans	-63.9	-43.1	173.6	-175.1	0	0	0	0	111	V13 D14 E15 V21 M22	V13-V18 HydrophobicContact CB-CG2 4.44Å; V13-V18 HydrophobicContact CG1-CG2 3.63Å; D14-V18 PolarHBondContact O-N 2.87Å; D14-V18 VanDerWaalsContact O-N 3.16Å; E15-V18 PolarHBondContact O-N 2.95Å; V18-V21 PolarHBondContact O-N 3.03Å; V18-M22 WeakPolarHBondContact O-CB 3.42Å; V18-M22 VanDerWaalsContact O-CG 3.3Å; V18-M22 WeakPolarHBondContact O-CG 3.24Å; V18-M22 PolarHBondContact O-N 2.93Å
19	D	68.4	Low	68.3	Low	87 Å²	87	110.5 Å²	110.5	47%	0.465	56%	0.561	S	S	.	*	H	α-helix	trans	-66.8	-39.2	177.8	-110.9	24.9	0	0	0	112.7	E15 A16 R23	E15-D19 PolarHBondContact O-N 3.07Å; A16-D19 PolarHBondContact O-N 3.27Å; D19-R23 VanDerWaalsContact O-CG 3.26Å; D19-R23 WeakPolarHBondContact O-CG 3.47Å; D19-R23 PolarHBondContact O-N 3.5Å; D19-R23 IonicContact OD2-NH2 3.35Å; D19-R23 PolarHBondContact OD2-NH2 2.91Å
20	E	69.3	Low	69.7	Low	90 Å²	90	106.3 Å²	106.3	42%	0.421	54%	0.543	S	S	.	.	H	α-helix	trans	-66.7	-41.6	174.7	-155.6	-176	163.1	0	0	110.3	A16 M17 R23 M24 R32	A16-E20 WeakPolarHBondContact O-CB 3.42Å; A16-E20 PolarHBondContact O-N 3.27Å; M17-E20 PolarHBondContact O-N 3.48Å; E20-R23 PolarHBondContact O-N 3.46Å; E20-M24 HydrophobicContact CG-SD 4.5Å; E20-M24 VanDerWaalsContact O-CG 3.24Å; E20-M24 WeakPolarHBondContact O-CG 3.38Å; E20-M24 PolarHBondContact O-N 2.76Å; E20-R32 IonicContact OE1-CZ 2.95Å; E20-R32 IonicContact OE1-NH1 2.61Å; E20-R32 PolarHBondContact OE1-NH1 2.94Å; E20-R32 IonicContact OE1-NH2 3.56Å
21	V	70	Confident	71.1	Confident	59 Å²	59	99.3 Å²	99.3	36%	0.358	53%	0.525	S	S	.	.	H	α-helix	trans	-65.4	-39.3	177.3	166.7	0	0	0	0	112.1	M17 V18 R23 M24 L29	M17-V21 VanDerWaalsContact O-CB 3.24Å; M17-V21 WeakPolarHBondContact O-CB 3.36Å; M17-V21 WeakPolarHBondContact O-CG2 3.3Å; M17-V21 PolarHBondContact O-N 2.84Å; V18-V21 PolarHBondContact O-N 3.03Å; V21-R23 VanDerWaalsContact C-N 3.3Å; V21-R23 PolarHBondContact O-N 3.16Å; V21-M24 PolarHBondContact O-N 3.46Å; V21-L29 HydrophobicContact CB-CD2 4.03Å; V21-L29 HydrophobicContact CG1-CD1 3.74Å; V21-L29 HydrophobicContact CG1-CD2 3.79Å; V21-L29 HydrophobicContact CG1-CG 4.41Å; V21-L29 HydrophobicContact CG2-CD2 3.79Å
22	M	69.1	Low	72.5	Confident	156 Å²	156	99 Å²	99	77%	0.768	52%	0.515	S	S	*	.	H	α-helix	trans	-67.6	-27.5	177	-80.1	-75.7	-139.3	0	0	113.4	V18	V18-M22 WeakPolarHBondContact O-CB 3.42Å; V18-M22 VanDerWaalsContact O-CG 3.3Å; V18-M22 WeakPolarHBondContact O-CG 3.24Å; V18-M22 PolarHBondContact O-N 2.93Å
23	R	78.2	Confident	74	Confident	198 Å²	198	95.5 Å²	95.5	75%	0.747	50%	0.503	S	S	*	.	H	α-helix	trans	-84.1	-22.8	178.6	-70.3	173.4	-161.8	-167.3	8.5	113	D19 E20 V21	D19-R23 VanDerWaalsContact O-CG 3.26Å; D19-R23 WeakPolarHBondContact O-CG 3.47Å; D19-R23 PolarHBondContact O-N 3.5Å; D19-R23 IonicContact OD2-NH2 3.35Å; D19-R23 PolarHBondContact OD2-NH2 2.91Å; E20-R23 PolarHBondContact O-N 3.46Å; V21-R23 VanDerWaalsContact C-N 3.3Å; V21-R23 PolarHBondContact O-N 3.16Å
24	M	72.6	Confident	75.5	Confident	41 Å²	41	100.9 Å²	100.9	20%	0.202	52%	0.517	C	S	.	.	S	Bend	trans	-79	142.6	-178.9	-72.7	175.4	77.1	0	0	110.7	E20 V21 E28 L29 R32	E20-M24 HydrophobicContact CG-SD 4.5Å; E20-M24 VanDerWaalsContact O-CG 3.24Å; E20-M24 WeakPolarHBondContact O-CG 3.38Å; E20-M24 PolarHBondContact O-N 2.76Å; V21-M24 PolarHBondContact O-N 3.46Å; M24-E28 VanDerWaalsContact CA-OE2 3.24Å; M24-E28 WeakPolarHBondContact CA-OE2 3.29Å; M24-E28 HydrophobicContact CB-CB 4.05Å; M24-E28 WeakPolarHBondContact CB-OE2 3.34Å; M24-E28 HydrophobicContact CE-CB 3.59Å; M24-E28 HydrophobicContact CG-CB 4.44Å; M24-L29 HydrophobicContact CB-CD2 4.16Å; M24-L29 HydrophobicContact CB-CG 4.01Å; M24-L29 HydrophobicContact SD-CD2 4.23Å; M24-R32 HydrophobicContact CE-CB 4.41Å
25	S	80.1	Confident	76.8	Confident	55 Å²	55	100.8 Å²	100.8	39%	0.385	52%	0.516	S	S	.	.			trans	-65.7	155.2	171.3	69.8	0	0	0	0	110.2	E27 E28 L29	S25-E27 PolarHBondContact O-N 3.36Å; S25-E27 VanDerWaalsContact O-N 3.07Å; S25-E28 PolarHBondContact N-OE2 2.93Å; S25-E28 VanDerWaalsContact N-OE2 3.08Å; S25-E28 PolarHBondContact O-N 2.91Å; S25-E28 WeakPolarHBondContact OG-CG 3.38Å; S25-E28 PolarHBondContact OG-N 2.92Å; S25-L29 PolarHBondContact O-N 3.38Å; S25-L29 VanDerWaalsContact O-N 3.08Å
26	T	81.1	Confident	78.1	Confident	116 Å²	116	96.8 Å²	96.8	71%	0.712	50%	0.5	S	S	*	.	H	α-helix	trans	-55	-29.1	174.4	49.2	0	0	0	0	112.1	T30	T26-T30 WeakPolarHBondContact O-CB 3.03Å; T26-T30 PolarHBondContact O-N 3.48Å; T26-T30 PolarHBondContact O-OG1 3.21Å
27	E	83.3	Confident	79.4	Confident	157 Å²	157	97.3 Å²	97.3	73%	0.734	49%	0.493	S	S	*	.	H	α-helix	trans	-70.1	-41.2	174.7	-66.8	-172.7	160.8	0	0	112.4	S25 T30 S31	S25-E27 PolarHBondContact O-N 3.36Å; S25-E27 VanDerWaalsContact O-N 3.07Å; E27-T30 PolarHBondContact O-N 3.45Å; E27-S31 PolarHBondContact O-N 3.28Å
28	E	83.8	Confident	80.8	Confident	94 Å²	94	95.7 Å²	95.7	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-68.9	-37.7	178.2	-73.8	174.1	166	0	0	112.8	M24 S25 T30 S31 R32	M24-E28 VanDerWaalsContact CA-OE2 3.24Å; M24-E28 WeakPolarHBondContact CA-OE2 3.29Å; M24-E28 HydrophobicContact CB-CB 4.05Å; M24-E28 WeakPolarHBondContact CB-OE2 3.34Å; M24-E28 HydrophobicContact CE-CB 3.59Å; M24-E28 HydrophobicContact CG-CB 4.44Å; S25-E28 PolarHBondContact N-OE2 2.93Å; S25-E28 VanDerWaalsContact N-OE2 3.08Å; S25-E28 PolarHBondContact O-N 2.91Å; S25-E28 WeakPolarHBondContact OG-CG 3.38Å; S25-E28 PolarHBondContact OG-N 2.92Å; E28-T30 VanDerWaalsContact C-N 3.34Å; E28-S31 WeakPolarHBondContact CA-OG 3.46Å; E28-S31 PolarHBondContact O-N 3.18Å; E28-S31 PolarHBondContact O-OG 3.28Å; E28-R32 WeakPolarHBondContact O-CB 3.24Å; E28-R32 PolarHBondContact O-N 3.39Å
29	L	82.6	Confident	82.1	Confident	57 Å²	57	97.7 Å²	97.7	30%	0.298	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-42.2	173.2	-71.5	172.4	0	0	0	111.7	V21 M24 S25 S31 R32 A33	V21-L29 HydrophobicContact CB-CD2 4.03Å; V21-L29 HydrophobicContact CG1-CD1 3.74Å; V21-L29 HydrophobicContact CG1-CD2 3.79Å; V21-L29 HydrophobicContact CG1-CG 4.41Å; V21-L29 HydrophobicContact CG2-CD2 3.79Å; M24-L29 HydrophobicContact CB-CD2 4.16Å; M24-L29 HydrophobicContact CB-CG 4.01Å; M24-L29 HydrophobicContact SD-CD2 4.23Å; S25-L29 PolarHBondContact O-N 3.38Å; S25-L29 VanDerWaalsContact O-N 3.08Å; L29-S31 VanDerWaalsContact C-N 3.3Å; L29-S31 PolarHBondContact O-N 2.97Å; L29-R32 PolarHBondContact O-N 3.22Å; L29-A33 WeakPolarHBondContact O-CB 3.43Å; L29-A33 PolarHBondContact O-N 2.95Å
30	T	85.9	Confident	83.2	Confident	67 Å²	67	97.2 Å²	97.2	41%	0.411	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-37.1	177.5	-54.2	0	0	0	0	111	T26 E27 E28 R34	T26-T30 WeakPolarHBondContact O-CB 3.03Å; T26-T30 PolarHBondContact O-N 3.48Å; T26-T30 PolarHBondContact O-OG1 3.21Å; E27-T30 PolarHBondContact O-N 3.45Å; E28-T30 VanDerWaalsContact C-N 3.34Å; T30-R34 WeakPolarHBondContact O-CB 3.37Å; T30-R34 WeakPolarHBondContact O-CG 3.21Å; T30-R34 PolarHBondContact O-N 3.12Å
31	S	85.5	Confident	84.2	Confident	59 Å²	59	100.9 Å²	100.9	41%	0.413	50%	0.503	S	S	.	.	H	α-helix	trans	-70.1	-42.9	176.4	74.3	0	0	0	0	111.9	E27 E28 L29 R34 L35	E27-S31 PolarHBondContact O-N 3.28Å; E28-S31 WeakPolarHBondContact CA-OG 3.46Å; E28-S31 PolarHBondContact O-N 3.18Å; E28-S31 PolarHBondContact O-OG 3.28Å; L29-S31 VanDerWaalsContact C-N 3.3Å; L29-S31 PolarHBondContact O-N 2.97Å; S31-R34 PolarHBondContact O-N 3.05Å; S31-L35 WeakPolarHBondContact O-CG 3.38Å; S31-L35 PolarHBondContact O-N 2.82Å
32	R	85.1	Confident	85.3	Confident	118 Å²	118	104.2 Å²	104.2	45%	0.445	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-41.6	178.1	-166	164.1	-176.4	167.3	-4.9	112.7	E20 M24 E28 L29 R34 L35 L36	E20-R32 IonicContact OE1-CZ 2.95Å; E20-R32 IonicContact OE1-NH1 2.61Å; E20-R32 PolarHBondContact OE1-NH1 2.94Å; E20-R32 IonicContact OE1-NH2 3.56Å; M24-R32 HydrophobicContact CE-CB 4.41Å; E28-R32 WeakPolarHBondContact O-CB 3.24Å; E28-R32 PolarHBondContact O-N 3.39Å; L29-R32 PolarHBondContact O-N 3.22Å; R32-R34 VanDerWaalsContact C-N 3.32Å; R32-R34 PolarHBondContact O-N 3.46Å; R32-L35 PolarHBondContact O-N 3.22Å; R32-L36 PolarHBondContact O-N 3.38Å
33	A	86.4	Confident	86.4	Confident	53 Å²	53	101.3 Å²	101.3	44%	0.438	50%	0.499	S	S	.	.	H	α-helix	trans	-60	-42.3	173.2	0	0	0	0	0	111.7	L29 L35 L36 D37	L29-A33 WeakPolarHBondContact O-CB 3.43Å; L29-A33 PolarHBondContact O-N 2.95Å; A33-L35 PolarHBondContact O-N 3.42Å; A33-L36 PolarHBondContact O-N 2.73Å; A33-D37 WeakPolarHBondContact O-CB 3.49Å; A33-D37 PolarHBondContact O-N 3.14Å
34	R	88.5	Confident	87	Confident	173 Å²	173	97 Å²	97	65%	0.653	49%	0.487	S	S	*	.	H	α-helix	trans	-65.2	-35.8	175.2	-74.7	174.7	-175.4	179.9	5	113.2	T30 S31 R32 S38	T30-R34 WeakPolarHBondContact O-CB 3.37Å; T30-R34 WeakPolarHBondContact O-CG 3.21Å; T30-R34 PolarHBondContact O-N 3.12Å; S31-R34 PolarHBondContact O-N 3.05Å; R32-R34 VanDerWaalsContact C-N 3.32Å; R32-R34 PolarHBondContact O-N 3.46Å; R34-S38 WeakPolarHBondContact O-CB 3.34Å; R34-S38 PolarHBondContact O-N 3.46Å; R34-S38 PolarHBondContact O-OG 2.93Å
35	L	90	Very high	88	Confident	118 Å²	118	98.4 Å²	98.4	62%	0.618	50%	0.501	S	S	*	.	H	α-helix	trans	-65.8	-48.7	174.9	-73.4	169.7	0	0	0	111	S31 R32 A33 D37 S38 E39	S31-L35 WeakPolarHBondContact O-CG 3.38Å; S31-L35 PolarHBondContact O-N 2.82Å; R32-L35 PolarHBondContact O-N 3.22Å; A33-L35 PolarHBondContact O-N 3.42Å; L35-D37 PolarHBondContact O-N 3.49Å; L35-S38 WeakPolarHBondContact O-CB 3.39Å; L35-S38 PolarHBondContact O-N 3.1Å; L35-S38 VanDerWaalsContact O-N 3.12Å; L35-E39 WeakPolarHBondContact O-CB 3.48Å; L35-E39 PolarHBondContact O-N 2.85Å
36	L	89.5	Confident	88.6	Confident	90 Å²	90	99.7 Å²	99.7	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-62	-41.7	177.1	-71.5	171.6	0	0	0	112.1	R32 A33 S38 E39 I40	R32-L36 PolarHBondContact O-N 3.38Å; A33-L36 PolarHBondContact O-N 2.73Å; L36-S38 VanDerWaalsContact C-N 3.27Å; L36-S38 PolarHBondContact O-N 2.8Å; L36-E39 PolarHBondContact O-N 3.22Å; L36-I40 WeakPolarHBondContact O-CB 3.45Å; L36-I40 WeakPolarHBondContact O-CG1 3.44Å; L36-I40 PolarHBondContact O-N 2.76Å
37	D	90.4	Very high	89.2	Confident	83 Å²	83	99.5 Å²	99.5	44%	0.444	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-37.3	174.3	-88.2	-17.4	0	0	0	112.2	A33 L35 R41	A33-D37 WeakPolarHBondContact O-CB 3.49Å; A33-D37 PolarHBondContact O-N 3.14Å; L35-D37 PolarHBondContact O-N 3.49Å; D37-R41 WeakPolarHBondContact O-CB 3.45Å; D37-R41 VanDerWaalsContact O-CG 3.24Å; D37-R41 WeakPolarHBondContact O-CG 3.35Å; D37-R41 PolarHBondContact O-N 2.86Å; D37-R41 VanDerWaalsContact O-N 3.1Å
38	S	90.5	Very high	89.6	Confident	72 Å²	72	99.3 Å²	99.3	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-69.9	-39.9	176.3	-58.8	0	0	0	0	111	R34 L35 L36 R41 F42	R34-S38 WeakPolarHBondContact O-CB 3.34Å; R34-S38 PolarHBondContact O-N 3.46Å; R34-S38 PolarHBondContact O-OG 2.93Å; L35-S38 WeakPolarHBondContact O-CB 3.39Å; L35-S38 PolarHBondContact O-N 3.1Å; L35-S38 VanDerWaalsContact O-N 3.12Å; L36-S38 VanDerWaalsContact C-N 3.27Å; L36-S38 PolarHBondContact O-N 2.8Å; S38-R41 PolarHBondContact O-N 3.06Å; S38-F42 WeakPolarHBondContact O-CB 3.44Å; S38-F42 PolarHBondContact O-N 3.23Å
39	E	93.3	Very high	90.1	Very high	108 Å²	108	99.6 Å²	99.6	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-67.6	-43.1	177.5	-164.1	178.5	-177.3	0	0	111.9	L35 L36 R41 F42 M43	L35-E39 WeakPolarHBondContact O-CB 3.48Å; L35-E39 PolarHBondContact O-N 2.85Å; L36-E39 PolarHBondContact O-N 3.22Å; E39-R41 PolarHBondContact O-N 3.35Å; E39-F42 WeakPolarHBondContact O-CB 3.39Å; E39-F42 PolarHBondContact O-N 2.91Å; E39-M43 HydrophobicContact CG-CE 4.22Å; E39-M43 WeakPolarHBondContact O-CB 3.48Å; E39-M43 WeakPolarHBondContact O-CG 3.36Å; E39-M43 PolarHBondContact O-N 2.77Å
40	I	92	Very high	90.7	Very high	77 Å²	77	100.1 Å²	100.1	40%	0.395	50%	0.498	S	S	.	.	H	α-helix	trans	-63	-43.6	174.8	-69.7	170	0	0	0	110.6	L36 F42 M43 Q44	L36-I40 WeakPolarHBondContact O-CB 3.45Å; L36-I40 WeakPolarHBondContact O-CG1 3.44Å; L36-I40 PolarHBondContact O-N 2.76Å; I40-F42 VanDerWaalsContact C-N 3.3Å; I40-F42 PolarHBondContact O-N 2.99Å; I40-M43 HydrophobicContact CG1-CE 4.19Å; I40-M43 PolarHBondContact O-N 3.45Å; I40-Q44 HydrophobicContact CG2-CG 4.3Å; I40-Q44 WeakPolarHBondContact O-CB 3.48Å; I40-Q44 VanDerWaalsContact O-CG 3.28Å; I40-Q44 WeakPolarHBondContact O-CG 3.24Å; I40-Q44 PolarHBondContact O-N 3.36Å
41	R	90.1	Very high	91	Very high	168 Å²	168	101 Å²	101	63%	0.634	50%	0.5	S	S	*	.	H	α-helix	trans	-61.8	-41.1	175.3	-76.5	179.9	-137.7	-174.2	3.3	111.6	D37 S38 E39 S45	D37-R41 WeakPolarHBondContact O-CB 3.45Å; D37-R41 VanDerWaalsContact O-CG 3.24Å; D37-R41 WeakPolarHBondContact O-CG 3.35Å; D37-R41 PolarHBondContact O-N 2.86Å; D37-R41 VanDerWaalsContact O-N 3.1Å; S38-R41 PolarHBondContact O-N 3.06Å; E39-R41 PolarHBondContact O-N 3.35Å; R41-S45 WeakPolarHBondContact O-CB 3.28Å; R41-S45 PolarHBondContact O-N 2.84Å
42	F	92.3	Very high	91.4	Very high	128 Å²	128	104.2 Å²	104.2	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-62	-52.3	175.2	-179	-99.1	0	0	0	111	S38 E39 I40 Q44 S45 E46	S38-F42 WeakPolarHBondContact O-CB 3.44Å; S38-F42 PolarHBondContact O-N 3.23Å; E39-F42 WeakPolarHBondContact O-CB 3.39Å; E39-F42 PolarHBondContact O-N 2.91Å; I40-F42 VanDerWaalsContact C-N 3.3Å; I40-F42 PolarHBondContact O-N 2.99Å; F42-Q44 VanDerWaalsContact C-N 3.34Å; F42-Q44 PolarHBondContact O-N 2.85Å; F42-S45 WeakPolarHBondContact O-CA 3.46Å; F42-S45 WeakPolarHBondContact O-CB 3.48Å; F42-S45 PolarHBondContact O-N 2.85Å; F42-E46 HydrophobicContact CD1-CG 4.13Å; F42-E46 HydrophobicContact CE1-CG 3.69Å; F42-E46 HydrophobicContact CE2-CG 4.27Å; F42-E46 HydrophobicContact CZ-CG 3.77Å; F42-E46 WeakPolarHBondContact O-CG 3.49Å; F42-E46 PolarHBondContact O-N 3.37Å
43	M	92.2	Very high	91.9	Very high	95 Å²	95	102.4 Å²	102.4	47%	0.468	51%	0.506	S	S	.	.	H	α-helix	trans	-59.9	-39.7	177.7	-73.2	-169.1	-72.5	0	0	113.1	E39 I40 S45 E46 L47	E39-M43 HydrophobicContact CG-CE 4.22Å; E39-M43 WeakPolarHBondContact O-CB 3.48Å; E39-M43 WeakPolarHBondContact O-CG 3.36Å; E39-M43 PolarHBondContact O-N 2.77Å; I40-M43 HydrophobicContact CG1-CE 4.19Å; I40-M43 PolarHBondContact O-N 3.45Å; M43-S45 VanDerWaalsContact C-N 3.33Å; M43-E46 PolarHBondContact O-N 3.13Å; M43-L47 WeakPolarHBondContact O-CB 3.34Å; M43-L47 WeakPolarHBondContact O-CG 3.36Å; M43-L47 PolarHBondContact O-N 3.24Å
44	Q	92.5	Very high	92.3	Very high	107 Å²	107	103.4 Å²	103.4	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-37	175.2	-75.8	-179.3	-3.2	0	0	112	I40 F42 K48	I40-Q44 HydrophobicContact CG2-CG 4.3Å; I40-Q44 WeakPolarHBondContact O-CB 3.48Å; I40-Q44 VanDerWaalsContact O-CG 3.28Å; I40-Q44 WeakPolarHBondContact O-CG 3.24Å; I40-Q44 PolarHBondContact O-N 3.36Å; F42-Q44 VanDerWaalsContact C-N 3.34Å; F42-Q44 PolarHBondContact O-N 2.85Å; Q44-K48 WeakPolarHBondContact O-CB 3.29Å; Q44-K48 VanDerWaalsContact O-CG 3.29Å; Q44-K48 WeakPolarHBondContact O-CG 3.3Å; Q44-K48 PolarHBondContact O-N 2.88Å
45	S	92.1	Very high	92.6	Very high	71 Å²	71	99.4 Å²	99.4	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-65.5	-46.7	173.8	-174.5	0	0	0	0	111.1	R41 F42 M43 K48 H49	R41-S45 WeakPolarHBondContact O-CB 3.28Å; R41-S45 PolarHBondContact O-N 2.84Å; F42-S45 WeakPolarHBondContact O-CA 3.46Å; F42-S45 WeakPolarHBondContact O-CB 3.48Å; F42-S45 PolarHBondContact O-N 2.85Å; M43-S45 VanDerWaalsContact C-N 3.33Å; S45-K48 PolarHBondContact O-N 3.04Å; S45-H49 WeakPolarHBondContact O-CB 3.43Å; S45-H49 PolarHBondContact O-N 3.36Å
46	E	93.7	Very high	92.8	Very high	83 Å²	83	96.2 Å²	96.2	39%	0.388	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.6	-72.2	-59.6	112.4	0	0	111.7	F42 M43 K48 H49 V50	F42-E46 HydrophobicContact CD1-CG 4.13Å; F42-E46 HydrophobicContact CE1-CG 3.69Å; F42-E46 HydrophobicContact CE2-CG 4.27Å; F42-E46 HydrophobicContact CZ-CG 3.77Å; F42-E46 WeakPolarHBondContact O-CG 3.49Å; F42-E46 PolarHBondContact O-N 3.37Å; M43-E46 PolarHBondContact O-N 3.13Å; E46-K48 VanDerWaalsContact C-N 3.31Å; E46-K48 PolarHBondContact O-N 3.4Å; E46-H49 WeakPolarHBondContact O-CB 3.4Å; E46-H49 PolarHBondContact O-N 3.06Å; E46-H49 VanDerWaalsContact O-N 3.13Å; E46-V50 WeakPolarHBondContact O-CG2 3.35Å; E46-V50 PolarHBondContact O-N 3.22Å
47	L	93.1	Very high	93	Very high	111 Å²	111	97.9 Å²	97.9	58%	0.581	48%	0.483	S	S	*	.	H	α-helix	trans	-60.1	-40.3	175.4	-84.6	169.5	0	0	0	112.2	M43 N51	M43-L47 WeakPolarHBondContact O-CB 3.34Å; M43-L47 WeakPolarHBondContact O-CG 3.36Å; M43-L47 PolarHBondContact O-N 3.24Å; L47-N51 VanDerWaalsContact O-CB 3.28Å; L47-N51 WeakPolarHBondContact O-CB 3.43Å; L47-N51 VanDerWaalsContact O-CG 3.29Å; L47-N51 PolarHBondContact O-N 3.03Å; L47-N51 PolarHBondContact O-ND2 2.99Å
48	K	92.7	Very high	93.2	Very high	154 Å²	154	99.8 Å²	99.8	67%	0.67	49%	0.489	S	S	*	.	H	α-helix	trans	-65.5	-41.6	174.9	-77	175.6	-177.2	177.4	0	111.4	Q44 S45 E46 H52	Q44-K48 WeakPolarHBondContact O-CB 3.29Å; Q44-K48 VanDerWaalsContact O-CG 3.29Å; Q44-K48 WeakPolarHBondContact O-CG 3.3Å; Q44-K48 PolarHBondContact O-N 2.88Å; S45-K48 PolarHBondContact O-N 3.04Å; E46-K48 VanDerWaalsContact C-N 3.31Å; E46-K48 PolarHBondContact O-N 3.4Å; K48-H52 WeakPolarHBondContact O-CB 3.47Å; K48-H52 PolarHBondContact O-N 2.92Å
49	H	93.4	Very high	93.4	Very high	99 Å²	99	100.1 Å²	100.1	46%	0.458	49%	0.489	S	S	.	.	H	α-helix	trans	-63.7	-50.8	178.7	-173.6	61.6	0	0	0	111.7	S45 E46 N51 H52 E53	S45-H49 WeakPolarHBondContact O-CB 3.43Å; S45-H49 PolarHBondContact O-N 3.36Å; E46-H49 WeakPolarHBondContact O-CB 3.4Å; E46-H49 PolarHBondContact O-N 3.06Å; E46-H49 VanDerWaalsContact O-N 3.13Å; H49-N51 VanDerWaalsContact C-N 3.35Å; H49-N51 PolarHBondContact O-N 3.41Å; H49-H52 WeakPolarHBondContact O-CB 3.47Å; H49-H52 PolarHBondContact O-N 3.24Å; H49-H52 VanDerWaalsContact O-N 3.11Å; H49-E53 IonicContact NE2-OE1 3.77Å; H49-E53 PolarHBondContact O-N 2.91Å
50	V	94.6	Very high	93.5	Very high	68 Å²	68	101.6 Å²	101.6	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-43.5	177.5	173	0	0	0	0	111.4	E46 H52 E53 I54	E46-V50 WeakPolarHBondContact O-CG2 3.35Å; E46-V50 PolarHBondContact O-N 3.22Å; V50-H52 VanDerWaalsContact C-N 3.32Å; V50-H52 PolarHBondContact O-N 3.11Å; V50-E53 PolarHBondContact O-N 3.4Å; V50-I54 HydrophobicContact CG1-CD1 3.87Å; V50-I54 HydrophobicContact CG1-CG1 4.43Å; V50-I54 VanDerWaalsContact O-CG1 3.3Å; V50-I54 WeakPolarHBondContact O-CG1 3.28Å; V50-I54 PolarHBondContact O-N 2.85Å
51	N	94	Very high	93.5	Very high	85 Å²	85	102.5 Å²	102.5	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-38.5	176	-80.5	-47.2	0	0	0	112.3	L47 H49 I54 N55	L47-N51 VanDerWaalsContact O-CB 3.28Å; L47-N51 WeakPolarHBondContact O-CB 3.43Å; L47-N51 VanDerWaalsContact O-CG 3.29Å; L47-N51 PolarHBondContact O-N 3.03Å; L47-N51 PolarHBondContact O-ND2 2.99Å; H49-N51 VanDerWaalsContact C-N 3.35Å; H49-N51 PolarHBondContact O-N 3.41Å; N51-I54 PolarHBondContact O-N 2.88Å; N51-N55 WeakPolarHBondContact O-CB 3.49Å; N51-N55 VanDerWaalsContact O-CG 3.27Å; N51-N55 PolarHBondContact O-N 3.49Å; N51-N55 VanDerWaalsContact O-N 3.07Å; N51-N55 PolarHBondContact O-ND2 3.07Å
52	H	94.1	Very high	93.7	Very high	127 Å²	127	102 Å²	102	59%	0.588	51%	0.505	S	S	*	.	H	α-helix	trans	-66.1	-40.5	175.1	-172.5	69.2	0	0	0	112.2	K48 H49 V50 N55 T56	K48-H52 WeakPolarHBondContact O-CB 3.47Å; K48-H52 PolarHBondContact O-N 2.92Å; H49-H52 WeakPolarHBondContact O-CB 3.47Å; H49-H52 PolarHBondContact O-N 3.24Å; H49-H52 VanDerWaalsContact O-N 3.11Å; V50-H52 VanDerWaalsContact C-N 3.32Å; V50-H52 PolarHBondContact O-N 3.11Å; H52-N55 PolarHBondContact O-N 3.11Å; H52-T56 WeakPolarHBondContact O-CB 3.43Å; H52-T56 PolarHBondContact O-N 3.48Å; H52-T56 PolarHBondContact O-OG1 3.37Å
53	E	95	Very high	93.8	Very high	81 Å²	81	99.9 Å²	99.9	38%	0.379	50%	0.499	S	S	.	.	H	α-helix	trans	-62.7	-44.9	174.3	-71.9	-152.3	158.2	0	0	112.5	H49 V50 N55 T56 K57	H49-E53 IonicContact NE2-OE1 3.77Å; H49-E53 PolarHBondContact O-N 2.91Å; V50-E53 PolarHBondContact O-N 3.4Å; E53-N55 PolarHBondContact O-N 2.86Å; E53-T56 PolarHBondContact O-N 3.49Å; E53-K57 WeakPolarHBondContact O-CB 3.43Å; E53-K57 WeakPolarHBondContact O-CG 3.39Å; E53-K57 PolarHBondContact O-N 3.28Å; E53-K57 IonicContact OE2-NZ 3.77Å; E53-K57 PolarHBondContact OE2-NZ 2.82Å; E53-K57 VanDerWaalsContact OE2-NZ 3.11Å
54	I	94.4	Very high	93.7	Very high	73 Å²	73	98.2 Å²	98.2	37%	0.374	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-49	178.4	-71.2	168.6	0	0	0	109.8	V50 N51 T56 K57 Q58	V50-I54 HydrophobicContact CG1-CD1 3.87Å; V50-I54 HydrophobicContact CG1-CG1 4.43Å; V50-I54 VanDerWaalsContact O-CG1 3.3Å; V50-I54 WeakPolarHBondContact O-CG1 3.28Å; V50-I54 PolarHBondContact O-N 2.85Å; N51-I54 PolarHBondContact O-N 2.88Å; I54-T56 VanDerWaalsContact C-N 3.3Å; I54-T56 PolarHBondContact O-N 3.02Å; I54-K57 PolarHBondContact O-N 3.04Å; I54-Q58 HydrophobicContact CG2-CG 4.3Å; I54-Q58 WeakPolarHBondContact O-CB 3.41Å; I54-Q58 VanDerWaalsContact O-CG 3.29Å; I54-Q58 WeakPolarHBondContact O-CG 3.29Å; I54-Q58 PolarHBondContact O-N 2.96Å
55	N	94.4	Very high	93.6	Very high	90 Å²	90	100.6 Å²	100.6	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-39.1	179.6	-73	-22.9	0	0	0	112.1	N51 H52 E53 T59	N51-N55 WeakPolarHBondContact O-CB 3.49Å; N51-N55 VanDerWaalsContact O-CG 3.27Å; N51-N55 PolarHBondContact O-N 3.49Å; N51-N55 VanDerWaalsContact O-N 3.07Å; N51-N55 PolarHBondContact O-ND2 3.07Å; H52-N55 PolarHBondContact O-N 3.11Å; E53-N55 PolarHBondContact O-N 2.86Å; N55-T59 WeakPolarHBondContact O-CB 3.37Å; N55-T59 PolarHBondContact O-N 3.14Å; N55-T59 PolarHBondContact O-OG1 3.25Å
56	T	95.1	Very high	93.5	Very high	51 Å²	51	99.9 Å²	99.9	31%	0.313	50%	0.501	S	S	.	.	H	α-helix	trans	-67.6	-45.5	177.2	-59.9	0	0	0	0	111.5	H52 E53 I54 T59 K60	H52-T56 WeakPolarHBondContact O-CB 3.43Å; H52-T56 PolarHBondContact O-N 3.48Å; H52-T56 PolarHBondContact O-OG1 3.37Å; E53-T56 PolarHBondContact O-N 3.49Å; I54-T56 VanDerWaalsContact C-N 3.3Å; I54-T56 PolarHBondContact O-N 3.02Å; T56-T59 PolarHBondContact O-N 2.84Å; T56-K60 WeakPolarHBondContact O-CG 3.29Å; T56-K60 PolarHBondContact O-N 3.29Å
57	K	94.3	Very high	93.2	Very high	125 Å²	125	102.7 Å²	102.7	54%	0.543	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-42.9	176.2	-72.9	174.1	-175.4	160.8	0	111	E53 I54 T59 K60 V61	E53-K57 WeakPolarHBondContact O-CB 3.43Å; E53-K57 WeakPolarHBondContact O-CG 3.39Å; E53-K57 PolarHBondContact O-N 3.28Å; E53-K57 IonicContact OE2-NZ 3.77Å; E53-K57 PolarHBondContact OE2-NZ 2.82Å; E53-K57 VanDerWaalsContact OE2-NZ 3.11Å; I54-K57 PolarHBondContact O-N 3.04Å; K57-T59 PolarHBondContact O-N 3.34Å; K57-K60 PolarHBondContact O-N 3.37Å; K57-V61 VanDerWaalsContact O-CG2 3.29Å; K57-V61 WeakPolarHBondContact O-CG2 3.46Å; K57-V61 PolarHBondContact O-N 3.01Å
58	Q	94.3	Very high	92.9	Very high	122 Å²	122	100.7 Å²	100.7	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-42	176.4	-76.1	-178.9	-1	0	0	112.6	I54 V61 K62	I54-Q58 HydrophobicContact CG2-CG 4.3Å; I54-Q58 WeakPolarHBondContact O-CB 3.41Å; I54-Q58 VanDerWaalsContact O-CG 3.29Å; I54-Q58 WeakPolarHBondContact O-CG 3.29Å; I54-Q58 PolarHBondContact O-N 2.96Å; Q58-V61 PolarHBondContact O-N 3.33Å; Q58-K62 WeakPolarHBondContact O-CB 3.49Å; Q58-K62 PolarHBondContact O-N 2.94Å
59	T	94	Very high	92.7	Very high	80 Å²	80	101.2 Å²	101.2	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-47.2	176.8	-55.8	0	0	0	0	110.8	N55 T56 K57 V61 K62 D63	N55-T59 WeakPolarHBondContact O-CB 3.37Å; N55-T59 PolarHBondContact O-N 3.14Å; N55-T59 PolarHBondContact O-OG1 3.25Å; T56-T59 PolarHBondContact O-N 2.84Å; K57-T59 PolarHBondContact O-N 3.34Å; T59-V61 VanDerWaalsContact C-N 3.32Å; T59-V61 PolarHBondContact O-N 2.91Å; T59-K62 WeakPolarHBondContact O-CB 3.5Å; T59-K62 PolarHBondContact O-N 3.26Å; T59-K62 VanDerWaalsContact O-N 3.14Å; T59-D63 PolarHBondContact O-N 2.94Å
60	K	94.5	Very high	92.2	Very high	138 Å²	138	103.1 Å²	103.1	60%	0.6	51%	0.514	S	S	*	.	H	α-helix	trans	-59.1	-39.7	175.4	-72.2	178.8	179	-179.1	0	112.9	T56 K57 D63 S64	T56-K60 WeakPolarHBondContact O-CG 3.29Å; T56-K60 PolarHBondContact O-N 3.29Å; K57-K60 PolarHBondContact O-N 3.37Å; K60-D63 PolarHBondContact O-N 3.34Å; K60-S64 WeakPolarHBondContact O-CB 3.41Å; K60-S64 PolarHBondContact O-N 3.46Å; K60-S64 PolarHBondContact O-OG 3.13Å
61	V	93.5	Very high	91.5	Very high	97 Å²	97	104.7 Å²	104.7	59%	0.588	52%	0.52	S	S	*	.	H	α-helix	trans	-65.6	-43.3	176.3	169.8	0	0	0	0	110.8	K57 Q58 T59 D63 S64 K65	K57-V61 VanDerWaalsContact O-CG2 3.29Å; K57-V61 WeakPolarHBondContact O-CG2 3.46Å; K57-V61 PolarHBondContact O-N 3.01Å; Q58-V61 PolarHBondContact O-N 3.33Å; T59-V61 VanDerWaalsContact C-N 3.32Å; T59-V61 PolarHBondContact O-N 2.91Å; V61-D63 PolarHBondContact O-N 3.21Å; V61-S64 PolarHBondContact O-N 3.5Å; V61-K65 WeakPolarHBondContact O-CB 3.34Å; V61-K65 PolarHBondContact O-N 3.06Å
62	K	93.8	Very high	91	Very high	158 Å²	158	104.4 Å²	104.4	69%	0.687	51%	0.514	S	S	*	.	H	α-helix	trans	-61.3	-43.8	177	-172.9	-179.7	177.4	-176.5	0	111.6	Q58 T59 K65 S66	Q58-K62 WeakPolarHBondContact O-CB 3.49Å; Q58-K62 PolarHBondContact O-N 2.94Å; T59-K62 WeakPolarHBondContact O-CB 3.5Å; T59-K62 PolarHBondContact O-N 3.26Å; T59-K62 VanDerWaalsContact O-N 3.14Å; K62-K65 PolarHBondContact O-N 2.75Å; K62-S66 PolarHBondContact O-N 3.29Å
63	D	93.4	Very high	90.4	Very high	82 Å²	82	101 Å²	101	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-67.7	-37	177.4	-66.6	-16.7	0	0	0	112.2	T59 K60 V61 S66 K67	T59-D63 PolarHBondContact O-N 2.94Å; K60-D63 PolarHBondContact O-N 3.34Å; V61-D63 PolarHBondContact O-N 3.21Å; D63-S66 PolarHBondContact O-OG 3.16Å; D63-K67 WeakPolarHBondContact O-CG 3.19Å; D63-K67 PolarHBondContact O-N 3.13Å
64	S	90.4	Very high	90	Very high	60 Å²	60	103.6 Å²	103.6	42%	0.42	52%	0.524	S	S	.	.	H	α-helix	trans	-69	-39.9	175.9	-57.9	0	0	0	0	111.2	K60 V61 S66 K67 I68	K60-S64 WeakPolarHBondContact O-CB 3.41Å; K60-S64 PolarHBondContact O-N 3.46Å; K60-S64 PolarHBondContact O-OG 3.13Å; V61-S64 PolarHBondContact O-N 3.5Å; S64-S66 PolarHBondContact O-N 3.08Å; S64-K67 PolarHBondContact O-N 3.16Å; S64-I68 VanDerWaalsContact O-CG1 3.32Å; S64-I68 WeakPolarHBondContact O-CG1 3.4Å; S64-I68 PolarHBondContact O-N 3.03Å
65	K	91.5	Very high	89.6	Confident	158 Å²	158	104.2 Å²	104.2	69%	0.687	53%	0.533	S	S	*	.	H	α-helix	trans	-66.2	-37.1	177.5	-170.3	173.1	-177	174.3	0	112.2	V61 K62 I68 K69	V61-K65 WeakPolarHBondContact O-CB 3.34Å; V61-K65 PolarHBondContact O-N 3.06Å; K62-K65 PolarHBondContact O-N 2.75Å; K65-I68 PolarHBondContact O-N 3.31Å; K65-K69 WeakPolarHBondContact O-CB 3.33Å; K65-K69 PolarHBondContact O-N 2.84Å
66	S	90	Very high	89.3	Confident	56 Å²	56	102.3 Å²	102.3	39%	0.392	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-42.1	175.2	67.1	0	0	0	0	111.5	K62 D63 S64 K69 M70	K62-S66 PolarHBondContact O-N 3.29Å; D63-S66 PolarHBondContact O-OG 3.16Å; S64-S66 PolarHBondContact O-N 3.08Å; S66-K69 PolarHBondContact O-N 3.49Å; S66-M70 WeakPolarHBondContact O-CG 3.34Å; S66-M70 PolarHBondContact O-N 3.4Å
67	K	87	Confident	89.1	Confident	141 Å²	141	101.5 Å²	101.5	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-60.9	-45.4	173	-71.3	174.3	-179.8	-178.1	0	112.5	D63 S64 K69 M70 N71	D63-K67 WeakPolarHBondContact O-CG 3.19Å; D63-K67 PolarHBondContact O-N 3.13Å; S64-K67 PolarHBondContact O-N 3.16Å; K67-K69 VanDerWaalsContact C-N 3.3Å; K67-K69 PolarHBondContact O-N 3.19Å; K67-M70 PolarHBondContact O-N 2.88Å; K67-N71 PolarHBondContact O-N 3.49Å; K67-N71 VanDerWaalsContact O-N 3.09Å
68	I	87.1	Confident	89	Confident	70 Å²	70	98.4 Å²	98.4	36%	0.359	50%	0.504	S	S	.	.	H	α-helix	trans	-61	-41.4	175.9	-68.2	165.7	0	0	0	110.6	S64 K65 M70 N71 K72 L128	S64-I68 VanDerWaalsContact O-CG1 3.32Å; S64-I68 WeakPolarHBondContact O-CG1 3.4Å; S64-I68 PolarHBondContact O-N 3.03Å; K65-I68 PolarHBondContact O-N 3.31Å; I68-M70 VanDerWaalsContact C-N 3.33Å; I68-M70 PolarHBondContact O-N 3.19Å; I68-N71 PolarHBondContact O-N 2.96Å; I68-K72 HydrophobicContact CG2-CD 4.13Å; I68-K72 HydrophobicContact CG2-CG 4.19Å; I68-K72 WeakPolarHBondContact O-CB 3.22Å; I68-K72 WeakPolarHBondContact O-CG 3.44Å; I68-K72 PolarHBondContact O-N 3.34Å; I68-L128 HydrophobicContact CG2-CD1 4.03Å
69	K	87.2	Confident	88.9	Confident	164 Å²	164	92.6 Å²	92.6	71%	0.713	48%	0.477	S	S	*	.	H	α-helix	trans	-63.4	-37.4	178.1	-172.1	179.4	178.5	-177	0	112.5	K65 S66 K67 K72	K65-K69 WeakPolarHBondContact O-CB 3.33Å; K65-K69 PolarHBondContact O-N 2.84Å; S66-K69 PolarHBondContact O-N 3.49Å; K67-K69 VanDerWaalsContact C-N 3.3Å; K67-K69 PolarHBondContact O-N 3.19Å; K69-K72 CarbonylContact O-C 3.52Å; K69-K72 PolarHBondContact O-N 3.38Å
70	M	83.5	Confident	88.9	Confident	140 Å²	140	91.4 Å²	91.4	69%	0.69	47%	0.47	S	S	*	.	H	α-helix	trans	-65.5	-40.2	174.7	-69.9	171.1	177.2	0	0	111.7	S66 K67 I68 A73	S66-M70 WeakPolarHBondContact O-CG 3.34Å; S66-M70 PolarHBondContact O-N 3.4Å; K67-M70 PolarHBondContact O-N 2.88Å; I68-M70 VanDerWaalsContact C-N 3.33Å; I68-M70 PolarHBondContact O-N 3.19Å; M70-A73 VanDerWaalsContact O-CB 3.26Å; M70-A73 WeakPolarHBondContact O-CB 3.47Å; M70-A73 PolarHBondContact O-N 3.1Å
71	N	80.6	Confident	88.9	Confident	100 Å²	100	84.8 Å²	84.8	54%	0.535	44%	0.441	S	S	.	.	H	α-helix	trans	-74.4	-27.2	176.6	-69.9	-11.3	0	0	0	113.1	K67 I68 A73	K67-N71 PolarHBondContact O-N 3.49Å; K67-N71 VanDerWaalsContact O-N 3.09Å; I68-N71 PolarHBondContact O-N 2.96Å; N71-A73 PolarHBondContact O-N 3.32Å
72	K	83	Confident	88.8	Confident	79 Å²	79	83.6 Å²	83.6	34%	0.343	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	30.8	168.8	-72.3	-164.3	178.7	-155.3	0	112.1	I68 K69 Y76 L128 L150	I68-K72 HydrophobicContact CG2-CD 4.13Å; I68-K72 HydrophobicContact CG2-CG 4.19Å; I68-K72 WeakPolarHBondContact O-CB 3.22Å; I68-K72 WeakPolarHBondContact O-CG 3.44Å; I68-K72 PolarHBondContact O-N 3.34Å; K69-K72 CarbonylContact O-C 3.52Å; K69-K72 PolarHBondContact O-N 3.38Å; K72-Y76 VanDerWaalsContact CA-OH 3.27Å; K72-Y76 WeakPolarHBondContact CA-OH 3.24Å; K72-Y76 WeakPolarHBondContact CB-OH 3.5Å; K72-Y76 PolarHBondContact O-OH 2.88Å; K72-L128 HydrophobicContact CD-CD1 4.3Å; K72-L128 HydrophobicContact CG-CD1 4.07Å; K72-L150 PolarHBondContact NZ-O 2.89Å
73	A	81.8	Confident	88.7	Confident	55 Å²	55	81 Å²	81	46%	0.455	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-77.6	132.1	171.9	0	0	0	0	0	109.6	M70 N71 Y76	M70-A73 VanDerWaalsContact O-CB 3.26Å; M70-A73 WeakPolarHBondContact O-CB 3.47Å; M70-A73 PolarHBondContact O-N 3.1Å; N71-A73 PolarHBondContact O-N 3.32Å; A73-Y76 VanDerWaalsContact O-CE1 3.25Å; A73-Y76 WeakPolarHBondContact O-CE1 3.33Å
74	L	85.4	Confident	88.5	Confident	137 Å²	137	79.1 Å²	79.1	72%	0.717	41%	0.414	S	S	*	.	S	Bend	trans	-64.6	146.4	167.2	-67.7	170.8	0	0	0	109.2	Y76	L74-Y76 HydrophobicContact CD2-CD2 3.56Å; L74-Y76 HydrophobicContact CD2-CE2 3.43Å; L74-Y76 VanDerWaalsContact CD2-CE2 3.43Å; L74-Y76 HydrophobicContact CD2-CG 4.24Å; L74-Y76 HydrophobicContact CG-CE2 4.39Å
75	P	87.1	Confident	88.3	Confident	85 Å²	85	79 Å²	79	55%	0.552	41%	0.408	S	S	*	.	P	Polyproline II helix	cis	-96.6	139.6	10.5	33.7	-34.3	0	0	0	115.5	K144	P75-K144 VanDerWaalsContact CG-NZ 3.27Å; P75-K144 WeakPolarHBondContact O-CE 3.31Å
76	Y	88	Confident	87.9	Confident	51 Å²	51	77 Å²	77	20%	0.2	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-90.3	157.5	170.3	-45.4	-49.6	0	0	0	112.3	K72 A73 L74 L150	K72-Y76 VanDerWaalsContact CA-OH 3.27Å; K72-Y76 WeakPolarHBondContact CA-OH 3.24Å; K72-Y76 WeakPolarHBondContact CB-OH 3.5Å; K72-Y76 PolarHBondContact O-OH 2.88Å; A73-Y76 VanDerWaalsContact O-CE1 3.25Å; A73-Y76 WeakPolarHBondContact O-CE1 3.33Å; L74-Y76 HydrophobicContact CD2-CD2 3.56Å; L74-Y76 HydrophobicContact CD2-CE2 3.43Å; L74-Y76 VanDerWaalsContact CD2-CE2 3.43Å; L74-Y76 HydrophobicContact CD2-CG 4.24Å; L74-Y76 HydrophobicContact CG-CE2 4.39Å; Y76-L150 HydrophobicContact CD1-CD1 3.27Å; Y76-L150 HydrophobicContact CE1-CD1 3.25Å; Y76-L150 HydrophobicContact CG-CD1 4.18Å
77	L	90.6	Very high	87	Confident	33 Å²	33	77.4 Å²	77.4	17%	0.173	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.2	166.6	-176.2	63.1	0	0	0	109.1	T115 S116 V142 K144 Y147	L77-T115 HydrophobicContact CD2-CG2 3.63Å; L77-T115 HydrophobicContact CG-CG2 4.46Å; L77-S116 WeakPolarHBondContact CD1-OG 3.17Å; L77-V142 PolarHBondContact N-O 3.24Å; L77-V142 WeakPolarHBondContact O-CA 3.33Å; L77-V142 WeakPolarHBondContact O-CB 3.46Å; L77-V142 PolarHBondContact O-N 3.43Å; L77-K144 HydrophobicContact CB-CG 4.31Å; L77-Y147 HydrophobicContact CD2-CE1 4.24Å
78	V	92.5	Very high	86	Confident	60 Å²	60	78.9 Å²	78.9	36%	0.364	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.3	175.7	-177.5	0	0	0	0	109.6	S116 L139 L153	V78-S116 PolarHBondContact O-N 2.88Å; V78-S116 PolarHBondContact O-OG 3.04Å; V78-L139 HydrophobicContact CG1-CD2 4.12Å; V78-L153 HydrophobicContact CG1-CD1 4.05Å; V78-L153 HydrophobicContact CG2-CD1 3.98Å
79	A	92.9	Very high	84.9	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.008	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	160.2	173.8	0	0	0	0	0	111.2	I113 K114 T115 V140 V142	A79-I113 HydrophobicContact CB-CB 4.28Å; A79-I113 HydrophobicContact CB-CD1 4.25Å; A79-K114 CarbonylContact C-O 3.45Å; A79-K114 VanDerWaalsContact CA-O 3.25Å; A79-K114 WeakPolarHBondContact CA-O 3.35Å; A79-K114 WeakPolarHBondContact CB-O 3.44Å; A79-T115 HydrophobicContact CB-CG2 4.42Å; A79-V140 HydrophobicContact CB-CG2 4.18Å; A79-V140 PolarHBondContact N-O 2.81Å; A79-V140 WeakPolarHBondContact O-CG2 3.39Å; A79-V140 PolarHBondContact O-N 2.76Å; A79-V142 HydrophobicContact CB-CB 4.46Å; A79-V142 HydrophobicContact CB-CG2 3.7Å
80	T	93.7	Very high	83.6	Confident	54 Å²	54	77.1 Å²	77.1	33%	0.331	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.6	172.5	-51.9	0	0	0	0	109.1	V82 I113 K114 D138	T80-V82 PolarHBondContact O-N 2.87Å; T80-I113 WeakPolarHBondContact O-CA 3.48Å; T80-K114 PolarHBondContact N-O 3.04Å; T80-K114 PolarHBondContact O-N 2.94Å; T80-D138 WeakPolarHBondContact CA-O 3.31Å
81	V	92.9	Very high	82.3	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	118	171.2	-178.2	0	0	0	0	108.2	L84 I113 L134 G137 D138 V140	V81-L84 HydrophobicContact CG1-CD2 4.36Å; V81-L84 HydrophobicContact CG1-CG 4.31Å; V81-I113 HydrophobicContact CG2-CG2 4.5Å; V81-L134 HydrophobicContact CG2-CD2 4.41Å; V81-G137 PolarHBondContact O-N 3.39Å; V81-D138 PolarHBondContact N-O 3.34Å; V81-V140 HydrophobicContact CG2-CG1 3.82Å; V81-V140 HydrophobicContact CG2-CG2 3.95Å
82	V	92.6	Very high	81	Confident	71 Å²	71	81 Å²	81	43%	0.43	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-50.1	179.3	-179.2	0	0	0	0	109.8	T80 V112 K114	T80-V82 PolarHBondContact O-N 2.87Å; V82-V112 HydrophobicContact CB-CB 4.47Å; V82-V112 HydrophobicContact CB-CG1 4.28Å; V82-V112 PolarHBondContact N-O 3.05Å; V82-K114 HydrophobicContact CG2-CB 3.67Å
83	E	91.9	Very high	79.4	Confident	103 Å²	103	84.6 Å²	84.6	48%	0.481	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	149.4	-174.2	-168.4	169.4	-171.4	0	0	110.4	L85 V112	E83-L85 HydrophobicContact CG-CD2 4.08Å; E83-L85 HydrophobicContact CG-CG 4.39Å; E83-V112 PolarHBondContact O-N 3.26Å
84	L	88.5	Confident	77.9	Confident	43 Å²	43	88.8 Å²	88.8	23%	0.225	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.5	170.2	-68.8	165.5	0	0	0	107.1	V81 C110 A111 L134	V81-L84 HydrophobicContact CG1-CD2 4.36Å; V81-L84 HydrophobicContact CG1-CG 4.31Å; L84-C110 WeakPolarHBondContact CA-O 3.41Å; L84-A111 HydrophobicContact CD2-CB 3.97Å; L84-L134 HydrophobicContact CD1-CB 4.1Å; L84-L134 VanDerWaalsContact CD1-O 3.26Å; L84-L134 WeakPolarHBondContact CD1-O 3.37Å; L84-L134 HydrophobicContact CD2-CB 4.44Å
85	L	87	Confident	76.2	Confident	57 Å²	57	91.1 Å²	91.1	30%	0.298	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.7	-177	-65	169.5	0	0	0	108.8	E83 K109 C110 V112 F122	E83-L85 HydrophobicContact CG-CD2 4.08Å; E83-L85 HydrophobicContact CG-CG 4.39Å; L85-K109 CarbonylContact O-C 3.59Å; L85-K109 WeakPolarHBondContact O-CA 3.5Å; L85-C110 HydrophobicContact CB-CB 4.42Å; L85-C110 PolarHBondContact N-O 3.38Å; L85-C110 PolarHBondContact O-N 3.29Å; L85-V112 HydrophobicContact CD1-CG2 3.84Å; L85-F122 HydrophobicContact CD1-CE2 4.21Å
86	D	82.1	Confident	74.1	Confident	116 Å²	116	96.4 Å²	96.4	62%	0.62	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	107	167.9	-64.6	-27.8	0	0	0	106.6	K109	D86-K109 WeakPolarHBondContact OD1-CE 3.44Å; D86-K109 VanDerWaalsContact OD1-CG 3.24Å; D86-K109 WeakPolarHBondContact OD1-CG 3.32Å
87	V	71.9	Confident	72.1	Confident	65 Å²	65	97.8 Å²	97.8	39%	0.394	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	114.5	179	-177.7	0	0	0	0	108.2	C110	V87-C110 HydrophobicContact CG2-CB 4.21Å
88	E	66.8	Low	70.1	Confident	172 Å²	172	100.8 Å²	100.8	80%	0.804	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-82	133.7	166.3	-65.8	-174.9	170.2	0	0	108.6	Q90	E88-Q90 PolarHBondContact O-N 3.4Å
89	P	63.7	Low	68.1	Low	45 Å²	45	105.2 Å²	105.2	29%	0.292	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-62.1	126.9	177.5	24.8	-31.7	0	0	0	109.2	E91 K107	P89-E91 PolarHBondContact O-N 2.84Å; P89-K107 HydrophobicContact CG-CG 4.1Å
90	Q	58.8	Low	66.2	Low	152 Å²	152	110.4 Å²	110.4	71%	0.71	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-64.8	120.4	168.4	-100.2	170	-30.2	0	0	108.4	E88 D92	E88-Q90 PolarHBondContact O-N 3.4Å; Q90-D92 PolarHBondContact O-N 3.02Å
91	E	56.7	Low	64.3	Low	173 Å²	173	113.4 Å²	113.4	81%	0.808	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-10.4	-179.3	-65.2	-171.7	154.1	0	0	112.8	P89	P89-E91 PolarHBondContact O-N 2.84Å
92	D	53.4	Low	62.7	Low	148 Å²	148	119.3 Å²	119.3	79%	0.791	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	1.8	-163.5	-63.5	-35.6	0	0	0	116.3	Q90	Q90-D92 PolarHBondContact O-N 3.02Å
93	E	48.9	Very low	60.9	Low	156 Å²	156	119.9 Å²	119.9	73%	0.729	64%	0.643	S	S	*	*			trans	-111.9	21.4	-177.8	-74	-168	164.7	0	0	115.1	E95	E93-E95 PolarHBondContact O-N 3.28Å; E93-E95 VanDerWaalsContact O-N 3.16Å
94	I	50.7	Low	59.2	Low	143 Å²	143	118.4 Å²	118.4	73%	0.733	64%	0.644	S	S	*	*			trans	-82.1	17.1	179.3	-55.5	164.2	0	0	0	112.2	E96	I94-E96 PolarHBondContact O-N 2.89Å; I94-E96 VanDerWaalsContact O-N 3.13Å
95	E	50.3	Low	57.5	Low	185 Å²	185	122.1 Å²	122.1	86%	0.864	66%	0.66	S	S	*	*			trans	-76.1	104.2	176.2	-73.5	-167.6	165.1	0	0	112.1	E93	E93-E95 PolarHBondContact O-N 3.28Å; E93-E95 VanDerWaalsContact O-N 3.16Å
96	E	41.6	Very low	56.2	Low	196 Å²	196	124.9 Å²	124.9	92%	0.916	67%	0.666	S	S	*	*	S	Bend	trans	17.5	112	147.9	-60.8	-172.7	156.7	0	0	118.1	I94	I94-E96 PolarHBondContact O-N 2.89Å; I94-E96 VanDerWaalsContact O-N 3.13Å
97	G	46	Very low	55.2	Low	81 Å²	81	127.9 Å²	127.9	84%	0.835	67%	0.674	S	S	*	*	S	Bend	trans	117.1	47.1	140.5	0	0	0	0	0	119.1
98	A	48.3	Very low	55.1	Low	95 Å²	95	126.5 Å²	126.5	79%	0.785	67%	0.673	S	S	*	*	S	Bend	trans	178.1	116.3	140.8	0	0	0	0	0	108.2
99	N	51.7	Low	55.7	Low	153 Å²	153	122.6 Å²	122.6	82%	0.818	65%	0.653	S	S	*	*			trans	33.4	93.3	175.8	-76.1	-11.8	0	0	0	115.6	D101	N99-D101 PolarHBondContact O-N 3.18Å
100	V	51.7	Low	56.8	Low	110 Å²	110	120.9 Å²	120.9	67%	0.667	64%	0.642	S	S	*	*			trans	-53.6	106.4	167.7	-173.3	0	0	0	0	108.5	L102	V100-L102 PolarHBondContact O-N 3.13Å
101	D	55.3	Low	58.2	Low	118 Å²	118	113.7 Å²	113.7	63%	0.631	61%	0.608	S	S	*	*			trans	-63.5	111.8	175.7	-90.6	-28.4	0	0	0	107.8	N99 D103 S104	N99-D101 PolarHBondContact O-N 3.18Å; D101-D103 PolarHBondContact O-N 3.25Å; D101-S104 PolarHBondContact O-N 2.97Å; D101-S104 PolarHBondContact O-OG 3.41Å
102	L	58.5	Low	60	Low	124 Å²	124	106.9 Å²	106.9	65%	0.649	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-8.4	176.1	-79.5	155	0	0	0	113.4	V100 R106	V100-L102 PolarHBondContact O-N 3.13Å; L102-R106 WeakPolarHBondContact O-CG 3.43Å; L102-R106 PolarHBondContact O-NE 2.9Å; L102-R106 VanDerWaalsContact O-NE 3.13Å
103	D	55.7	Low	61.9	Low	83 Å²	83	99.8 Å²	99.8	44%	0.444	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-27.5	177.3	-75	-10.2	0	0	0	112.8	D101 R106	D101-D103 PolarHBondContact O-N 3.25Å; D103-R106 IonicContact OD1-CZ 2.84Å; D103-R106 VanDerWaalsContact OD1-CZ 3.27Å; D103-R106 IonicContact OD1-NE 3.81Å; D103-R106 IonicContact OD1-NH1 3.65Å; D103-R106 IonicContact OD1-NH2 3.92Å; D103-R106 PolarHBondContact OD1-NH2 2.93Å; D103-R106 VanDerWaalsContact OD1-NH2 3.13Å
104	S	54.7	Low	64	Low	72 Å²	72	97 Å²	97	50%	0.503	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-18.6	178.2	57.8	0	0	0	0	113.7	D101	D101-S104 PolarHBondContact O-N 2.97Å; D101-S104 PolarHBondContact O-OG 3.41Å
105	Q	53.6	Low	66.1	Low	120 Å²	120	90.5 Å²	90.5	56%	0.561	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.9	178.5	-65.6	-171.2	-5	0	0	114.2	K107	Q105-K107 PolarHBondContact O-N 3.48Å; Q105-K107 VanDerWaalsContact O-N 3.16Å
106	R	59.2	Low	67.9	Low	115 Å²	115	85.5 Å²	85.5	43%	0.434	48%	0.478	S	S	.	.			trans	-81.1	103.9	-174.7	-73.8	178.7	-157.4	-177.6	13.6	111	L102 D103 G108	L102-R106 WeakPolarHBondContact O-CG 3.43Å; L102-R106 PolarHBondContact O-NE 2.9Å; L102-R106 VanDerWaalsContact O-NE 3.13Å; D103-R106 IonicContact OD1-CZ 2.84Å; D103-R106 VanDerWaalsContact OD1-CZ 3.27Å; D103-R106 IonicContact OD1-NE 3.81Å; D103-R106 IonicContact OD1-NH1 3.65Å; D103-R106 IonicContact OD1-NH2 3.92Å; D103-R106 PolarHBondContact OD1-NH2 2.93Å; D103-R106 VanDerWaalsContact OD1-NH2 3.13Å; R106-G108 PolarHBondContact O-N 3.5Å; R106-G108 VanDerWaalsContact O-N 3.08Å
107	K	61.6	Low	70.3	Confident	180 Å²	180	80.1 Å²	80.1	78%	0.783	46%	0.459	S	S	*	.			trans	-65.4	103	155.5	-68.4	-174.1	178.9	-173.1	0	107.9	P89 Q105	P89-K107 HydrophobicContact CG-CG 4.1Å; Q105-K107 PolarHBondContact O-N 3.48Å; Q105-K107 VanDerWaalsContact O-N 3.16Å
108	G	69.5	Low	72.4	Confident	36 Å²	36	86.6 Å²	86.6	37%	0.371	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	159.6	-177.1	0	0	0	0	0	112.4	R106	R106-G108 PolarHBondContact O-N 3.5Å; R106-G108 VanDerWaalsContact O-N 3.08Å
109	K	80.9	Confident	74.5	Confident	90 Å²	90	86.7 Å²	86.7	39%	0.391	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	125.2	173.4	-55	-160.8	153.1	-179.6	0	108.8	L85 D86 I126 P131	L85-K109 CarbonylContact O-C 3.59Å; L85-K109 WeakPolarHBondContact O-CA 3.5Å; D86-K109 WeakPolarHBondContact OD1-CE 3.44Å; D86-K109 VanDerWaalsContact OD1-CG 3.24Å; D86-K109 WeakPolarHBondContact OD1-CG 3.32Å; K109-I126 HydrophobicContact CB-CD1 3.92Å; K109-I126 WeakPolarHBondContact O-CD1 3.45Å; K109-I126 WeakPolarHBondContact O-CG1 3.44Å; K109-P131 HydrophobicContact CB-CB 3.98Å; K109-P131 HydrophobicContact CB-CG 4.39Å; K109-P131 HydrophobicContact CD-CB 3.54Å; K109-P131 HydrophobicContact CD-CG 3.98Å; K109-P131 HydrophobicContact CG-CB 4.16Å; K109-P131 HydrophobicContact CG-CG 4.36Å
110	C	85.8	Confident	76.5	Confident	9 Å²	9	84 Å²	84	6%	0.061	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	156	171.1	-58.1	0	0	0	0	109.6	L84 L85 V87 F122 L123	L84-C110 WeakPolarHBondContact CA-O 3.41Å; L85-C110 HydrophobicContact CB-CB 4.42Å; L85-C110 PolarHBondContact N-O 3.38Å; L85-C110 PolarHBondContact O-N 3.29Å; V87-C110 HydrophobicContact CG2-CB 4.21Å; C110-F122 HydrophobicContact CB-CE2 3.63Å; C110-F122 HydrophobicContact CB-CZ 3.69Å; C110-L123 WeakPolarHBondContact CA-O 3.42Å; C110-L123 WeakPolarHBondContact CB-O 3.04Å
111	A	89.3	Confident	78.4	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.6	176.7	0	0	0	0	0	110.7	L84 L123 I126 I149	L84-A111 HydrophobicContact CD2-CB 3.97Å; A111-L123 PolarHBondContact N-O 3.34Å; A111-L123 VanDerWaalsContact N-O 3.1Å; A111-L123 WeakPolarHBondContact O-CB 3.26Å; A111-L123 PolarHBondContact O-N 3.09Å; A111-I126 HydrophobicContact CB-CG1 4.14Å; A111-I149 HydrophobicContact CB-CD1 4.38Å
112	V	92.8	Very high	80.1	Confident	30 Å²	30	81.3 Å²	81.3	18%	0.182	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	118	166.4	-178.4	0	0	0	0	107.6	V82 E83 L85 F122	V82-V112 HydrophobicContact CB-CB 4.47Å; V82-V112 HydrophobicContact CB-CG1 4.28Å; V82-V112 PolarHBondContact N-O 3.05Å; E83-V112 PolarHBondContact O-N 3.26Å; L85-V112 HydrophobicContact CD1-CG2 3.84Å; V112-F122 HydrophobicContact CG2-CD2 4.18Å
113	I	93.4	Very high	81.5	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.1	177.8	60.9	160.5	0	0	0	110.8	A79 T80 V81 T120 Y121 L123 V142 I149	A79-I113 HydrophobicContact CB-CB 4.28Å; A79-I113 HydrophobicContact CB-CD1 4.25Å; T80-I113 WeakPolarHBondContact O-CA 3.48Å; V81-I113 HydrophobicContact CG2-CG2 4.5Å; I113-T120 CarbonylContact O-C 3.57Å; I113-T120 VanDerWaalsContact O-CA 3.29Å; I113-T120 WeakPolarHBondContact O-CA 3.35Å; I113-Y121 PolarHBondContact N-O 3.39Å; I113-Y121 PolarHBondContact O-N 3.23Å; I113-L123 HydrophobicContact CD1-CD1 3.77Å; I113-L123 HydrophobicContact CD1-CG 4.37Å; I113-L123 HydrophobicContact CG1-CD1 3.89Å; I113-L123 HydrophobicContact CG1-CG 4.26Å; I113-L123 HydrophobicContact CG2-CD1 3.95Å; I113-V142 HydrophobicContact CD1-CG1 3.99Å; I113-V142 HydrophobicContact CD1-CG2 3.85Å; I113-I149 HydrophobicContact CG2-CD1 3.98Å; I113-I149 HydrophobicContact CG2-CG1 4.34Å
114	K	94.7	Very high	82.8	Confident	98 Å²	98	74 Å²	74	43%	0.426	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.4	171	-173.7	173.7	-177.8	174.5	0	109.4	A79 T80 V82 Q119 T120	A79-K114 CarbonylContact C-O 3.45Å; A79-K114 VanDerWaalsContact CA-O 3.25Å; A79-K114 WeakPolarHBondContact CA-O 3.35Å; A79-K114 WeakPolarHBondContact CB-O 3.44Å; T80-K114 PolarHBondContact N-O 3.04Å; T80-K114 PolarHBondContact O-N 2.94Å; V82-K114 HydrophobicContact CG2-CB 3.67Å; K114-Q119 CarbonylContact C-O 3.55Å; K114-Q119 WeakPolarHBondContact CA-O 3.48Å; K114-T120 HydrophobicContact CB-CG2 4.21Å; K114-T120 HydrophobicContact CD-CG2 4.36Å; K114-T120 HydrophobicContact CG-CG2 4.09Å
115	T	93.1	Very high	84.1	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.031	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	161.2	-180	59.6	0	0	0	0	111.6	L77 A79 T117 R118 Q119 Y121 Y147	L77-T115 HydrophobicContact CD2-CG2 3.63Å; L77-T115 HydrophobicContact CG-CG2 4.46Å; A79-T115 HydrophobicContact CB-CG2 4.42Å; T115-T117 PolarHBondContact O-N 2.81Å; T115-T117 VanDerWaalsContact O-N 3.16Å; T115-T117 PolarHBondContact OG1-OG1 2.92Å; T115-R118 WeakPolarHBondContact O-CA 3.42Å; T115-R118 PolarHBondContact O-N 2.86Å; T115-Q119 PolarHBondContact N-O 2.88Å; T115-Q119 PolarHBondContact OG1-N 3.1Å; T115-Q119 PolarHBondContact OG1-O 2.8Å; T115-Y121 HydrophobicContact CG2-CD2 3.78Å; T115-Y121 HydrophobicContact CG2-CE2 3.78Å; T115-Y147 HydrophobicContact CG2-CD1 4.34Å; T115-Y147 HydrophobicContact CG2-CE1 4.39Å
116	S	88.9	Confident	85.5	Confident	80 Å²	80	68.3 Å²	68.3	56%	0.559	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.2	170.1	59.2	0	0	0	0	113.3	L77 V78 R118	L77-S116 WeakPolarHBondContact CD1-OG 3.17Å; V78-S116 PolarHBondContact O-N 2.88Å; V78-S116 PolarHBondContact O-OG 3.04Å; S116-R118 PolarHBondContact O-N 2.89Å
117	T	90.9	Very high	86.7	Confident	83 Å²	83	64.5 Å²	64.5	51%	0.509	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	7.3	171.5	58.3	0	0	0	0	113.9	T115 Q119	T115-T117 PolarHBondContact O-N 2.81Å; T115-T117 VanDerWaalsContact O-N 3.16Å; T115-T117 PolarHBondContact OG1-OG1 2.92Å; T117-Q119 PolarHBondContact O-N 3.33Å
118	R	90.1	Very high	87.8	Confident	218 Å²	218	59.9 Å²	59.9	82%	0.823	32%	0.318	S	S	*	.	S	Bend	trans	64.9	18.7	-180	-52.5	179.4	-178.6	-180	0.3	114.9	T115 S116	T115-R118 WeakPolarHBondContact O-CA 3.42Å; T115-R118 PolarHBondContact O-N 2.86Å; S116-R118 PolarHBondContact O-N 2.89Å
119	Q	93.2	Very high	88.7	Confident	96 Å²	96	58.9 Å²	58.9	45%	0.449	31%	0.305	S	S	.	.			trans	-92.8	143.2	173.5	-67.5	173	-27.4	0	0	109.9	K114 T115 T117 Y121	K114-Q119 CarbonylContact C-O 3.55Å; K114-Q119 WeakPolarHBondContact CA-O 3.48Å; T115-Q119 PolarHBondContact N-O 2.88Å; T115-Q119 PolarHBondContact OG1-N 3.1Å; T115-Q119 PolarHBondContact OG1-O 2.8Å; T117-Q119 PolarHBondContact O-N 3.33Å; Q119-Y121 HydrophobicContact CB-CD2 4.34Å; Q119-Y121 HydrophobicContact CB-CE2 3.59Å; Q119-Y121 PolarHBondContact OE1-OH 2.99Å
120	T	93.8	Very high	89	Confident	96 Å²	96	57.2 Å²	57.2	59%	0.589	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.5	177	48.1	0	0	0	0	109.6	I113 K114	I113-T120 CarbonylContact O-C 3.57Å; I113-T120 VanDerWaalsContact O-CA 3.29Å; I113-T120 WeakPolarHBondContact O-CA 3.35Å; K114-T120 HydrophobicContact CB-CG2 4.21Å; K114-T120 HydrophobicContact CD-CG2 4.36Å; K114-T120 HydrophobicContact CG-CG2 4.09Å
121	Y	92.5	Very high	88.9	Confident	59 Å²	59	58.8 Å²	58.8	23%	0.231	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.3	177.6	-66.4	-86.6	0	0	0	109.8	I113 T115 Q119 Y147	I113-Y121 PolarHBondContact N-O 3.39Å; I113-Y121 PolarHBondContact O-N 3.23Å; T115-Y121 HydrophobicContact CG2-CD2 3.78Å; T115-Y121 HydrophobicContact CG2-CE2 3.78Å; Q119-Y121 HydrophobicContact CB-CD2 4.34Å; Q119-Y121 HydrophobicContact CB-CE2 3.59Å; Q119-Y121 PolarHBondContact OE1-OH 2.99Å; Y121-Y147 HydrophobicContact CD1-CD1 4.47Å; Y121-Y147 HydrophobicContact CD1-CD2 4.08Å; Y121-Y147 HydrophobicContact CD1-CE2 4.31Å; Y121-Y147 HydrophobicContact CD1-CG 4.16Å; Y121-Y147 AromaticContact CD2-CD1 3.88Å; Y121-Y147 HydrophobicContact CD2-CD1 3.88Å; Y121-Y147 HydrophobicContact CD2-CE1 4.09Å; Y121-Y147 HydrophobicContact CD2-CG 4.29Å; Y121-Y147 HydrophobicContact CE1-CD1 4.4Å; Y121-Y147 AromaticContact CE1-CD2 3.96Å; Y121-Y147 HydrophobicContact CE1-CD2 3.96Å; Y121-Y147 HydrophobicContact CE1-CE1 4.18Å; Y121-Y147 AromaticContact CE1-CE2 3.71Å; Y121-Y147 HydrophobicContact CE1-CE2 3.71Å; Y121-Y147 HydrophobicContact CE1-CG 4.29Å; Y121-Y147 AromaticContact CE1-CZ 3.83Å; Y121-Y147 AromaticContact CE2-CD1 3.79Å; Y121-Y147 HydrophobicContact CE2-CD1 3.79Å; Y121-Y147 AromaticContact CE2-CE1 3.5Å; Y121-Y147 HydrophobicContact CE2-CE1 3.5Å; Y121-Y147 VanDerWaalsContact CE2-CE1 3.5Å; Y121-Y147 HydrophobicContact CE2-CG 4.41Å; Y121-Y147 AromaticContact CE2-CZ 3.9Å; Y121-Y147 HydrophobicContact CG-CD1 4.22Å; Y121-Y147 HydrophobicContact CG-CG 4.17Å; Y121-Y147 AromaticContact CZ-CE1 3.56Å; Y121-Y147 AromaticContact CZ-CE2 3.84Å; Y121-Y147 AromaticContact CZ-CZ 3.42Å; Y121-Y147 VanDerWaalsContact CZ-CZ 3.42Å; Y121-Y147 PolarHBondContact OH-OH 3.25Å; Y121-Y147 VanDerWaalsContact OH-OH 3.11Å
122	F	90.6	Very high	88.9	Confident	113 Å²	113	67 Å²	67	50%	0.496	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126	168.9	175.5	-100.7	0	0	0	108.8	L85 C110 V112 P124	L85-F122 HydrophobicContact CD1-CE2 4.21Å; C110-F122 HydrophobicContact CB-CE2 3.63Å; C110-F122 HydrophobicContact CB-CZ 3.69Å; V112-F122 HydrophobicContact CG2-CD2 4.18Å; F122-P124 HydrophobicContact CE1-CB 4.15Å
123	L	86.9	Confident	88.6	Confident	9 Å²	9	70.9 Å²	70.9	5%	0.047	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	107.5	178.4	-63.9	173.2	0	0	0	109.1	C110 A111 I113 V125 Y147 I149	C110-L123 WeakPolarHBondContact CA-O 3.42Å; C110-L123 WeakPolarHBondContact CB-O 3.04Å; A111-L123 PolarHBondContact N-O 3.34Å; A111-L123 VanDerWaalsContact N-O 3.1Å; A111-L123 WeakPolarHBondContact O-CB 3.26Å; A111-L123 PolarHBondContact O-N 3.09Å; I113-L123 HydrophobicContact CD1-CD1 3.77Å; I113-L123 HydrophobicContact CD1-CG 4.37Å; I113-L123 HydrophobicContact CG1-CD1 3.89Å; I113-L123 HydrophobicContact CG1-CG 4.26Å; I113-L123 HydrophobicContact CG2-CD1 3.95Å; L123-V125 PolarHBondContact O-N 3.45Å; L123-Y147 VanDerWaalsContact CD1-O 3.3Å; L123-Y147 WeakPolarHBondContact CD1-O 3.33Å; L123-Y147 VanDerWaalsContact CD2-O 3.25Å; L123-Y147 WeakPolarHBondContact CD2-O 3.27Å; L123-I149 HydrophobicContact CD1-CD1 4.17Å; L123-I149 HydrophobicContact CD1-CG1 4.05Å
124	P	82.6	Confident	88.4	Confident	44 Å²	44	71.1 Å²	71.1	29%	0.286	37%	0.369	S	S	.	.	S	Bend	trans	-66.4	-22.3	170.9	26.9	-32.9	0	0	0	111.4	F122	F122-P124 HydrophobicContact CE1-CB 4.15Å
125	V	83.9	Confident	88.1	Confident	61 Å²	61	73.1 Å²	73.1	37%	0.37	38%	0.378	S	S	.	.	S	Bend	trans	-124.5	118.5	174.2	-175.2	0	0	0	0	109.7	L123 G127 L148	L123-V125 PolarHBondContact O-N 3.45Å; V125-G127 PolarHBondContact O-N 2.69Å; V125-L148 WeakPolarHBondContact O-CD2 3.26Å
126	I	81.6	Confident	88	Confident	13 Å²	13	77.1 Å²	77.1	7%	0.067	40%	0.404	C	S	.	.			trans	-59.4	-47.2	-177.4	-62.5	172.9	0	0	0	111	K109 A111 P131 L134 I149	K109-I126 HydrophobicContact CB-CD1 3.92Å; K109-I126 WeakPolarHBondContact O-CD1 3.45Å; K109-I126 WeakPolarHBondContact O-CG1 3.44Å; A111-I126 HydrophobicContact CB-CG1 4.14Å; I126-P131 HydrophobicContact CD1-CB 3.48Å; I126-P131 VanDerWaalsContact CD1-CB 3.48Å; I126-P131 HydrophobicContact CD1-CG 4.1Å; I126-L134 HydrophobicContact CG2-CD1 3.55Å; I126-I149 HydrophobicContact CG2-CD1 3.85Å; I126-I149 WeakPolarHBondContact O-CB 3.06Å; I126-I149 PolarHBondContact O-N 3.2Å
127	G	83.8	Confident	87.9	Confident	35 Å²	35	75.8 Å²	75.8	36%	0.361	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	125.2	-131.7	178.9	0	0	0	0	0	112.3	V125 I149	V125-G127 PolarHBondContact O-N 2.69Å; G127-I149 WeakPolarHBondContact CA-O 3.32Å
128	L	85.6	Confident	87.9	Confident	83 Å²	83	73.5 Å²	73.5	44%	0.435	39%	0.387	S	S	.	.	S	Bend	trans	-90.9	-10.7	-173.2	-65.6	175.1	0	0	0	114.3	I68 K72 I149 L150	I68-L128 HydrophobicContact CG2-CD1 4.03Å; K72-L128 HydrophobicContact CD-CD1 4.3Å; K72-L128 HydrophobicContact CG-CD1 4.07Å; L128-I149 PolarHBondContact N-O 2.81Å; L128-L150 HydrophobicContact CD1-CD2 3.89Å
129	V	87.7	Confident	88	Confident	14 Å²	14	64.7 Å²	64.7	9%	0.085	36%	0.356	C	S	.	.	S	Bend	trans	-99.1	133.4	-179.3	-179.3	0	0	0	0	109.2	L134 I149 K152	V129-L134 HydrophobicContact CG1-CD1 4.44Å; V129-L134 HydrophobicContact CG1-CD2 3.91Å; V129-L134 HydrophobicContact CG1-CG 4.03Å; V129-I149 HydrophobicContact CB-CG2 4.16Å; V129-I149 HydrophobicContact CG2-CG2 3.84Å; V129-K152 HydrophobicContact CG1-CB 4.47Å
130	P	87.5	Confident	87.9	Confident	56 Å²	56	60.1 Å²	60.1	36%	0.364	34%	0.335	S	S	.	.			trans	-65.2	141.1	177.5	27.2	-34.6	0	0	0	111.3	E132 E133	P130-E132 PolarHBondContact O-N 2.69Å; P130-E133 HydrophobicContact CG-CB 4.24Å; P130-E133 VanDerWaalsContact CG-CD 3.45Å; P130-E133 HydrophobicContact CG-CG 3.78Å; P130-E133 PolarHBondContact O-N 2.73Å
131	P	85.1	Confident	87.9	Confident	42 Å²	42	55.6 Å²	55.6	27%	0.273	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-59.7	-28.1	-179.7	15.7	-26.9	0	0	0	114.3	K109 I126 E133 L134	K109-P131 HydrophobicContact CB-CB 3.98Å; K109-P131 HydrophobicContact CB-CG 4.39Å; K109-P131 HydrophobicContact CD-CB 3.54Å; K109-P131 HydrophobicContact CD-CG 3.98Å; K109-P131 HydrophobicContact CG-CB 4.16Å; K109-P131 HydrophobicContact CG-CG 4.36Å; I126-P131 HydrophobicContact CD1-CB 3.48Å; I126-P131 VanDerWaalsContact CD1-CB 3.48Å; I126-P131 HydrophobicContact CD1-CG 4.1Å; P131-E133 VanDerWaalsContact C-N 3.26Å; P131-E133 PolarHBondContact O-N 2.93Å; P131-L134 PolarHBondContact O-N 2.82Å
132	E	87.3	Confident	87.8	Confident	172 Å²	172	52.8 Å²	52.8	80%	0.804	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-68.5	-26.4	-176	-62.7	175	-175.4	0	0	112.7	P130	P130-E132 PolarHBondContact O-N 2.69Å
133	E	87.8	Confident	87.8	Confident	111 Å²	111	49.6 Å²	49.6	52%	0.519	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-84.3	-15.6	178.6	-70	179.8	-176.4	0	0	112.9	P130 P131 K152	P130-E133 HydrophobicContact CG-CB 4.24Å; P130-E133 VanDerWaalsContact CG-CD 3.45Å; P130-E133 HydrophobicContact CG-CG 3.78Å; P130-E133 PolarHBondContact O-N 2.73Å; P131-E133 VanDerWaalsContact C-N 3.26Å; P131-E133 PolarHBondContact O-N 2.93Å; E133-K152 PolarHBondContact O-NZ 3.24Å
134	L	88.4	Confident	87.7	Confident	6 Å²	6	54 Å²	54	3%	0.031	30%	0.302	C	S	.	.			trans	-89.2	136.1	-177.5	-64.9	177.4	0	0	0	110.5	V81 L84 I126 V129 P131 V140 I149 K152	V81-L134 HydrophobicContact CG2-CD2 4.41Å; L84-L134 HydrophobicContact CD1-CB 4.1Å; L84-L134 VanDerWaalsContact CD1-O 3.26Å; L84-L134 WeakPolarHBondContact CD1-O 3.37Å; L84-L134 HydrophobicContact CD2-CB 4.44Å; I126-L134 HydrophobicContact CG2-CD1 3.55Å; V129-L134 HydrophobicContact CG1-CD1 4.44Å; V129-L134 HydrophobicContact CG1-CD2 3.91Å; V129-L134 HydrophobicContact CG1-CG 4.03Å; P131-L134 PolarHBondContact O-N 2.82Å; L134-V140 HydrophobicContact CD2-CG1 3.74Å; L134-I149 HydrophobicContact CD1-CD1 4.06Å; L134-K152 HydrophobicContact CD2-CD 4.44Å
135	K	89.5	Confident	87.9	Confident	139 Å²	139	58.2 Å²	58.2	60%	0.604	32%	0.322	S	S	*	.			trans	-126.3	150.6	172.1	-63.5	-178.3	-177.6	179	0	109.9	G137 D138	K135-G137 PolarHBondContact O-N 2.83Å; K135-D138 PolarHBondContact N-OD2 3.44Å; K135-D138 WeakPolarHBondContact O-CB 3.39Å; K135-D138 PolarHBondContact O-N 2.99Å
136	P	90	Very high	88	Confident	90 Å²	90	58.3 Å²	58.3	58%	0.584	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	126.6	168.4	-27.5	36.6	0	0	0	110.9
137	G	87.4	Confident	88.3	Confident	52 Å²	52	60.5 Å²	60.5	54%	0.536	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.6	-9.7	-176.6	0	0	0	0	0	115.4	V81 K135	V81-G137 PolarHBondContact O-N 3.39Å; K135-G137 PolarHBondContact O-N 2.83Å
138	D	90.5	Very high	88.6	Confident	34 Å²	34	62 Å²	62	18%	0.182	33%	0.332	C	S	.	.			trans	-66.5	141.9	177.6	-76.3	-19.1	0	0	0	111.8	T80 V81 K135 K152	T80-D138 WeakPolarHBondContact CA-O 3.31Å; V81-D138 PolarHBondContact N-O 3.34Å; K135-D138 PolarHBondContact N-OD2 3.44Å; K135-D138 WeakPolarHBondContact O-CB 3.39Å; K135-D138 PolarHBondContact O-N 2.99Å; D138-K152 IonicContact OD1-NZ 3.66Å; D138-K152 WeakPolarHBondContact OD2-CE 3.39Å; D138-K152 IonicContact OD2-NZ 3.27Å; D138-K152 PolarHBondContact OD2-NZ 2.78Å
139	L	91.4	Very high	88.8	Confident	33 Å²	33	58 Å²	58	17%	0.173	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.2	171.9	-68.9	167.9	0	0	0	109.9	V78 L153 E156	V78-L139 HydrophobicContact CG1-CD2 4.12Å; L139-L153 HydrophobicContact CB-CB 4.11Å; L139-L153 PolarHBondContact O-N 3.35Å; L139-E156 HydrophobicContact CD1-CB 3.51Å
140	V	93	Very high	88.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.9	-177.5	-68.4	0	0	0	0	111	A79 V81 L134 V142 I149	A79-V140 HydrophobicContact CB-CG2 4.18Å; A79-V140 PolarHBondContact N-O 2.81Å; A79-V140 WeakPolarHBondContact O-CG2 3.39Å; A79-V140 PolarHBondContact O-N 2.76Å; V81-V140 HydrophobicContact CG2-CG1 3.82Å; V81-V140 HydrophobicContact CG2-CG2 3.95Å; L134-V140 HydrophobicContact CD2-CG1 3.74Å; V140-V142 HydrophobicContact CG2-CG2 4.01Å; V140-I149 HydrophobicContact CB-CG1 4.48Å; V140-I149 HydrophobicContact CB-CG2 3.86Å; V140-I149 HydrophobicContact CG1-CG2 3.99Å; V140-I149 HydrophobicContact CG2-CD1 4.45Å; V140-I149 HydrophobicContact CG2-CG1 4.16Å; V140-I149 HydrophobicContact CG2-CG2 4.46Å
141	G	91.9	Very high	88.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	123.2	170.9	0	0	0	0	0	109.8	L150 E151	G141-L150 PolarHBondContact O-N 3.22Å; G141-E151 PolarHBondContact N-O 3.04Å
142	V	91.4	Very high	89.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.4	-173.1	172.9	0	0	0	0	110.1	L77 A79 I113 V140 Y147 L148 I149	L77-V142 PolarHBondContact N-O 3.24Å; L77-V142 WeakPolarHBondContact O-CA 3.33Å; L77-V142 WeakPolarHBondContact O-CB 3.46Å; L77-V142 PolarHBondContact O-N 3.43Å; A79-V142 HydrophobicContact CB-CB 4.46Å; A79-V142 HydrophobicContact CB-CG2 3.7Å; I113-V142 HydrophobicContact CD1-CG1 3.99Å; I113-V142 HydrophobicContact CD1-CG2 3.85Å; V140-V142 HydrophobicContact CG2-CG2 4.01Å; V142-Y147 HydrophobicContact CG1-CD1 4.28Å; V142-Y147 WeakPolarHBondContact CG1-O 3.48Å; V142-L148 WeakPolarHBondContact CA-O 3.42Å; V142-I149 HydrophobicContact CG2-CG1 4.23Å
143	H	89.5	Confident	89.3	Confident	47 Å²	47	55.4 Å²	55.4	22%	0.218	29%	0.29	C	S	.	.			trans	-67.4	138.4	173.6	-168.4	-81.8	0	0	0	110.8	D145 S146 Y147 L148 L150	H143-D145 IonicContact CE1-OD2 3.13Å; H143-D145 PolarHBondContact CE1-OD2 3.11Å; H143-D145 PolarHBondContact ND1-N 3.44Å; H143-D145 VanDerWaalsContact ND1-N 3.15Å; H143-D145 PolarHBondContact O-N 3.32Å; H143-S146 WeakPolarHBondContact CB-OG 3.23Å; H143-S146 PolarHBondContact ND1-N 3.31Å; H143-S146 PolarHBondContact ND1-OG 3.01Å; H143-Y147 WeakPolarHBondContact O-CA 3.49Å; H143-Y147 PolarHBondContact O-N 2.92Å; H143-Y147 VanDerWaalsContact O-N 3.07Å; H143-L148 PolarHBondContact N-O 3.42Å; H143-L150 HydrophobicContact CB-CD1 3.99Å; H143-L150 HydrophobicContact CB-CG 4.36Å
144	K	86.2	Confident	89.2	Confident	101 Å²	101	55.1 Å²	55.1	44%	0.439	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-39.6	-174.1	-68.6	-176.3	174.3	-172.1	0	113.9	P75 L77	P75-K144 VanDerWaalsContact CG-NZ 3.27Å; P75-K144 WeakPolarHBondContact O-CE 3.31Å; L77-K144 HydrophobicContact CB-CG 4.31Å
145	D	86.7	Confident	88.9	Confident	133 Å²	133	58 Å²	58	71%	0.711	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-45.8	-174.4	-51.1	-46.1	0	0	0	113.6	H143 Y147	H143-D145 IonicContact CE1-OD2 3.13Å; H143-D145 PolarHBondContact CE1-OD2 3.11Å; H143-D145 PolarHBondContact ND1-N 3.44Å; H143-D145 VanDerWaalsContact ND1-N 3.15Å; H143-D145 PolarHBondContact O-N 3.32Å; D145-Y147 WeakPolarHBondContact O-CD2 3.42Å; D145-Y147 WeakPolarHBondContact O-CE2 3.02Å
146	S	85.9	Confident	88.6	Confident	62 Å²	62	58.4 Å²	58.4	43%	0.434	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-9.3	-175.6	59.9	0	0	0	0	114.3	H143 L148	H143-S146 WeakPolarHBondContact CB-OG 3.23Å; H143-S146 PolarHBondContact ND1-N 3.31Å; H143-S146 PolarHBondContact ND1-OG 3.01Å; S146-L148 PolarHBondContact O-N 3.49Å
147	Y	88.4	Confident	88.2	Confident	60 Å²	60	54.8 Å²	54.8	24%	0.235	30%	0.297	C	S	.	.			trans	56.1	14.6	-177.7	-57.7	-78.8	0	0	0	116	L77 T115 Y121 L123 V142 H143 D145	L77-Y147 HydrophobicContact CD2-CE1 4.24Å; T115-Y147 HydrophobicContact CG2-CD1 4.34Å; T115-Y147 HydrophobicContact CG2-CE1 4.39Å; Y121-Y147 HydrophobicContact CD1-CD1 4.47Å; Y121-Y147 HydrophobicContact CD1-CD2 4.08Å; Y121-Y147 HydrophobicContact CD1-CE2 4.31Å; Y121-Y147 HydrophobicContact CD1-CG 4.16Å; Y121-Y147 AromaticContact CD2-CD1 3.88Å; Y121-Y147 HydrophobicContact CD2-CD1 3.88Å; Y121-Y147 HydrophobicContact CD2-CE1 4.09Å; Y121-Y147 HydrophobicContact CD2-CG 4.29Å; Y121-Y147 HydrophobicContact CE1-CD1 4.4Å; Y121-Y147 AromaticContact CE1-CD2 3.96Å; Y121-Y147 HydrophobicContact CE1-CD2 3.96Å; Y121-Y147 HydrophobicContact CE1-CE1 4.18Å; Y121-Y147 AromaticContact CE1-CE2 3.71Å; Y121-Y147 HydrophobicContact CE1-CE2 3.71Å; Y121-Y147 HydrophobicContact CE1-CG 4.29Å; Y121-Y147 AromaticContact CE1-CZ 3.83Å; Y121-Y147 AromaticContact CE2-CD1 3.79Å; Y121-Y147 HydrophobicContact CE2-CD1 3.79Å; Y121-Y147 AromaticContact CE2-CE1 3.5Å; Y121-Y147 HydrophobicContact CE2-CE1 3.5Å; Y121-Y147 VanDerWaalsContact CE2-CE1 3.5Å; Y121-Y147 HydrophobicContact CE2-CG 4.41Å; Y121-Y147 AromaticContact CE2-CZ 3.9Å; Y121-Y147 HydrophobicContact CG-CD1 4.22Å; Y121-Y147 HydrophobicContact CG-CG 4.17Å; Y121-Y147 AromaticContact CZ-CE1 3.56Å; Y121-Y147 AromaticContact CZ-CE2 3.84Å; Y121-Y147 AromaticContact CZ-CZ 3.42Å; Y121-Y147 VanDerWaalsContact CZ-CZ 3.42Å; Y121-Y147 PolarHBondContact OH-OH 3.25Å; Y121-Y147 VanDerWaalsContact OH-OH 3.11Å; L123-Y147 VanDerWaalsContact CD1-O 3.3Å; L123-Y147 WeakPolarHBondContact CD1-O 3.33Å; L123-Y147 VanDerWaalsContact CD2-O 3.25Å; L123-Y147 WeakPolarHBondContact CD2-O 3.27Å; V142-Y147 HydrophobicContact CG1-CD1 4.28Å; V142-Y147 WeakPolarHBondContact CG1-O 3.48Å; H143-Y147 WeakPolarHBondContact O-CA 3.49Å; H143-Y147 PolarHBondContact O-N 2.92Å; H143-Y147 VanDerWaalsContact O-N 3.07Å; D145-Y147 WeakPolarHBondContact O-CD2 3.42Å; D145-Y147 WeakPolarHBondContact O-CE2 3.02Å
148	L	89.1	Confident	88	Confident	65 Å²	65	54.5 Å²	54.5	34%	0.34	28%	0.282	S	S	.	.			trans	-72.6	142.2	176.6	-63.5	173.9	0	0	0	111.7	V125 V142 H143 S146 L150	V125-L148 WeakPolarHBondContact O-CD2 3.26Å; V142-L148 WeakPolarHBondContact CA-O 3.42Å; H143-L148 PolarHBondContact N-O 3.42Å; S146-L148 PolarHBondContact O-N 3.49Å; L148-L150 PolarHBondContact O-N 2.9Å
149	I	90.6	Very high	87.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.6	175.6	-60	163	0	0	0	109.2	A111 I113 L123 I126 G127 L128 V129 L134 V140 V142	A111-I149 HydrophobicContact CB-CD1 4.38Å; I113-I149 HydrophobicContact CG2-CD1 3.98Å; I113-I149 HydrophobicContact CG2-CG1 4.34Å; L123-I149 HydrophobicContact CD1-CD1 4.17Å; L123-I149 HydrophobicContact CD1-CG1 4.05Å; I126-I149 HydrophobicContact CG2-CD1 3.85Å; I126-I149 WeakPolarHBondContact O-CB 3.06Å; I126-I149 PolarHBondContact O-N 3.2Å; G127-I149 WeakPolarHBondContact CA-O 3.32Å; L128-I149 PolarHBondContact N-O 2.81Å; V129-I149 HydrophobicContact CB-CG2 4.16Å; V129-I149 HydrophobicContact CG2-CG2 3.84Å; L134-I149 HydrophobicContact CD1-CD1 4.06Å; V140-I149 HydrophobicContact CB-CG1 4.48Å; V140-I149 HydrophobicContact CB-CG2 3.86Å; V140-I149 HydrophobicContact CG1-CG2 3.99Å; V140-I149 HydrophobicContact CG2-CD1 4.45Å; V140-I149 HydrophobicContact CG2-CG1 4.16Å; V140-I149 HydrophobicContact CG2-CG2 4.46Å; V142-I149 HydrophobicContact CG2-CG1 4.23Å
150	L	88.1	Confident	87.6	Confident	9 Å²	9	61 Å²	61	5%	0.047	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-39.6	-177.6	-63.7	175.6	0	0	0	112.5	K72 Y76 L128 G141 H143 L148	K72-L150 PolarHBondContact NZ-O 2.89Å; Y76-L150 HydrophobicContact CD1-CD1 3.27Å; Y76-L150 HydrophobicContact CE1-CD1 3.25Å; Y76-L150 HydrophobicContact CG-CD1 4.18Å; L128-L150 HydrophobicContact CD1-CD2 3.89Å; G141-L150 PolarHBondContact O-N 3.22Å; H143-L150 HydrophobicContact CB-CD1 3.99Å; H143-L150 HydrophobicContact CB-CG 4.36Å; L148-L150 PolarHBondContact O-N 2.9Å
151	E	89.2	Confident	87.3	Confident	95 Å²	95	61 Å²	61	44%	0.444	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	145.6	-173.9	-171.9	166.7	-175	0	0	110.8	G141	G141-E151 PolarHBondContact N-O 3.04Å
152	K	90.3	Very high	86.9	Confident	76 Å²	76	66.4 Å²	66.4	33%	0.33	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	125.6	170.8	178.9	171.6	171.7	158.7	0	109	V129 E133 L134 D138	V129-K152 HydrophobicContact CG1-CB 4.47Å; E133-K152 PolarHBondContact O-NZ 3.24Å; L134-K152 HydrophobicContact CD2-CD 4.44Å; D138-K152 IonicContact OD1-NZ 3.66Å; D138-K152 WeakPolarHBondContact OD2-CE 3.39Å; D138-K152 IonicContact OD2-NZ 3.27Å; D138-K152 PolarHBondContact OD2-NZ 2.78Å
153	L	89.5	Confident	86.7	Confident	50 Å²	50	70.4 Å²	70.4	26%	0.262	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-89.1	148.2	178.3	-63.6	173.1	0	0	0	109.8	V78 L139	V78-L153 HydrophobicContact CG1-CD1 4.05Å; V78-L153 HydrophobicContact CG2-CD1 3.98Å; L139-L153 HydrophobicContact CB-CB 4.11Å; L139-L153 PolarHBondContact O-N 3.35Å
154	P	86.2	Confident	86.4	Confident	104 Å²	104	68.9 Å²	68.9	68%	0.675	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-61.5	151.5	170.8	27.5	-34	0	0	0	110.3	E156	P154-E156 PolarHBondContact O-N 2.83Å
155	P	82.6	Confident	86.3	Confident	68 Å²	68	66.1 Å²	66.1	44%	0.442	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-58.1	136.5	177.5	23.7	-31.7	0	0	0	110.7	F157 E266	P155-F157 HydrophobicContact CB-CZ 4.37Å; P155-F157 HydrophobicContact CG-CE2 4.34Å; P155-F157 HydrophobicContact CG-CZ 4.18Å; P155-E266 WeakPolarHBondContact CG-OE1 3.45Å
156	E	81.8	Confident	85.7	Confident	147 Å²	147	62.2 Å²	62.2	69%	0.687	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-91.1	117.3	178	-173	177	-167.7	0	0	109.4	L139 P154	L139-E156 HydrophobicContact CD1-CB 3.51Å; P154-E156 PolarHBondContact O-N 2.83Å
157	F	82.5	Confident	84.8	Confident	14 Å²	14	66.1 Å²	66.1	6%	0.061	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-91.7	148.1	166.9	-56	-69.6	0	0	0	110.3	P155 S159 D259 Q262 L263 E266	P155-F157 HydrophobicContact CB-CZ 4.37Å; P155-F157 HydrophobicContact CG-CE2 4.34Å; P155-F157 HydrophobicContact CG-CZ 4.18Å; F157-S159 PolarHBondContact O-N 2.94Å; F157-D259 HydrophobicContact CD1-CB 4.25Å; F157-Q262 HydrophobicContact CE1-CB 3.81Å; F157-Q262 HydrophobicContact CE1-CG 3.64Å; F157-Q262 HydrophobicContact CZ-CG 4.07Å; F157-L263 HydrophobicContact CD1-CB 4.43Å; F157-L263 HydrophobicContact CD2-CD1 3.85Å; F157-L263 HydrophobicContact CE1-CB 4.45Å; F157-L263 HydrophobicContact CE2-CD1 3.89Å; F157-L263 HydrophobicContact CG-CD1 4.45Å; F157-E266 WeakPolarHBondContact CE2-OE2 3.43Å; F157-E266 VanDerWaalsContact CZ-CD 3.46Å; F157-E266 HydrophobicContact CZ-CG 4.4Å; F157-E266 WeakPolarHBondContact CZ-OE1 3.03Å; F157-E266 WeakPolarHBondContact CZ-OE2 3.39Å
158	D	83.9	Confident	83.7	Confident	45 Å²	45	71.3 Å²	71.3	24%	0.241	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-51.8	136.4	170.8	-163.1	-59.1	0	0	0	110.5	R160 V161 K162 L256	D158-R160 PolarHBondContact O-N 3.05Å; D158-R160 VanDerWaalsContact O-N 3.12Å; D158-R160 WeakPolarHBondContact OD1-CB 3.3Å; D158-R160 VanDerWaalsContact OD1-CG 3.28Å; D158-R160 WeakPolarHBondContact OD1-CG 3.41Å; D158-R160 PolarHBondContact OD1-N 2.89Å; D158-V161 HydrophobicContact CB-CG2 4.19Å; D158-V161 WeakPolarHBondContact O-CB 3.25Å; D158-V161 PolarHBondContact O-N 3.11Å; D158-K162 PolarHBondContact O-N 3.08Å; D158-L256 HydrophobicContact CB-CD1 4.44Å
159	S	86.3	Confident	82.6	Confident	93 Å²	93	76.5 Å²	76.5	65%	0.65	39%	0.393	S	S	*	.	H	α-helix	trans	-58	-28.2	-179.4	57	0	0	0	0	112.2	F157 V161 K162 A163	F157-S159 PolarHBondContact O-N 2.94Å; S159-V161 VanDerWaalsContact C-N 3.33Å; S159-V161 PolarHBondContact O-N 3.02Å; S159-K162 PolarHBondContact O-N 3.48Å; S159-A163 PolarHBondContact O-N 3.41Å
160	R	86.4	Confident	81.5	Confident	111 Å²	111	77.9 Å²	77.9	42%	0.419	40%	0.402	S	S	.	.	H	α-helix	trans	-63.8	-37.1	174.6	-63.1	170.2	-176.6	-171.9	0.4	112.3	D158 A163 M164 L256	D158-R160 PolarHBondContact O-N 3.05Å; D158-R160 VanDerWaalsContact O-N 3.12Å; D158-R160 WeakPolarHBondContact OD1-CB 3.3Å; D158-R160 VanDerWaalsContact OD1-CG 3.28Å; D158-R160 WeakPolarHBondContact OD1-CG 3.41Å; D158-R160 PolarHBondContact OD1-N 2.89Å; R160-A163 PolarHBondContact O-N 3.13Å; R160-M164 WeakPolarHBondContact O-CG 3.38Å; R160-M164 PolarHBondContact O-N 2.96Å; R160-L256 HydrophobicContact CB-CD1 3.88Å
161	V	85.9	Confident	81	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-71.2	-39.1	178.1	-177.6	0	0	0	0	110.5	D158 S159 A163 M164 E165 L256 D259 A260 L263	D158-V161 HydrophobicContact CB-CG2 4.19Å; D158-V161 WeakPolarHBondContact O-CB 3.25Å; D158-V161 PolarHBondContact O-N 3.11Å; S159-V161 VanDerWaalsContact C-N 3.33Å; S159-V161 PolarHBondContact O-N 3.02Å; V161-A163 PolarHBondContact O-N 3.18Å; V161-M164 WeakPolarHBondContact O-CB 3.18Å; V161-M164 PolarHBondContact O-N 3.27Å; V161-E165 PolarHBondContact O-N 3.12Å; V161-L256 HydrophobicContact CG2-CD1 3.47Å; V161-L256 VanDerWaalsContact CG2-CD1 3.47Å; V161-L256 HydrophobicContact CG2-CG 4.24Å; V161-D259 HydrophobicContact CG2-CB 3.86Å; V161-A260 HydrophobicContact CG1-CB 4.08Å; V161-L263 HydrophobicContact CG1-CB 4.18Å; V161-L263 HydrophobicContact CG1-CD2 3.67Å
162	K	85.3	Confident	80.6	Confident	115 Å²	115	82.3 Å²	82.3	50%	0.5	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-35.3	173.1	-64.1	-175.5	-178.1	177.7	0	111.8	D158 S159 M164 E165	D158-K162 PolarHBondContact O-N 3.08Å; S159-K162 PolarHBondContact O-N 3.48Å; K162-M164 VanDerWaalsContact C-N 3.27Å; K162-M164 PolarHBondContact O-N 2.94Å; K162-E165 WeakPolarHBondContact O-CB 3.19Å; K162-E165 PolarHBondContact O-N 3.05Å
163	A	86.3	Confident	80.4	Confident	83 Å²	83	86.4 Å²	86.4	69%	0.686	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-16	174.4	0	0	0	0	0	114.3	S159 R160 V161 E165	S159-A163 PolarHBondContact O-N 3.41Å; R160-A163 PolarHBondContact O-N 3.13Å; V161-A163 PolarHBondContact O-N 3.18Å; A163-E165 VanDerWaalsContact C-N 3.34Å
164	M	83.8	Confident	80.3	Confident	16 Å²	16	86.3 Å²	86.3	8%	0.079	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-17.1	174.5	-69.8	166.3	177.1	0	0	112.6	R160 V161 K162 V166 K239 L240 Q244 L256	R160-M164 WeakPolarHBondContact O-CG 3.38Å; R160-M164 PolarHBondContact O-N 2.96Å; V161-M164 WeakPolarHBondContact O-CB 3.18Å; V161-M164 PolarHBondContact O-N 3.27Å; K162-M164 VanDerWaalsContact C-N 3.27Å; K162-M164 PolarHBondContact O-N 2.94Å; M164-V166 PolarHBondContact O-N 2.91Å; M164-K239 WeakPolarHBondContact CB-O 3.46Å; M164-K239 WeakPolarHBondContact CG-O 3.41Å; M164-K239 PolarHBondContact O-N 2.87Å; M164-L240 HydrophobicContact CE-CD1 3.46Å; M164-L240 VanDerWaalsContact CE-CD1 3.46Å; M164-L240 HydrophobicContact SD-CD1 3.33Å; M164-L240 WeakPolarHBondContact SD-CD1 3.42Å; M164-Q244 HydrophobicContact CE-CB 4.14Å; M164-L256 HydrophobicContact CE-CD1 4.45Å; M164-L256 HydrophobicContact CE-CD2 3.88Å; M164-L256 HydrophobicContact CE-CG 4.29Å
165	E	83.3	Confident	80.3	Confident	42 Å²	42	84.4 Å²	84.4	20%	0.196	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-68.5	125.9	170.4	-174.1	173.9	-173.1	0	0	109.4	V161 K162 A163 D167 K267	V161-E165 PolarHBondContact O-N 3.12Å; K162-E165 WeakPolarHBondContact O-CB 3.19Å; K162-E165 PolarHBondContact O-N 3.05Å; A163-E165 VanDerWaalsContact C-N 3.34Å; E165-D167 PolarHBondContact O-N 2.78Å; E165-K267 WeakPolarHBondContact OE1-CD 3.08Å; E165-K267 IonicContact OE1-NZ 3.95Å; E165-K267 PolarHBondContact OE1-NZ 2.85Å; E165-K267 IonicContact OE2-NZ 3.7Å; E165-K267 PolarHBondContact OE2-NZ 2.86Å
166	V	74.9	Confident	80.5	Confident	51 Å²	51	83.5 Å²	83.5	31%	0.309	42%	0.421	S	S	.	.			trans	-87.1	98.3	-180	-176.1	0	0	0	0	108.4	M164 E168 F237 K239	M164-V166 PolarHBondContact O-N 2.91Å; V166-E168 VanDerWaalsContact C-N 3.25Å; V166-E168 WeakPolarHBondContact CG1-O 3.44Å; V166-E168 PolarHBondContact O-N 2.8Å; V166-F237 HydrophobicContact CB-CD1 4.08Å; V166-F237 HydrophobicContact CG2-CD1 3.65Å; V166-F237 HydrophobicContact CG2-CE1 4.16Å; V166-F237 PolarHBondContact N-O 2.95Å; V166-K239 HydrophobicContact CG2-CB 3.73Å
167	D	66.6	Low	80.7	Confident	144 Å²	144	77 Å²	77	77%	0.77	39%	0.391	S	S	*	.			trans	-62.1	-35	174.5	-69.2	-31.9	0	0	0	111.7	E165	E165-D167 PolarHBondContact O-N 2.78Å
168	E	65.3	Low	80.9	Confident	169 Å²	169	76.6 Å²	76.6	79%	0.79	39%	0.391	S	S	*	.	S	Bend	trans	-95.1	106.7	-178.8	-69.7	-171	170.7	0	0	112.3	V166 P170	V166-E168 VanDerWaalsContact C-N 3.25Å; V166-E168 WeakPolarHBondContact CG1-O 3.44Å; V166-E168 PolarHBondContact O-N 2.8Å; E168-P170 WeakPolarHBondContact O-CD 3.49Å
169	R	66.6	Low	80.9	Confident	174 Å²	174	76 Å²	76	66%	0.657	40%	0.396	S	S	*	.			trans	-57.6	123.6	174.5	-66.2	-179.7	-179.8	170	0.1	110.1	T171	R169-T171 PolarHBondContact O-N 2.92Å
170	P	67.8	Low	81	Confident	29 Å²	29	72.3 Å²	72.3	19%	0.188	37%	0.369	C	S	.	.			trans	-58.5	139.2	170.5	22.8	-30.4	0	0	0	109.4	E168 E172 R227 A230 A231	E168-P170 WeakPolarHBondContact O-CD 3.49Å; P170-E172 VanDerWaalsContact C-N 3.35Å; P170-R227 HydrophobicContact CB-CB 4.02Å; P170-R227 HydrophobicContact CG-CB 4.05Å; P170-R227 VanDerWaalsContact CG-O 3.25Å; P170-R227 WeakPolarHBondContact CG-O 3.33Å; P170-A230 HydrophobicContact CG-CB 4.42Å; P170-A231 HydrophobicContact CG-CB 4.3Å; P170-A231 WeakPolarHBondContact O-CB 3.27Å
171	T	77.5	Confident	81.2	Confident	125 Å²	125	71.3 Å²	71.3	77%	0.767	37%	0.371	S	S	*	.			trans	-90.4	-1	-177.4	47.9	0	0	0	0	113.6	R169	R169-T171 PolarHBondContact O-N 2.92Å
172	E	80.8	Confident	81.5	Confident	72 Å²	72	79 Å²	79	34%	0.336	41%	0.405	S	S	.	.			trans	-65.1	132.4	-175.5	-56.4	-68.2	173.5	0	0	111.4	P170 A228 A231	P170-E172 VanDerWaalsContact C-N 3.35Å; E172-A228 HydrophobicContact CB-CB 4.31Å; E172-A231 WeakPolarHBondContact O-CB 3.14Å
173	R	84.9	Confident	81.8	Confident	163 Å²	163	74.9 Å²	74.9	62%	0.615	39%	0.387	S	S	*	.			trans	-105.8	159.1	176.1	-61.5	-178.7	-178.1	-171	0.9	110.3	S175 D176	R173-S175 WeakPolarHBondContact CB-OG 3.45Å; R173-S175 PolarHBondContact O-N 3.37Å; R173-S175 VanDerWaalsContact O-N 3.11Å; R173-D176 PolarHBondContact N-OD2 3.03Å; R173-D176 VanDerWaalsContact N-OD2 3.07Å; R173-D176 WeakPolarHBondContact O-CB 3.32Å; R173-D176 PolarHBondContact O-N 2.99Å
174	Y	87.4	Confident	82	Confident	48 Å²	48	71.5 Å²	71.5	19%	0.188	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-58.8	-24.4	172.8	-61.3	-59.6	0	0	0	112.8	D176 I177 I184 I188 L225 A228 C229 Q232	Y174-D176 PolarHBondContact O-N 3.07Å; Y174-I177 PolarHBondContact O-N 3.49Å; Y174-I184 HydrophobicContact CD1-CG2 3.82Å; Y174-I184 HydrophobicContact CE1-CG2 4.2Å; Y174-I184 HydrophobicContact CG-CG2 4.17Å; Y174-I188 HydrophobicContact CD2-CD1 4.38Å; Y174-I188 HydrophobicContact CE1-CD1 4.45Å; Y174-I188 HydrophobicContact CE2-CD1 3.91Å; Y174-I188 HydrophobicContact CE2-CG1 4.32Å; Y174-L225 HydrophobicContact CD1-CD1 4.48Å; Y174-L225 HydrophobicContact CE1-CD1 4.46Å; Y174-A228 HydrophobicContact CD1-CB 4.22Å; Y174-A228 HydrophobicContact CE1-CB 4.31Å; Y174-C229 WeakPolarHBondContact OH-CA 3.49Å; Y174-Q232 HydrophobicContact CD2-CG 3.97Å; Y174-Q232 HydrophobicContact CE2-CB 3.92Å; Y174-Q232 HydrophobicContact CE2-CG 3.53Å
175	S	86.8	Confident	82.4	Confident	63 Å²	63	76.3 Å²	76.3	44%	0.441	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-65.4	-19.5	174.7	56.3	0	0	0	0	114.3	R173 I177	R173-S175 WeakPolarHBondContact CB-OG 3.45Å; R173-S175 PolarHBondContact O-N 3.37Å; R173-S175 VanDerWaalsContact O-N 3.11Å; S175-I177 VanDerWaalsContact C-N 3.3Å
176	D	86	Confident	82.8	Confident	49 Å²	49	78.7 Å²	78.7	26%	0.262	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-90.8	0.1	-179.3	-52.7	-36.9	0	0	0	111.5	R173 Y174 I357	R173-D176 PolarHBondContact N-OD2 3.03Å; R173-D176 VanDerWaalsContact N-OD2 3.07Å; R173-D176 WeakPolarHBondContact O-CB 3.32Å; R173-D176 PolarHBondContact O-N 2.99Å; Y174-D176 PolarHBondContact O-N 3.07Å; D176-I357 HydrophobicContact CB-CG2 4.44Å
177	I	87.1	Confident	83.6	Confident	10 Å²	10	76.2 Å²	76.2	5%	0.051	38%	0.376	C	S	.	.	S	Bend	trans	-104.9	116.1	177.3	-50.5	-175.2	0	0	0	108.8	Y174 S175 L180 I184 L224 L225 A228	Y174-I177 PolarHBondContact O-N 3.49Å; S175-I177 VanDerWaalsContact C-N 3.3Å; I177-L180 HydrophobicContact CG2-CB 4.1Å; I177-L180 HydrophobicContact CG2-CD1 3.9Å; I177-L180 HydrophobicContact CG2-CG 4.44Å; I177-I184 HydrophobicContact CB-CD1 4.09Å; I177-I184 HydrophobicContact CG2-CD1 4.09Å; I177-L224 HydrophobicContact CD1-CD2 3.61Å; I177-L224 HydrophobicContact CG1-CD2 3.48Å; I177-L224 VanDerWaalsContact CG1-CD2 3.48Å; I177-L225 HydrophobicContact CD1-CB 4.29Å; I177-L225 HydrophobicContact CD1-CD1 3.54Å; I177-A228 HydrophobicContact CD1-CB 3.8Å
178	G	86.3	Confident	84.7	Confident	7 Å²	7	71.6 Å²	71.6	7%	0.072	35%	0.351	C	S	.	.			trans	-91.5	133.1	179.4	0	0	0	0	0	113	L180	G178-L180 VanDerWaalsContact C-N 3.31Å; G178-L180 PolarHBondContact O-N 3.33Å
179	G	84.9	Confident	85.8	Confident	32 Å²	32	67.9 Å²	67.9	33%	0.33	33%	0.333	S	S	.	.	S	Bend	trans	76.5	4.2	162.7	0	0	0	0	0	117.3
180	L	88.3	Confident	86.8	Confident	16 Å²	16	59.7 Å²	59.7	8%	0.084	30%	0.303	C	S	.	.			trans	-108.3	32.9	-178.4	-66.1	172.4	0	0	0	112.4	I177 G178 K182 Q183 I184 F343	I177-L180 HydrophobicContact CG2-CB 4.1Å; I177-L180 HydrophobicContact CG2-CD1 3.9Å; I177-L180 HydrophobicContact CG2-CG 4.44Å; G178-L180 VanDerWaalsContact C-N 3.31Å; G178-L180 PolarHBondContact O-N 3.33Å; L180-K182 VanDerWaalsContact C-N 3.3Å; L180-K182 PolarHBondContact O-N 3.4Å; L180-Q183 HydrophobicContact CB-CB 4.38Å; L180-Q183 HydrophobicContact CD2-CG 4.4Å; L180-Q183 PolarHBondContact O-N 2.72Å; L180-Q183 VanDerWaalsContact O-N 3.17Å; L180-I184 WeakPolarHBondContact O-CD1 3.47Å; L180-I184 VanDerWaalsContact O-CG1 3.25Å; L180-I184 WeakPolarHBondContact O-CG1 3.37Å; L180-I184 PolarHBondContact O-N 2.81Å; L180-F343 HydrophobicContact CD1-CD1 3.85Å; L180-F343 HydrophobicContact CD1-CE1 3.83Å; L180-F343 HydrophobicContact CD2-CD1 4.14Å
181	D	89.3	Confident	87.7	Confident	89 Å²	89	58.4 Å²	58.4	48%	0.476	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-39.3	-171.8	-63.7	-48.7	0	0	0	112.4	I184 Q185 R353	D181-I184 PolarHBondContact O-N 3.49Å; D181-Q185 PolarHBondContact O-N 3.27Å; D181-R353 IonicContact OD2-NH1 2.87Å
182	K	91.7	Very high	88.1	Confident	162 Å²	162	53.8 Å²	53.8	70%	0.704	27%	0.266	S	S	*	.	H	α-helix	trans	-63.9	-46.7	176.3	-66.8	-177.5	180	178.8	0	111.8	L180 Q185 E186	L180-K182 VanDerWaalsContact C-N 3.3Å; L180-K182 PolarHBondContact O-N 3.4Å; K182-Q185 PolarHBondContact O-N 3.15Å; K182-E186 PolarHBondContact O-N 2.84Å
183	Q	91.9	Very high	88.3	Confident	28 Å²	28	52.8 Å²	52.8	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-67.3	-37.3	-179.7	-68.4	77.1	7.5	0	0	111.8	L180 L187 I341 E342 P344	L180-Q183 HydrophobicContact CB-CB 4.38Å; L180-Q183 HydrophobicContact CD2-CG 4.4Å; L180-Q183 PolarHBondContact O-N 2.72Å; L180-Q183 VanDerWaalsContact O-N 3.17Å; Q183-L187 WeakPolarHBondContact O-CB 3.25Å; Q183-L187 PolarHBondContact O-N 3.06Å; Q183-I341 HydrophobicContact CB-CG2 3.69Å; Q183-I341 HydrophobicContact CG-CG2 3.48Å; Q183-I341 VanDerWaalsContact CG-CG2 3.48Å; Q183-E342 WeakPolarHBondContact CG-O 3.38Å; Q183-E342 PolarHBondContact NE2-O 3.25Å; Q183-E342 VanDerWaalsContact NE2-O 3.1Å; Q183-P344 VanDerWaalsContact NE2-CD 3.32Å
184	I	91.5	Very high	88.3	Confident	13 Å²	13	45.3 Å²	45.3	7%	0.067	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-47.6	173.5	-69.8	161.8	0	0	0	109.6	Y174 I177 L180 D181 L187 I188 L225	Y174-I184 HydrophobicContact CD1-CG2 3.82Å; Y174-I184 HydrophobicContact CE1-CG2 4.2Å; Y174-I184 HydrophobicContact CG-CG2 4.17Å; I177-I184 HydrophobicContact CB-CD1 4.09Å; I177-I184 HydrophobicContact CG2-CD1 4.09Å; L180-I184 WeakPolarHBondContact O-CD1 3.47Å; L180-I184 VanDerWaalsContact O-CG1 3.25Å; L180-I184 WeakPolarHBondContact O-CG1 3.37Å; L180-I184 PolarHBondContact O-N 2.81Å; D181-I184 PolarHBondContact O-N 3.49Å; I184-L187 PolarHBondContact O-N 3.36Å; I184-I188 HydrophobicContact CG2-CD1 3.56Å; I184-I188 HydrophobicContact CG2-CG1 4.3Å; I184-I188 WeakPolarHBondContact O-CB 3.07Å; I184-I188 WeakPolarHBondContact O-CG1 2.91Å; I184-I188 PolarHBondContact O-N 2.97Å; I184-L225 HydrophobicContact CB-CD1 4.4Å; I184-L225 HydrophobicContact CG1-CD1 3.48Å; I184-L225 VanDerWaalsContact CG1-CD1 3.48Å
185	Q	92.3	Very high	88.1	Confident	117 Å²	117	44.5 Å²	44.5	55%	0.547	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-49	179	-177	175.3	-5.8	0	0	111.9	D181 K182 L187 I188 E189	D181-Q185 PolarHBondContact O-N 3.27Å; K182-Q185 PolarHBondContact O-N 3.15Å; Q185-L187 VanDerWaalsContact C-N 3.29Å; Q185-L187 PolarHBondContact O-N 2.91Å; Q185-I188 PolarHBondContact O-N 2.95Å; Q185-E189 HydrophobicContact CG-CG 4.45Å; Q185-E189 VanDerWaalsContact CG-OE1 3.32Å; Q185-E189 WeakPolarHBondContact CG-OE1 3.09Å; Q185-E189 PolarHBondContact NE2-OE1 3.33Å; Q185-E189 WeakPolarHBondContact O-CG 3.41Å; Q185-E189 PolarHBondContact O-N 3.4Å
186	E	92	Very high	87.9	Confident	91 Å²	91	45.6 Å²	45.6	43%	0.425	24%	0.238	S	C	.	.	H	α-helix	trans	-59.6	-38.8	178.3	-73	-177.6	-170.3	0	0	112.6	K182 A190 I341	K182-E186 PolarHBondContact O-N 2.84Å; E186-A190 WeakPolarHBondContact O-CB 3.16Å; E186-A190 PolarHBondContact O-N 2.77Å; E186-I341 HydrophobicContact CB-CD1 3.87Å; E186-I341 HydrophobicContact CB-CG1 4.31Å
187	L	91	Very high	87.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.9	-42.3	177.1	-172.3	67.9	0	0	0	111.8	Q183 I184 Q185 E189 A190 V191 V212 L214 L225 C229 I318 I341	Q183-L187 WeakPolarHBondContact O-CB 3.25Å; Q183-L187 PolarHBondContact O-N 3.06Å; I184-L187 PolarHBondContact O-N 3.36Å; Q185-L187 VanDerWaalsContact C-N 3.29Å; Q185-L187 PolarHBondContact O-N 2.91Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 3.3Å; L187-A190 PolarHBondContact O-N 2.98Å; L187-V191 HydrophobicContact CD1-CG2 3.95Å; L187-V191 HydrophobicContact CG-CG2 4.47Å; L187-V191 WeakPolarHBondContact O-CB 3.49Å; L187-V191 PolarHBondContact O-N 2.9Å; L187-V212 HydrophobicContact CD1-CB 4.18Å; L187-V212 HydrophobicContact CD1-CG1 3.88Å; L187-V212 HydrophobicContact CD1-CG2 4.18Å; L187-L214 HydrophobicContact CD1-CD2 4.34Å; L187-L225 HydrophobicContact CB-CD2 4.35Å; L187-L225 HydrophobicContact CD2-CD1 4.27Å; L187-L225 HydrophobicContact CD2-CD2 3.62Å; L187-L225 HydrophobicContact CD2-CG 3.54Å; L187-C229 HydrophobicContact CD2-CB 3.93Å; L187-I318 HydrophobicContact CD1-CD1 4.32Å; L187-I341 HydrophobicContact CB-CD1 4.01Å; L187-I341 HydrophobicContact CD1-CD1 4.29Å
188	I	90.1	Very high	87.6	Confident	47 Å²	47	51 Å²	51	24%	0.241	26%	0.258	C	S	.	.	I	π-helix	trans	-61.5	-43	176.5	-70.5	170.7	0	0	0	110.1	Y174 I184 Q185 A190 V192 L193	Y174-I188 HydrophobicContact CD2-CD1 4.38Å; Y174-I188 HydrophobicContact CE1-CD1 4.45Å; Y174-I188 HydrophobicContact CE2-CD1 3.91Å; Y174-I188 HydrophobicContact CE2-CG1 4.32Å; I184-I188 HydrophobicContact CG2-CD1 3.56Å; I184-I188 HydrophobicContact CG2-CG1 4.3Å; I184-I188 WeakPolarHBondContact O-CB 3.07Å; I184-I188 WeakPolarHBondContact O-CG1 2.91Å; I184-I188 PolarHBondContact O-N 2.97Å; Q185-I188 PolarHBondContact O-N 2.95Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 2.82Å; I188-V192 HydrophobicContact CB-CG2 4.26Å; I188-V192 HydrophobicContact CG1-CG2 4.2Å; I188-V192 HydrophobicContact CG2-CB 3.93Å; I188-V192 HydrophobicContact CG2-CG1 4.48Å; I188-V192 HydrophobicContact CG2-CG2 4.11Å; I188-V192 WeakPolarHBondContact O-CA 3.41Å; I188-V192 VanDerWaalsContact O-CB 3.31Å; I188-V192 WeakPolarHBondContact O-CB 3.47Å; I188-V192 PolarHBondContact O-N 3.49Å; I188-L193 HydrophobicContact CG2-CD1 4.31Å; I188-L193 PolarHBondContact O-N 3.04Å
189	E	88.6	Confident	87.6	Confident	90 Å²	90	56.7 Å²	56.7	42%	0.421	29%	0.286	S	S	.	.	I	π-helix	trans	-63	-37.4	176.7	-72.1	176	-167.5	0	0	113.2	Q185 L187 L193	Q185-E189 HydrophobicContact CG-CG 4.45Å; Q185-E189 VanDerWaalsContact CG-OE1 3.32Å; Q185-E189 WeakPolarHBondContact CG-OE1 3.09Å; Q185-E189 PolarHBondContact NE2-OE1 3.33Å; Q185-E189 WeakPolarHBondContact O-CG 3.41Å; Q185-E189 PolarHBondContact O-N 3.4Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 3.3Å; E189-L193 HydrophobicContact CB-CD1 4.24Å; E189-L193 HydrophobicContact CG-CD1 3.92Å
190	A	87.2	Confident	87.9	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.025	30%	0.299	C	S	.	.	I	π-helix	trans	-80.1	-34.4	-179.6	0	0	0	0	0	113.9	E186 L187 I188 P194 P209 V212 R339	E186-A190 WeakPolarHBondContact O-CB 3.16Å; E186-A190 PolarHBondContact O-N 2.77Å; L187-A190 PolarHBondContact O-N 2.98Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 2.82Å; A190-P194 WeakPolarHBondContact O-CG 3.37Å; A190-P209 HydrophobicContact CB-CG 3.97Å; A190-V212 HydrophobicContact CB-CG2 3.48Å; A190-V212 VanDerWaalsContact CB-CG2 3.48Å; A190-R339 HydrophobicContact CB-CG 4.14Å
191	V	86	Confident	87.8	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.012	30%	0.301	C	S	.	.	I	π-helix	trans	-109.1	-51.7	-171.2	-178.8	0	0	0	0	112.1	L187 M195 V212 I271 K316 I318	L187-V191 HydrophobicContact CD1-CG2 3.95Å; L187-V191 HydrophobicContact CG-CG2 4.47Å; L187-V191 WeakPolarHBondContact O-CB 3.49Å; L187-V191 PolarHBondContact O-N 2.9Å; V191-M195 HydrophobicContact CG1-SD 4.22Å; V191-M195 VanDerWaalsContact O-CG 3.23Å; V191-M195 WeakPolarHBondContact O-CG 3.38Å; V191-V212 HydrophobicContact CG2-CG2 4.09Å; V191-I271 HydrophobicContact CG1-CD1 3.74Å; V191-I271 HydrophobicContact CG1-CG1 4.23Å; V191-K316 HydrophobicContact CG1-CB 4.26Å; V191-K316 HydrophobicContact CG1-CG 4.39Å; V191-I318 HydrophobicContact CG2-CD1 4.16Å; V191-I318 HydrophobicContact CG2-CG1 4.23Å
192	V	85.9	Confident	87.6	Confident	27 Å²	27	66.1 Å²	66.1	16%	0.164	31%	0.311	C	S	.	.	I	π-helix	trans	-76.6	-42.4	-171.5	-176.1	0	0	0	0	111.5	I188 M195 T196 T233	I188-V192 HydrophobicContact CB-CG2 4.26Å; I188-V192 HydrophobicContact CG1-CG2 4.2Å; I188-V192 HydrophobicContact CG2-CB 3.93Å; I188-V192 HydrophobicContact CG2-CG1 4.48Å; I188-V192 HydrophobicContact CG2-CG2 4.11Å; I188-V192 WeakPolarHBondContact O-CA 3.41Å; I188-V192 VanDerWaalsContact O-CB 3.31Å; I188-V192 WeakPolarHBondContact O-CB 3.47Å; I188-V192 PolarHBondContact O-N 3.49Å; V192-M195 PolarHBondContact O-N 3.33Å; V192-M195 VanDerWaalsContact O-N 3.11Å; V192-T196 HydrophobicContact CG1-CG2 4.07Å; V192-T196 PolarHBondContact O-N 3.06Å; V192-T196 PolarHBondContact O-OG1 3.2Å; V192-T233 HydrophobicContact CB-CG2 4.42Å; V192-T233 HydrophobicContact CG1-CG2 4.48Å; V192-T233 HydrophobicContact CG2-CG2 3.7Å
193	L	86	Confident	87.5	Confident	52 Å²	52	62.9 Å²	62.9	27%	0.272	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-46.5	-178.1	-99.4	108.9	0	0	0	112.8	I188 E189 M195 T196 H197 F201	I188-L193 HydrophobicContact CG2-CD1 4.31Å; I188-L193 PolarHBondContact O-N 3.04Å; E189-L193 HydrophobicContact CB-CD1 4.24Å; E189-L193 HydrophobicContact CG-CD1 3.92Å; L193-M195 PolarHBondContact O-N 3.33Å; L193-T196 PolarHBondContact O-N 3.02Å; L193-H197 PolarHBondContact O-N 2.92Å; L193-F201 HydrophobicContact CB-CE2 4.11Å; L193-F201 HydrophobicContact CB-CZ 4.21Å
194	P	84.7	Confident	87.5	Confident	6 Å²	6	67.4 Å²	67.4	4%	0.039	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-25.6	174.9	-27.5	36.7	0	0	0	114.2	A190 R198 F201 P208	A190-P194 WeakPolarHBondContact O-CG 3.37Å; P194-R198 WeakPolarHBondContact O-CG 3.34Å; P194-F201 HydrophobicContact CB-CE2 4.26Å; P194-F201 HydrophobicContact CG-CE1 4.41Å; P194-F201 HydrophobicContact CG-CE2 3.93Å; P194-F201 HydrophobicContact CG-CZ 3.74Å; P194-P208 HydrophobicContact CB-CB 3.69Å; P194-P208 HydrophobicContact CB-CG 4.44Å; P194-P208 HydrophobicContact CG-CB 3.66Å
195	M	81.7	Confident	87.3	Confident	30 Å²	30	70 Å²	70	15%	0.148	37%	0.369	C	S	.	.	H	α-helix	trans	-83.9	-34.8	-179.1	-63.9	178.6	94.9	0	0	112.1	V191 V192 L193 T233 S235 P269 I271	V191-M195 HydrophobicContact CG1-SD 4.22Å; V191-M195 VanDerWaalsContact O-CG 3.23Å; V191-M195 WeakPolarHBondContact O-CG 3.38Å; V192-M195 PolarHBondContact O-N 3.33Å; V192-M195 VanDerWaalsContact O-N 3.11Å; L193-M195 PolarHBondContact O-N 3.33Å; M195-T233 HydrophobicContact SD-CG2 4.41Å; M195-S235 WeakPolarHBondContact CE-OG 3.29Å; M195-P269 HydrophobicContact CE-CB 3.53Å; M195-P269 HydrophobicContact CE-CG 4.46Å; M195-I271 HydrophobicContact CE-CG1 4.31Å; M195-I271 HydrophobicContact SD-CD1 4.21Å; M195-I271 HydrophobicContact SD-CG1 4.28Å
196	T	82.8	Confident	87	Confident	86 Å²	86	68.6 Å²	68.6	53%	0.528	36%	0.364	S	S	.	.	H	α-helix	trans	-94.4	-31.9	-175.1	50.9	0	0	0	0	113.7	V192 L193	V192-T196 HydrophobicContact CG1-CG2 4.07Å; V192-T196 PolarHBondContact O-N 3.06Å; V192-T196 PolarHBondContact O-OG1 3.2Å; L193-T196 PolarHBondContact O-N 3.02Å
197	H	84.4	Confident	86.6	Confident	80 Å²	80	71 Å²	71	37%	0.37	38%	0.375	S	S	.	.			trans	-133.6	59.1	-171.4	-66.6	-68.6	0	0	0	112.1	L193 D199 R200 F201	L193-H197 PolarHBondContact O-N 2.92Å; H197-D199 VanDerWaalsContact C-N 3.28Å; H197-D199 PolarHBondContact O-N 3.45Å; H197-R200 HydrophobicContact CB-CB 4.45Å; H197-R200 HydrophobicContact CB-CG 4.13Å; H197-R200 PolarHBondContact O-N 2.88Å; H197-F201 WeakPolarHBondContact O-CD2 3.34Å
198	R	82.8	Confident	86.3	Confident	94 Å²	94	72.5 Å²	72.5	36%	0.355	39%	0.385	S	S	.	.	H	α-helix	trans	-58.4	-40.7	176.9	-69.7	-177	-159.3	169	12.5	112.8	P194 R200 F201 E202 D314	P194-R198 WeakPolarHBondContact O-CG 3.34Å; R198-R200 PolarHBondContact O-N 3.06Å; R198-F201 WeakPolarHBondContact O-CA 3.22Å; R198-F201 WeakPolarHBondContact O-CB 3.47Å; R198-F201 PolarHBondContact O-N 2.91Å; R198-E202 PolarHBondContact O-N 3.36Å; R198-D314 IonicContact CZ-OD1 3.56Å; R198-D314 IonicContact CZ-OD2 3.28Å; R198-D314 IonicContact NE-OD1 3.11Å; R198-D314 PolarHBondContact NE-OD1 3.28Å; R198-D314 IonicContact NH1-OD1 3.74Å; R198-D314 PolarHBondContact NH1-OD1 3.1Å; R198-D314 IonicContact NH1-OD2 3.1Å; R198-D314 PolarHBondContact NH1-OD2 3.37Å; R198-D314 IonicContact NH2-OD1 3.61Å; R198-D314 PolarHBondContact NH2-OD1 2.78Å; R198-D314 IonicContact NH2-OD2 3.55Å; R198-D314 PolarHBondContact NH2-OD2 2.98Å
199	D	87.3	Confident	86	Confident	126 Å²	126	71.3 Å²	71.3	67%	0.674	38%	0.38	S	S	*	.	H	α-helix	trans	-54.9	-31.6	-179.1	-46.6	-19.8	0	0	0	112.5	H197 A203	H197-D199 VanDerWaalsContact C-N 3.28Å; H197-D199 PolarHBondContact O-N 3.45Å; D199-A203 WeakPolarHBondContact O-CB 3.32Å; D199-A203 PolarHBondContact O-N 3.35Å
200	R	89.4	Confident	85.7	Confident	159 Å²	159	69.1 Å²	69.1	60%	0.6	37%	0.369	S	S	*	.	H	α-helix	trans	-70	-34.7	176.8	-66.7	-173.3	-178	179.3	2.1	112.5	H197 R198 L204	H197-R200 HydrophobicContact CB-CB 4.45Å; H197-R200 HydrophobicContact CB-CG 4.13Å; H197-R200 PolarHBondContact O-N 2.88Å; R198-R200 PolarHBondContact O-N 3.06Å; R200-L204 WeakPolarHBondContact O-CB 3.47Å; R200-L204 PolarHBondContact O-N 3.01Å
201	F	86.2	Confident	85.7	Confident	29 Å²	29	69.2 Å²	69.2	13%	0.127	37%	0.371	C	S	.	.	H	α-helix	trans	-73.4	-41.5	175.6	-70.9	-90.9	0	0	0	110.8	L193 P194 H197 R198 L204 G205 I206 P208	L193-F201 HydrophobicContact CB-CE2 4.11Å; L193-F201 HydrophobicContact CB-CZ 4.21Å; P194-F201 HydrophobicContact CB-CE2 4.26Å; P194-F201 HydrophobicContact CG-CE1 4.41Å; P194-F201 HydrophobicContact CG-CE2 3.93Å; P194-F201 HydrophobicContact CG-CZ 3.74Å; H197-F201 WeakPolarHBondContact O-CD2 3.34Å; R198-F201 WeakPolarHBondContact O-CA 3.22Å; R198-F201 WeakPolarHBondContact O-CB 3.47Å; R198-F201 PolarHBondContact O-N 2.91Å; F201-L204 PolarHBondContact O-N 3.35Å; F201-G205 PolarHBondContact O-N 2.85Å; F201-I206 HydrophobicContact CD1-CD1 3.86Å; F201-I206 HydrophobicContact CD1-CG1 3.94Å; F201-I206 HydrophobicContact CE1-CD1 4.15Å; F201-I206 PolarHBondContact O-N 2.93Å; F201-P208 HydrophobicContact CD1-CB 4.04Å; F201-P208 HydrophobicContact CE1-CB 4.11Å; F201-P208 HydrophobicContact CG-CB 4.47Å
202	E	85.6	Confident	86	Confident	147 Å²	147	69.3 Å²	69.3	69%	0.687	37%	0.371	S	S	*	.	H	α-helix	trans	-65.2	-44.4	177.2	-67.7	-176	179.5	0	0	112.1	R198 L204 G205	R198-E202 PolarHBondContact O-N 3.36Å; E202-L204 VanDerWaalsContact C-N 3.27Å; E202-L204 PolarHBondContact O-N 3.48Å; E202-G205 PolarHBondContact O-N 2.87Å; E202-G205 VanDerWaalsContact O-N 3.1Å
203	A	90.7	Very high	86.3	Confident	93 Å²	93	68 Å²	68	77%	0.769	36%	0.363	S	S	*	.	H	α-helix	trans	-63.2	-32.7	177.3	0	0	0	0	0	113.1	D199	D199-A203 WeakPolarHBondContact O-CB 3.32Å; D199-A203 PolarHBondContact O-N 3.35Å
204	L	91.3	Very high	86.7	Confident	124 Å²	124	65.6 Å²	65.6	65%	0.649	35%	0.351	S	S	*	.	H	α-helix	trans	-84.9	-15.2	176.8	-170.3	61	0	0	0	112.6	R200 F201 E202 I206	R200-L204 WeakPolarHBondContact O-CB 3.47Å; R200-L204 PolarHBondContact O-N 3.01Å; F201-L204 PolarHBondContact O-N 3.35Å; E202-L204 VanDerWaalsContact C-N 3.27Å; E202-L204 PolarHBondContact O-N 3.48Å; L204-I206 VanDerWaalsContact C-N 3.31Å; L204-I206 HydrophobicContact CB-CG1 4.12Å; L204-I206 HydrophobicContact CD2-CD1 3.66Å; L204-I206 HydrophobicContact CD2-CG1 3.85Å; L204-I206 HydrophobicContact CD2-CG2 4.34Å; L204-I206 HydrophobicContact CG-CD1 4.43Å; L204-I206 HydrophobicContact CG-CG1 4.08Å; L204-I206 HydrophobicContact CG-CG2 4.15Å; L204-I206 PolarHBondContact O-N 3.05Å
205	G	86.6	Confident	87.1	Confident	67 Å²	67	67.5 Å²	67.5	69%	0.691	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	21	-178.2	0	0	0	0	0	114.3	F201 E202	F201-G205 PolarHBondContact O-N 2.85Å; E202-G205 PolarHBondContact O-N 2.87Å; E202-G205 VanDerWaalsContact O-N 3.1Å
206	I	87.4	Confident	87.5	Confident	87 Å²	87	66.8 Å²	66.8	45%	0.446	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-103.1	143.1	178.8	58.7	160.6	0	0	0	111.2	F201 L204	F201-I206 HydrophobicContact CD1-CD1 3.86Å; F201-I206 HydrophobicContact CD1-CG1 3.94Å; F201-I206 HydrophobicContact CE1-CD1 4.15Å; F201-I206 PolarHBondContact O-N 2.93Å; L204-I206 VanDerWaalsContact C-N 3.31Å; L204-I206 HydrophobicContact CB-CG1 4.12Å; L204-I206 HydrophobicContact CD2-CD1 3.66Å; L204-I206 HydrophobicContact CD2-CG1 3.85Å; L204-I206 HydrophobicContact CD2-CG2 4.34Å; L204-I206 HydrophobicContact CG-CD1 4.43Å; L204-I206 HydrophobicContact CG-CG1 4.08Å; L204-I206 HydrophobicContact CG-CG2 4.15Å; L204-I206 PolarHBondContact O-N 3.05Å
207	Q	82.9	Confident	87.8	Confident	143 Å²	143	65.7 Å²	65.7	67%	0.668	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-79.8	135	173.4	-66.9	-179.3	0.6	0	0	109.9	P311	Q207-P311 HydrophobicContact CG-CB 4.24Å
208	P	84.3	Confident	87.9	Confident	30 Å²	30	65.8 Å²	65.8	20%	0.195	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-66.4	150.6	175.1	29.4	-34.9	0	0	0	110.2	P194 F201 K210	P194-P208 HydrophobicContact CB-CB 3.69Å; P194-P208 HydrophobicContact CB-CG 4.44Å; P194-P208 HydrophobicContact CG-CB 3.66Å; F201-P208 HydrophobicContact CD1-CB 4.04Å; F201-P208 HydrophobicContact CE1-CB 4.11Å; F201-P208 HydrophobicContact CG-CB 4.47Å; P208-K210 PolarHBondContact O-N 2.79Å
209	P	85	Confident	88	Confident	23 Å²	23	62.8 Å²	62.8	15%	0.149	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-60.3	141.5	175.8	26	-33.1	0	0	0	110.5	A190 K316 D338 R339	A190-P209 HydrophobicContact CB-CG 3.97Å; P209-K316 PolarHBondContact O-NZ 3.43Å; P209-D338 WeakPolarHBondContact CA-OD2 3.44Å; P209-D338 HydrophobicContact CB-CB 3.9Å; P209-R339 HydrophobicContact CB-CG 4.39Å
210	K	82.5	Confident	88	Confident	44 Å²	44	57.4 Å²	57.4	19%	0.191	33%	0.33	C	S	.	.			trans	-81	-37.3	-178.2	-73.8	178.7	167.2	-166.6	0	112	P208 D307 F309 V317 G335 D338	P208-K210 PolarHBondContact O-N 2.79Å; K210-D307 PolarHBondContact NZ-O 3.02Å; K210-F309 PolarHBondContact NZ-O 2.89Å; K210-F309 VanDerWaalsContact NZ-O 3.11Å; K210-V317 PolarHBondContact O-N 3.03Å; K210-G335 WeakPolarHBondContact CD-O 3.34Å; K210-D338 PolarHBondContact N-OD2 3.47Å
211	G	87.5	Confident	87.8	Confident	5 Å²	5	51.1 Å²	51.1	5%	0.052	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	162.6	-177.1	0	0	0	0	0	115.2	V317 D338 R339	G211-V317 CarbonylContact C-O 3.59Å; G211-V317 WeakPolarHBondContact CA-O 3.41Å; G211-D338 PolarHBondContact O-N 3.34Å; G211-R339 PolarHBondContact O-N 2.83Å
212	V	91.2	Very high	87.9	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.7	-177.6	-172.8	0	0	0	0	109.7	L187 A190 V191 L214 V317 I318 A319 R339 I341	L187-V212 HydrophobicContact CD1-CB 4.18Å; L187-V212 HydrophobicContact CD1-CG1 3.88Å; L187-V212 HydrophobicContact CD1-CG2 4.18Å; A190-V212 HydrophobicContact CB-CG2 3.48Å; A190-V212 VanDerWaalsContact CB-CG2 3.48Å; V191-V212 HydrophobicContact CG2-CG2 4.09Å; V212-L214 HydrophobicContact CG1-CD2 3.92Å; V212-V317 PolarHBondContact N-O 2.83Å; V212-I318 CarbonylContact O-C 3.54Å; V212-I318 WeakPolarHBondContact O-CA 3.49Å; V212-A319 PolarHBondContact O-N 2.85Å; V212-R339 CarbonylContact C-O 3.52Å; V212-R339 WeakPolarHBondContact CA-O 3.31Å; V212-R339 HydrophobicContact CG1-CB 4.2Å; V212-R339 HydrophobicContact CG2-CB 4.23Å; V212-I341 HydrophobicContact CG1-CD1 3.48Å; V212-I341 VanDerWaalsContact CG1-CD1 3.48Å; V212-I341 HydrophobicContact CG1-CG1 3.77Å
213	L	92.4	Very high	87.9	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.7	172.8	179.2	70.4	0	0	0	109.5	L277 A319 T321 V324 L327 L332 V337 R339 K340 I341	L213-L277 HydrophobicContact CD1-CD2 4.19Å; L213-A319 CarbonylContact C-O 3.53Å; L213-A319 WeakPolarHBondContact CA-O 3.42Å; L213-A319 HydrophobicContact CD1-CB 3.93Å; L213-T321 HydrophobicContact CD1-CG2 3.89Å; L213-T321 HydrophobicContact CG-CG2 4.4Å; L213-V324 HydrophobicContact CD2-CG2 4.41Å; L213-L327 HydrophobicContact CD1-CD1 4.37Å; L213-L327 HydrophobicContact CD2-CD1 4.27Å; L213-L332 HydrophobicContact CD2-CD2 3.47Å; L213-L332 VanDerWaalsContact CD2-CD2 3.47Å; L213-V337 HydrophobicContact CB-CB 4.48Å; L213-V337 HydrophobicContact CB-CG1 3.32Å; L213-R339 PolarHBondContact N-O 3.43Å; L213-K340 WeakPolarHBondContact O-CA 3.36Å; L213-I341 PolarHBondContact O-N 2.94Å
214	L	93.7	Very high	87.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.9	172.2	-49.4	-177.6	0	0	0	108.5	L187 V212 K222 I318 A319 A320 T321 I341 F343	L187-L214 HydrophobicContact CD1-CD2 4.34Å; V212-L214 HydrophobicContact CG1-CD2 3.92Å; L214-K222 HydrophobicContact CB-CB 4.26Å; L214-K222 HydrophobicContact CB-CD 4.34Å; L214-K222 HydrophobicContact CB-CG 4.33Å; L214-K222 HydrophobicContact CD1-CB 4.39Å; L214-I318 HydrophobicContact CD1-CG2 3.84Å; L214-I318 HydrophobicContact CG-CG2 4.07Å; L214-A319 PolarHBondContact N-O 3.17Å; L214-A320 HydrophobicContact CB-CB 4.42Å; L214-A320 WeakPolarHBondContact O-CA 3.41Å; L214-T321 PolarHBondContact O-N 2.73Å; L214-I341 HydrophobicContact CD2-CB 3.98Å; L214-I341 HydrophobicContact CD2-CD1 4.04Å; L214-I341 HydrophobicContact CD2-CG1 4.37Å; L214-F343 HydrophobicContact CB-CD2 4.35Å; L214-F343 HydrophobicContact CB-CE2 3.65Å; L214-F343 HydrophobicContact CB-CZ 4.33Å; L214-F343 HydrophobicContact CD1-CE2 4.36Å; L214-F343 HydrophobicContact CD1-CZ 4.25Å; L214-F343 HydrophobicContact CD2-CE2 3.75Å; L214-F343 HydrophobicContact CD2-CZ 4.14Å; L214-F343 HydrophobicContact CG-CE2 4.09Å; L214-F343 HydrophobicContact CG-CZ 4.46Å
215	Y	93.2	Very high	87.7	Confident	47 Å²	47	37.2 Å²	37.2	18%	0.184	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.5	179.6	72.3	-86	0	0	0	112.6	K222 T321 V324 K340 I341 E342 F343	Y215-K222 VanDerWaalsContact C-CE 3.46Å; Y215-T321 WeakPolarHBondContact CA-O 3.25Å; Y215-V324 HydrophobicContact CD2-CB 4.27Å; Y215-V324 HydrophobicContact CD2-CG1 4.05Å; Y215-V324 HydrophobicContact CG-CB 4.33Å; Y215-V324 HydrophobicContact CG-CG2 4.5Å; Y215-K340 HydrophobicContact CD1-CB 4.44Å; Y215-K340 HydrophobicContact CE1-CB 3.85Å; Y215-I341 WeakPolarHBondContact CD1-O 3.44Å; Y215-I341 PolarHBondContact N-O 3.13Å; Y215-E342 HydrophobicContact CD2-CG 4.25Å; Y215-E342 HydrophobicContact CE1-CB 4.12Å; Y215-E342 HydrophobicContact CE2-CB 3.84Å; Y215-E342 HydrophobicContact CE2-CG 3.54Å; Y215-E342 WeakPolarHBondContact CE2-OE2 3.47Å; Y215-E342 WeakPolarHBondContact OH-CB 3.49Å; Y215-E342 PolarHBondContact OH-OE2 3.17Å; Y215-F343 PolarHBondContact O-N 3.11Å
216	G	90.2	Very high	87.6	Confident	14 Å²	14	34 Å²	34	14%	0.144	20%	0.201	C	C	.	.	S	Bend	trans	149	-171.5	-177.1	0	0	0	0	0	113.9	K222 N322	G216-K222 VanDerWaalsContact C-NZ 3.31Å; G216-K222 VanDerWaalsContact N-CE 3.29Å; G216-K222 VanDerWaalsContact N-NZ 3.17Å; G216-K222 WeakPolarHBondContact O-CE 3.31Å; G216-K222 PolarHBondContact O-NZ 2.57Å; G216-N322 VanDerWaalsContact O-O 3.12Å
217	P	88.6	Confident	87.5	Confident	64 Å²	64	35 Å²	35	42%	0.416	20%	0.199	S	C	.	.	S	Bend	trans	-65.2	154	175.8	-21.3	33.6	0	0	0	112.9	T220 F343	P217-T220 HydrophobicContact CB-CG2 4.22Å; P217-T220 HydrophobicContact CG-CG2 4.46Å; P217-T220 PolarHBondContact O-OG1 3.22Å; P217-F343 VanDerWaalsContact CD-O 3.24Å; P217-F343 WeakPolarHBondContact CD-O 3.43Å
218	P	87.6	Confident	87.6	Confident	81 Å²	81	28.2 Å²	28.2	53%	0.526	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	146.2	172.5	29	-34.6	0	0	0	111.1	N381	P218-N381 PolarHBondContact O-ND2 3.29Å
219	G	84.7	Confident	87.7	Confident	32 Å²	32	26.8 Å²	26.8	33%	0.33	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	9	178.5	0	0	0	0	0	115.7	G382 A383	G219-G382 PolarHBondContact O-N 3.45Å; G219-G382 VanDerWaalsContact O-N 3.13Å; G219-A383 PolarHBondContact O-N 3.48Å
220	T	86.6	Confident	87.6	Confident	13 Å²	13	26 Å²	26	8%	0.08	15%	0.154	C	C	.	.	S	Bend	trans	-83.4	-6.1	173.1	49.7	0	0	0	0	114	P217 F343	P217-T220 HydrophobicContact CB-CG2 4.22Å; P217-T220 HydrophobicContact CG-CG2 4.46Å; P217-T220 PolarHBondContact O-OG1 3.22Å; T220-F343 HydrophobicContact CG2-CB 4.43Å
221	G	85.2	Confident	87.6	Confident	26 Å²	26	25 Å²	25	27%	0.268	15%	0.153	S	C	.	.	S	Bend	trans	95.2	19.4	173.8	0	0	0	0	0	116.2	T223 L224 L225	G221-T223 PolarHBondContact O-N 3.36Å; G221-L224 WeakPolarHBondContact O-CA 3.45Å; G221-L224 WeakPolarHBondContact O-CB 3.48Å; G221-L224 PolarHBondContact O-N 3.25Å; G221-L225 PolarHBondContact O-N 3.41Å
222	K	88.8	Confident	87.3	Confident	9 Å²	9	29.2 Å²	29.2	4%	0.039	17%	0.172	C	C	.	.	H	α-helix	trans	-53.1	-50.5	177.1	-57.1	177.3	-159.5	156.5	0	113.4	L214 Y215 G216 L224 L225 A226 A320 T321 N322 F343	L214-K222 HydrophobicContact CB-CB 4.26Å; L214-K222 HydrophobicContact CB-CD 4.34Å; L214-K222 HydrophobicContact CB-CG 4.33Å; L214-K222 HydrophobicContact CD1-CB 4.39Å; Y215-K222 VanDerWaalsContact C-CE 3.46Å; G216-K222 VanDerWaalsContact C-NZ 3.31Å; G216-K222 VanDerWaalsContact N-CE 3.29Å; G216-K222 VanDerWaalsContact N-NZ 3.17Å; G216-K222 WeakPolarHBondContact O-CE 3.31Å; G216-K222 PolarHBondContact O-NZ 2.57Å; K222-L224 VanDerWaalsContact C-N 3.25Å; K222-L224 PolarHBondContact O-N 3.46Å; K222-L225 PolarHBondContact O-N 2.61Å; K222-A226 PolarHBondContact O-N 2.81Å; K222-A226 VanDerWaalsContact O-N 3.11Å; K222-A320 HydrophobicContact CB-CB 4.45Å; K222-T321 PolarHBondContact NZ-O 2.8Å; K222-N322 PolarHBondContact NZ-OD1 3.39Å; K222-F343 HydrophobicContact CB-CZ 4.45Å; K222-F343 HydrophobicContact CD-CD2 4.49Å; K222-F343 HydrophobicContact CG-CB 4.45Å; K222-F343 HydrophobicContact CG-CD1 4Å; K222-F343 HydrophobicContact CG-CD2 3.85Å; K222-F343 HydrophobicContact CG-CE1 4.14Å; K222-F343 HydrophobicContact CG-CE2 4.04Å; K222-F343 HydrophobicContact CG-CG 3.83Å; K222-F343 HydrophobicContact CG-CZ 4.16Å
223	T	85.9	Confident	86.7	Confident	36 Å²	36	30.2 Å²	30.2	22%	0.221	18%	0.178	C	C	.	.	H	α-helix	trans	-65.6	-30.5	177.7	-45.4	0	0	0	0	111.7	G221 R227 F273 D275	G221-T223 PolarHBondContact O-N 3.36Å; T223-R227 VanDerWaalsContact O-CG 3.31Å; T223-R227 WeakPolarHBondContact O-CG 3.47Å; T223-R227 PolarHBondContact O-N 2.9Å; T223-F273 HydrophobicContact CG2-CE1 4.02Å; T223-F273 HydrophobicContact CG2-CZ 4.2Å; T223-D275 WeakPolarHBondContact CG2-OD2 3.45Å; T223-D275 PolarHBondContact OG1-OD2 3.37Å
224	L	87.5	Confident	86.1	Confident	56 Å²	56	38 Å²	38	29%	0.293	21%	0.212	S	C	.	.	H	α-helix	trans	-69.9	-46.1	176.8	-164.2	171.7	0	0	0	110	I177 G221 K222 A226 R227 A228	I177-L224 HydrophobicContact CD1-CD2 3.61Å; I177-L224 HydrophobicContact CG1-CD2 3.48Å; I177-L224 VanDerWaalsContact CG1-CD2 3.48Å; G221-L224 WeakPolarHBondContact O-CA 3.45Å; G221-L224 WeakPolarHBondContact O-CB 3.48Å; G221-L224 PolarHBondContact O-N 3.25Å; K222-L224 VanDerWaalsContact C-N 3.25Å; K222-L224 PolarHBondContact O-N 3.46Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 3.35Å; L224-R227 PolarHBondContact O-N 3.47Å; L224-A228 PolarHBondContact O-N 3.32Å
225	L	89.5	Confident	85.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-43.3	177	-173.8	67.2	0	0	0	112	Y174 I177 I184 L187 G221 K222 R227 A228 C229 F343	Y174-L225 HydrophobicContact CD1-CD1 4.48Å; Y174-L225 HydrophobicContact CE1-CD1 4.46Å; I177-L225 HydrophobicContact CD1-CB 4.29Å; I177-L225 HydrophobicContact CD1-CD1 3.54Å; I184-L225 HydrophobicContact CB-CD1 4.4Å; I184-L225 HydrophobicContact CG1-CD1 3.48Å; I184-L225 VanDerWaalsContact CG1-CD1 3.48Å; L187-L225 HydrophobicContact CB-CD2 4.35Å; L187-L225 HydrophobicContact CD2-CD1 4.27Å; L187-L225 HydrophobicContact CD2-CD2 3.62Å; L187-L225 HydrophobicContact CD2-CG 3.54Å; G221-L225 PolarHBondContact O-N 3.41Å; K222-L225 PolarHBondContact O-N 2.61Å; L225-R227 PolarHBondContact O-N 2.86Å; L225-A228 PolarHBondContact O-N 3.44Å; L225-C229 WeakPolarHBondContact O-CB 3.22Å; L225-C229 PolarHBondContact O-N 2.8Å; L225-F343 HydrophobicContact CB-CE1 4.41Å; L225-F343 HydrophobicContact CB-CZ 4.33Å; L225-F343 HydrophobicContact CD2-CE1 4.08Å; L225-F343 HydrophobicContact CD2-CZ 3.54Å
226	A	86	Confident	85.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-41.8	176.4	0	0	0	0	0	112.5	K222 L224 C229 A230 F273 I318	K222-A226 PolarHBondContact O-N 2.81Å; K222-A226 VanDerWaalsContact O-N 3.11Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 3.35Å; A226-C229 PolarHBondContact O-N 2.88Å; A226-A230 PolarHBondContact O-N 3.28Å; A226-A230 VanDerWaalsContact O-N 3.1Å; A226-F273 HydrophobicContact CB-CD2 3.43Å; A226-F273 VanDerWaalsContact CB-CD2 3.43Å; A226-F273 HydrophobicContact CB-CE1 4.39Å; A226-F273 HydrophobicContact CB-CE2 3.29Å; A226-F273 HydrophobicContact CB-CG 4.07Å; A226-F273 HydrophobicContact CB-CZ 3.82Å; A226-I318 HydrophobicContact CB-CG2 4.41Å
227	R	83.6	Confident	85	Confident	108 Å²	108	38.4 Å²	38.4	41%	0.408	22%	0.216	S	C	.	.	H	α-helix	trans	-65.9	-42.3	175.3	-71.7	179.7	-153.7	178.8	7.4	112.3	P170 T223 L224 L225 C229 A230 A231	P170-R227 HydrophobicContact CB-CB 4.02Å; P170-R227 HydrophobicContact CG-CB 4.05Å; P170-R227 VanDerWaalsContact CG-O 3.25Å; P170-R227 WeakPolarHBondContact CG-O 3.33Å; T223-R227 VanDerWaalsContact O-CG 3.31Å; T223-R227 WeakPolarHBondContact O-CG 3.47Å; T223-R227 PolarHBondContact O-N 2.9Å; L224-R227 PolarHBondContact O-N 3.47Å; L225-R227 PolarHBondContact O-N 2.86Å; R227-C229 VanDerWaalsContact C-N 3.31Å; R227-C229 PolarHBondContact O-N 3.39Å; R227-A230 WeakPolarHBondContact O-CB 3.38Å; R227-A230 PolarHBondContact O-N 3.29Å; R227-A231 PolarHBondContact O-N 3.38Å
228	A	86.1	Confident	85	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-37.7	176.8	0	0	0	0	0	111.8	E172 Y174 I177 L224 L225 A231 Q232	E172-A228 HydrophobicContact CB-CB 4.31Å; Y174-A228 HydrophobicContact CD1-CB 4.22Å; Y174-A228 HydrophobicContact CE1-CB 4.31Å; I177-A228 HydrophobicContact CD1-CB 3.8Å; L224-A228 PolarHBondContact O-N 3.32Å; L225-A228 PolarHBondContact O-N 3.44Å; A228-A231 WeakPolarHBondContact O-CB 3.5Å; A228-A231 PolarHBondContact O-N 2.91Å; A228-Q232 WeakPolarHBondContact O-CG 3.33Å; A228-Q232 PolarHBondContact O-N 3.17Å
229	C	85.8	Confident	85.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-44.5	174.1	-171.8	0	0	0	0	111.7	Y174 L187 L225 A226 R227 A231 Q232 T233	Y174-C229 WeakPolarHBondContact OH-CA 3.49Å; L187-C229 HydrophobicContact CD2-CB 3.93Å; L225-C229 WeakPolarHBondContact O-CB 3.22Å; L225-C229 PolarHBondContact O-N 2.8Å; A226-C229 PolarHBondContact O-N 2.88Å; R227-C229 VanDerWaalsContact C-N 3.31Å; R227-C229 PolarHBondContact O-N 3.39Å; C229-A231 VanDerWaalsContact C-N 3.35Å; C229-A231 PolarHBondContact O-N 2.91Å; C229-Q232 PolarHBondContact O-N 3.45Å; C229-T233 WeakPolarHBondContact O-CG2 3.5Å; C229-T233 PolarHBondContact O-N 3.08Å; C229-T233 PolarHBondContact O-OG1 3.17Å
230	A	82.6	Confident	85.4	Confident	7 Å²	7	34.6 Å²	34.6	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-39	177.5	0	0	0	0	0	113	P170 A226 R227 Q232 F237	P170-A230 HydrophobicContact CG-CB 4.42Å; A226-A230 PolarHBondContact O-N 3.28Å; A226-A230 VanDerWaalsContact O-N 3.1Å; R227-A230 WeakPolarHBondContact O-CB 3.38Å; R227-A230 PolarHBondContact O-N 3.29Å; A230-Q232 VanDerWaalsContact C-N 3.26Å; A230-Q232 PolarHBondContact O-N 2.84Å; A230-F237 HydrophobicContact CB-CB 3.97Å; A230-F237 HydrophobicContact CB-CD1 4.29Å; A230-F237 HydrophobicContact CB-CD2 3.27Å; A230-F237 HydrophobicContact CB-CE2 3.69Å; A230-F237 HydrophobicContact CB-CG 3.59Å; A230-F237 HydrophobicContact CB-CZ 4.36Å
231	A	82.8	Confident	85.5	Confident	22 Å²	22	35 Å²	35	18%	0.182	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-37.6	177.1	0	0	0	0	0	112.4	P170 E172 R227 A228 C229	P170-A231 HydrophobicContact CG-CB 4.3Å; P170-A231 WeakPolarHBondContact O-CB 3.27Å; E172-A231 WeakPolarHBondContact O-CB 3.14Å; R227-A231 PolarHBondContact O-N 3.38Å; A228-A231 WeakPolarHBondContact O-CB 3.5Å; A228-A231 PolarHBondContact O-N 2.91Å; C229-A231 VanDerWaalsContact C-N 3.35Å; C229-A231 PolarHBondContact O-N 2.91Å
232	Q	81.8	Confident	85.6	Confident	94 Å²	94	33.8 Å²	33.8	44%	0.439	17%	0.169	S	C	.	.	H	α-helix	trans	-86	-35	-172.3	-66.9	-70.1	-25.9	0	0	113.2	Y174 A228 C229 A230 K234	Y174-Q232 HydrophobicContact CD2-CG 3.97Å; Y174-Q232 HydrophobicContact CE2-CB 3.92Å; Y174-Q232 HydrophobicContact CE2-CG 3.53Å; A228-Q232 WeakPolarHBondContact O-CG 3.33Å; A228-Q232 PolarHBondContact O-N 3.17Å; C229-Q232 PolarHBondContact O-N 3.45Å; A230-Q232 VanDerWaalsContact C-N 3.26Å; A230-Q232 PolarHBondContact O-N 2.84Å; Q232-K234 VanDerWaalsContact C-N 3.27Å; Q232-K234 PolarHBondContact O-N 2.84Å
233	T	78.6	Confident	85.5	Confident	24 Å²	24	36.3 Å²	36.3	15%	0.147	19%	0.186	C	C	.	.	H	α-helix	trans	-77	-7.7	-176.7	54.3	0	0	0	0	114.4	V192 M195 C229 S235 I271	V192-T233 HydrophobicContact CB-CG2 4.42Å; V192-T233 HydrophobicContact CG1-CG2 4.48Å; V192-T233 HydrophobicContact CG2-CG2 3.7Å; M195-T233 HydrophobicContact SD-CG2 4.41Å; C229-T233 WeakPolarHBondContact O-CG2 3.5Å; C229-T233 PolarHBondContact O-N 3.08Å; C229-T233 PolarHBondContact O-OG1 3.17Å; T233-S235 PolarHBondContact O-N 3.11Å; T233-S235 PolarHBondContact O-OG 3.34Å; T233-I271 HydrophobicContact CG2-CD1 4.2Å; T233-I271 WeakPolarHBondContact OG1-CD1 3.31Å
234	K	79.8	Confident	85.6	Confident	164 Å²	164	39 Å²	39	71%	0.713	20%	0.196	S	C	*	.			trans	47.3	25.3	-174.3	-61.8	-178.9	-178.3	175.2	0	113.5	Q232	Q232-K234 VanDerWaalsContact C-N 3.27Å; Q232-K234 PolarHBondContact O-N 2.84Å
235	S	80.3	Confident	85.6	Confident	18 Å²	18	36.3 Å²	36.3	13%	0.126	18%	0.182	C	C	.	.			trans	-97.5	160.2	-176.4	-59.3	0	0	0	0	110.1	M195 T233 F237	M195-S235 WeakPolarHBondContact CE-OG 3.29Å; T233-S235 PolarHBondContact O-N 3.11Å; T233-S235 PolarHBondContact O-OG 3.34Å; S235-F237 PolarHBondContact O-N 3.49Å
236	T	84.6	Confident	85.4	Confident	36 Å²	36	39.3 Å²	39.3	22%	0.221	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	123.9	177.1	-51.3	0	0	0	0	109.1	L238 K267 P269 A270 I271	T236-L238 HydrophobicContact CG2-CD1 3.84Å; T236-K267 HydrophobicContact CG2-CB 3.83Å; T236-K267 HydrophobicContact CG2-CD 3.84Å; T236-K267 HydrophobicContact CG2-CG 4.47Å; T236-K267 PolarHBondContact OG1-O 3.43Å; T236-K267 VanDerWaalsContact OG1-O 3.05Å; T236-P269 PolarHBondContact N-O 3.39Å; T236-P269 VanDerWaalsContact N-O 3.12Å; T236-A270 CarbonylContact O-C 3.48Å; T236-A270 VanDerWaalsContact O-CA 3.32Å; T236-A270 WeakPolarHBondContact O-CA 3.31Å; T236-I271 PolarHBondContact O-N 3.15Å
237	F	88.1	Confident	85.5	Confident	16 Å²	16	41.5 Å²	41.5	7%	0.07	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.5	-179.6	-175.1	-103.8	0	0	0	110.1	V166 A230 S235 K239 I271 F273	V166-F237 HydrophobicContact CB-CD1 4.08Å; V166-F237 HydrophobicContact CG2-CD1 3.65Å; V166-F237 HydrophobicContact CG2-CE1 4.16Å; V166-F237 PolarHBondContact N-O 2.95Å; A230-F237 HydrophobicContact CB-CB 3.97Å; A230-F237 HydrophobicContact CB-CD1 4.29Å; A230-F237 HydrophobicContact CB-CD2 3.27Å; A230-F237 HydrophobicContact CB-CE2 3.69Å; A230-F237 HydrophobicContact CB-CG 3.59Å; A230-F237 HydrophobicContact CB-CZ 4.36Å; S235-F237 PolarHBondContact O-N 3.49Å; F237-K239 HydrophobicContact CD1-CB 4.43Å; F237-K239 HydrophobicContact CE1-CB 3.94Å; F237-I271 HydrophobicContact CD2-CB 4.25Å; F237-I271 HydrophobicContact CD2-CG2 4.17Å; F237-I271 HydrophobicContact CE2-CG2 4.35Å; F237-F273 HydrophobicContact CD2-CB 4.5Å; F237-F273 HydrophobicContact CE1-CB 4.28Å; F237-F273 HydrophobicContact CE2-CB 3.44Å; F237-F273 VanDerWaalsContact CE2-CB 3.44Å; F237-F273 HydrophobicContact CE2-CG 4.21Å; F237-F273 HydrophobicContact CZ-CB 3.3Å; F237-F273 AromaticContact CZ-CD1 3.91Å; F237-F273 HydrophobicContact CZ-CD1 3.91Å; F237-F273 AromaticContact CZ-CG 3.77Å; F237-F273 HydrophobicContact CZ-CG 3.77Å
238	L	89.1	Confident	85.5	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	116	174.8	-70.2	88.9	0	0	0	108.4	T236 L263 A264 A270 I271 I272 F273	T236-L238 HydrophobicContact CG2-CD1 3.84Å; L238-L263 HydrophobicContact CD2-CB 4.42Å; L238-L263 HydrophobicContact CD2-CD2 4.05Å; L238-L263 HydrophobicContact CD2-CG 4.33Å; L238-A264 HydrophobicContact CD1-CB 4.17Å; L238-A264 HydrophobicContact CD2-CB 4.32Å; L238-A270 HydrophobicContact CD1-CB 4.09Å; L238-I271 PolarHBondContact N-O 2.83Å; L238-I272 HydrophobicContact CB-CG1 4.36Å; L238-F273 PolarHBondContact O-N 2.94Å
239	K	90.3	Very high	85.6	Confident	84 Å²	84	52.3 Å²	52.3	37%	0.365	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.8	177.5	-177.8	-175.3	174.2	-167	0	109.8	M164 V166 F237 F273	M164-K239 WeakPolarHBondContact CB-O 3.46Å; M164-K239 WeakPolarHBondContact CG-O 3.41Å; M164-K239 PolarHBondContact O-N 2.87Å; V166-K239 HydrophobicContact CG2-CB 3.73Å; F237-K239 HydrophobicContact CD1-CB 4.43Å; F237-K239 HydrophobicContact CE1-CB 3.94Å; K239-F273 HydrophobicContact CG-CD1 4.38Å
240	L	90.1	Very high	85.6	Confident	7 Å²	7	59 Å²	59	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.4	176.3	-166.8	70.1	0	0	0	109.2	M164 L245 F273 I274 D275	M164-L240 HydrophobicContact CE-CD1 3.46Å; M164-L240 VanDerWaalsContact CE-CD1 3.46Å; M164-L240 HydrophobicContact SD-CD1 3.33Å; M164-L240 WeakPolarHBondContact SD-CD1 3.42Å; L240-L245 HydrophobicContact CD1-CD2 3.85Å; L240-L245 HydrophobicContact CD1-CG 4.25Å; L240-L245 HydrophobicContact CD2-CD1 3.69Å; L240-L245 HydrophobicContact CD2-CD2 4.05Å; L240-L245 HydrophobicContact CD2-CG 4.12Å; L240-L245 HydrophobicContact CG-CD1 4.22Å; L240-L245 HydrophobicContact CG-CD2 4.25Å; L240-L245 HydrophobicContact CG-CG 4.21Å; L240-F273 PolarHBondContact N-O 3.23Å; L240-F273 VanDerWaalsContact O-O 3.11Å; L240-I274 HydrophobicContact CB-CG1 4.37Å; L240-I274 HydrophobicContact CD2-CD1 4.27Å; L240-I274 HydrophobicContact CD2-CG1 3.99Å; L240-I274 CarbonylContact O-C 3.58Å; L240-I274 VanDerWaalsContact O-CA 3.32Å; L240-I274 WeakPolarHBondContact O-CA 3.46Å; L240-D275 PolarHBondContact O-N 3.42Å
241	A	90.1	Very high	85.8	Confident	23 Å²	23	59.4 Å²	59.4	19%	0.19	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.9	169.2	0	0	0	0	0	109.6	P243 Q244	A241-P243 VanDerWaalsContact C-N 3.33Å; A241-Q244 HydrophobicContact CB-CG 4.01Å; A241-Q244 WeakPolarHBondContact O-CB 3.42Å; A241-Q244 PolarHBondContact O-N 2.88Å
242	G	86	Confident	86.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-47.9	-47.2	179	0	0	0	0	0	113.8	Q244 L245 D275 I280	G242-Q244 VanDerWaalsContact C-N 3.26Å; G242-Q244 PolarHBondContact O-N 3.36Å; G242-L245 WeakPolarHBondContact O-CB 3.22Å; G242-L245 PolarHBondContact O-N 3.5Å; G242-L245 VanDerWaalsContact O-N 3.17Å; G242-D275 PolarHBondContact N-O 3.08Å; G242-I280 WeakPolarHBondContact O-CG2 3.43Å
243	P	87.6	Confident	86.4	Confident	62 Å²	62	56.9 Å²	56.9	40%	0.403	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-61.6	-26.8	177.3	-26.3	35.3	0	0	0	115	A241 L245 V246 E276 A279	A241-P243 VanDerWaalsContact C-N 3.33Å; P243-L245 PolarHBondContact O-N 2.9Å; P243-V246 PolarHBondContact O-N 3.27Å; P243-E276 WeakPolarHBondContact CG-OE2 3.33Å; P243-A279 HydrophobicContact CG-CB 3.98Å
244	Q	87.9	Confident	87	Confident	92 Å²	92	56.2 Å²	56.2	43%	0.43	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-68.9	-21.7	179.3	-68.9	174.4	-30.7	0	0	112.6	M164 A241 G242 V246 Q247	M164-Q244 HydrophobicContact CE-CB 4.14Å; A241-Q244 HydrophobicContact CB-CG 4.01Å; A241-Q244 WeakPolarHBondContact O-CB 3.42Å; A241-Q244 PolarHBondContact O-N 2.88Å; G242-Q244 VanDerWaalsContact C-N 3.26Å; G242-Q244 PolarHBondContact O-N 3.36Å; Q244-V246 VanDerWaalsContact C-N 3.27Å; Q244-Q247 PolarHBondContact O-NE2 2.85Å
245	L	86.5	Confident	87.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-77.1	-15.2	176.8	-66.8	176.4	0	0	0	112.9	L240 G242 P243 G253 L256 V257 I280	L240-L245 HydrophobicContact CD1-CD2 3.85Å; L240-L245 HydrophobicContact CD1-CG 4.25Å; L240-L245 HydrophobicContact CD2-CD1 3.69Å; L240-L245 HydrophobicContact CD2-CD2 4.05Å; L240-L245 HydrophobicContact CD2-CG 4.12Å; L240-L245 HydrophobicContact CG-CD1 4.22Å; L240-L245 HydrophobicContact CG-CD2 4.25Å; L240-L245 HydrophobicContact CG-CG 4.21Å; G242-L245 WeakPolarHBondContact O-CB 3.22Å; G242-L245 PolarHBondContact O-N 3.5Å; G242-L245 VanDerWaalsContact O-N 3.17Å; P243-L245 PolarHBondContact O-N 2.9Å; L245-G253 VanDerWaalsContact O-CA 3.31Å; L245-G253 WeakPolarHBondContact O-CA 3.49Å; L245-L256 HydrophobicContact CD2-CD2 3.96Å; L245-L256 HydrophobicContact CD2-CG 4.37Å; L245-V257 HydrophobicContact CD1-CG2 4.13Å; L245-V257 HydrophobicContact CD2-CG2 3.55Å; L245-V257 HydrophobicContact CG-CG2 4.39Å; L245-I280 HydrophobicContact CB-CG2 4.11Å; L245-I280 HydrophobicContact CD1-CD1 3.58Å
246	V	86.2	Confident	88	Confident	62 Å²	62	52.2 Å²	52.2	38%	0.376	27%	0.268	S	S	.	.			trans	-87.8	114.1	178	-174.1	0	0	0	0	108.8	P243 Q244 I280 V295	P243-V246 PolarHBondContact O-N 3.27Å; Q244-V246 VanDerWaalsContact C-N 3.27Å; V246-I280 HydrophobicContact CG2-CG2 4.06Å; V246-V295 HydrophobicContact CG1-CG2 3.96Å; V246-V295 HydrophobicContact CG2-CG2 4.02Å
247	Q	87.1	Confident	88.2	Confident	47 Å²	47	50.5 Å²	50.5	22%	0.22	26%	0.258	C	S	.	.			trans	-121.7	152.6	-175.6	-65.5	-62.2	-37.7	0	0	111.1	Q244 F249 D252	Q244-Q247 PolarHBondContact O-NE2 2.85Å; Q247-F249 VanDerWaalsContact C-N 3.35Å; Q247-D252 HydrophobicContact CB-CB 3.81Å; Q247-D252 HydrophobicContact CG-CB 4.03Å
248	M	85.1	Confident	88.3	Confident	188 Å²	188	55.6 Å²	55.6	93%	0.926	28%	0.277	S	S	*	.	S	Bend	trans	-71.1	-31.1	179.6	-65.3	-176.5	177.6	0	0	112.6
249	F	86.7	Confident	88.3	Confident	146 Å²	146	56.5 Å²	56.5	64%	0.64	28%	0.282	S	S	*	.	S	Bend	trans	-90.2	138	179.4	-60.1	-73.3	0	0	0	110.9	Q247 G251 D252	Q247-F249 VanDerWaalsContact C-N 3.35Å; F249-G251 PolarHBondContact O-N 2.94Å; F249-D252 HydrophobicContact CB-CB 4.4Å; F249-D252 WeakPolarHBondContact CB-OD2 3.5Å; F249-D252 WeakPolarHBondContact CD2-OD2 3.25Å; F249-D252 PolarHBondContact O-N 2.88Å
250	I	86.4	Confident	88.2	Confident	141 Å²	141	52.8 Å²	52.8	72%	0.723	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	102.4	-178.1	-61.9	168.3	0	0	0	108.8	R297	I250-R297 PolarHBondContact O-NH2 3.22Å
251	G	86.7	Confident	88.2	Confident	15 Å²	15	52.7 Å²	52.7	16%	0.155	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	111.9	-7.4	165.6	0	0	0	0	0	114.4	F249 G253 A254 K255 E294	F249-G251 PolarHBondContact O-N 2.94Å; G251-G253 VanDerWaalsContact C-N 3.27Å; G251-G253 PolarHBondContact O-N 3.24Å; G251-A254 PolarHBondContact O-N 3.16Å; G251-K255 WeakPolarHBondContact O-CB 3.48Å; G251-K255 PolarHBondContact O-N 3.34Å; G251-E294 WeakPolarHBondContact CA-OE1 3.36Å; G251-E294 PolarHBondContact N-OE1 3.11Å
252	D	89	Confident	88	Confident	63 Å²	63	55.8 Å²	55.8	34%	0.337	28%	0.277	S	S	.	.	H	α-helix	trans	-61.2	-40.8	174	-78.2	8.4	0	0	0	110.4	Q247 F249 A254 K255 L256	Q247-D252 HydrophobicContact CB-CB 3.81Å; Q247-D252 HydrophobicContact CG-CB 4.03Å; F249-D252 HydrophobicContact CB-CB 4.4Å; F249-D252 WeakPolarHBondContact CB-OD2 3.5Å; F249-D252 WeakPolarHBondContact CD2-OD2 3.25Å; F249-D252 PolarHBondContact O-N 2.88Å; D252-A254 PolarHBondContact O-N 3.28Å; D252-K255 PolarHBondContact O-N 2.91Å; D252-L256 VanDerWaalsContact O-CB 3.31Å; D252-L256 WeakPolarHBondContact O-CB 3.47Å; D252-L256 PolarHBondContact O-N 3.42Å
253	G	88.9	Confident	88.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-40.4	176.4	0	0	0	0	0	112.9	L245 G251 L256 V257	L245-G253 VanDerWaalsContact O-CA 3.31Å; L245-G253 WeakPolarHBondContact O-CA 3.49Å; G251-G253 VanDerWaalsContact C-N 3.27Å; G251-G253 PolarHBondContact O-N 3.24Å; G253-L256 PolarHBondContact O-N 2.73Å; G253-V257 WeakPolarHBondContact O-CG2 3.48Å; G253-V257 PolarHBondContact O-N 3.38Å; G253-V257 VanDerWaalsContact O-N 3.09Å
254	A	89.7	Confident	88.1	Confident	10 Å²	10	53.2 Å²	53.2	8%	0.083	26%	0.259	C	S	.	.	H	α-helix	trans	-70.3	-35.3	177.4	0	0	0	0	0	111.9	G251 D252 R258 E301	G251-A254 PolarHBondContact O-N 3.16Å; D252-A254 PolarHBondContact O-N 3.28Å; A254-R258 WeakPolarHBondContact O-CG 3.25Å; A254-R258 PolarHBondContact O-N 3.21Å; A254-R258 PolarHBondContact O-NE 3.01Å; A254-E301 HydrophobicContact CB-CB 4.02Å; A254-E301 HydrophobicContact CB-CG 4.06Å
255	K	90.2	Very high	88	Confident	94 Å²	94	52.3 Å²	52.3	41%	0.409	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-45.6	171	-172.5	-171.4	171.5	-163.6	0	110.9	G251 D252 V257 R258 D259	G251-K255 WeakPolarHBondContact O-CB 3.48Å; G251-K255 PolarHBondContact O-N 3.34Å; D252-K255 PolarHBondContact O-N 2.91Å; K255-V257 VanDerWaalsContact C-N 3.32Å; K255-V257 PolarHBondContact O-N 3.47Å; K255-R258 WeakPolarHBondContact O-CB 3.33Å; K255-R258 PolarHBondContact O-N 3.46Å; K255-R258 VanDerWaalsContact O-N 3.11Å; K255-D259 WeakPolarHBondContact CE-OD2 3.46Å; K255-D259 PolarHBondContact O-N 3.19Å
256	L	90.7	Very high	88	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-41.4	-180	-166.1	72.1	0	0	0	112.2	D158 R160 V161 M164 L245 D252 G253 A260	D158-L256 HydrophobicContact CB-CD1 4.44Å; R160-L256 HydrophobicContact CB-CD1 3.88Å; V161-L256 HydrophobicContact CG2-CD1 3.47Å; V161-L256 VanDerWaalsContact CG2-CD1 3.47Å; V161-L256 HydrophobicContact CG2-CG 4.24Å; M164-L256 HydrophobicContact CE-CD1 4.45Å; M164-L256 HydrophobicContact CE-CD2 3.88Å; M164-L256 HydrophobicContact CE-CG 4.29Å; L245-L256 HydrophobicContact CD2-CD2 3.96Å; L245-L256 HydrophobicContact CD2-CG 4.37Å; D252-L256 VanDerWaalsContact O-CB 3.31Å; D252-L256 WeakPolarHBondContact O-CB 3.47Å; D252-L256 PolarHBondContact O-N 3.42Å; G253-L256 PolarHBondContact O-N 2.73Å; L256-A260 WeakPolarHBondContact O-CB 3.46Å; L256-A260 PolarHBondContact O-N 3.29Å
257	V	90.5	Very high	88	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-47.8	174	173.4	0	0	0	0	111.1	L245 G253 K255 D259 A260 F261 E301 L302 Q305	L245-V257 HydrophobicContact CD1-CG2 4.13Å; L245-V257 HydrophobicContact CD2-CG2 3.55Å; L245-V257 HydrophobicContact CG-CG2 4.39Å; G253-V257 WeakPolarHBondContact O-CG2 3.48Å; G253-V257 PolarHBondContact O-N 3.38Å; G253-V257 VanDerWaalsContact O-N 3.09Å; K255-V257 VanDerWaalsContact C-N 3.32Å; K255-V257 PolarHBondContact O-N 3.47Å; V257-D259 PolarHBondContact O-N 3.31Å; V257-A260 PolarHBondContact O-N 2.89Å; V257-F261 HydrophobicContact CG1-CD2 3.79Å; V257-F261 HydrophobicContact CG1-CE2 3.75Å; V257-F261 VanDerWaalsContact O-CD2 3.22Å; V257-F261 WeakPolarHBondContact O-CD2 3.41Å; V257-F261 PolarHBondContact O-N 3.33Å; V257-F261 VanDerWaalsContact O-N 3.08Å; V257-E301 HydrophobicContact CG1-CG 4.47Å; V257-L302 HydrophobicContact CG1-CB 4.14Å; V257-L302 HydrophobicContact CG1-CD1 4.15Å; V257-Q305 HydrophobicContact CG1-CG 4.18Å
258	R	88.6	Confident	87.8	Confident	122 Å²	122	57.6 Å²	57.6	46%	0.46	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-45.6	178.4	-73.7	-175.8	-70.4	164.3	-0.2	112.2	A254 K255 A260 F261 Q262 E301	A254-R258 WeakPolarHBondContact O-CG 3.25Å; A254-R258 PolarHBondContact O-N 3.21Å; A254-R258 PolarHBondContact O-NE 3.01Å; K255-R258 WeakPolarHBondContact O-CB 3.33Å; K255-R258 PolarHBondContact O-N 3.46Å; K255-R258 VanDerWaalsContact O-N 3.11Å; R258-A260 VanDerWaalsContact C-N 3.35Å; R258-A260 PolarHBondContact O-N 3.26Å; R258-F261 PolarHBondContact O-N 3.1Å; R258-Q262 WeakPolarHBondContact O-CB 3.48Å; R258-Q262 PolarHBondContact O-N 3.32Å; R258-E301 VanDerWaalsContact CD-OE1 3.27Å; R258-E301 WeakPolarHBondContact CD-OE1 3.31Å; R258-E301 HydrophobicContact CG-CG 4.04Å; R258-E301 WeakPolarHBondContact CG-OE1 3.33Å
259	D	89.7	Confident	87.9	Confident	26 Å²	26	51.2 Å²	51.2	14%	0.139	25%	0.254	C	S	.	.	H	α-helix	trans	-64.1	-39.9	179.4	-69.4	-2.9	0	0	0	111	F157 V161 K255 V257 Q262 L263	F157-D259 HydrophobicContact CD1-CB 4.25Å; V161-D259 HydrophobicContact CG2-CB 3.86Å; K255-D259 WeakPolarHBondContact CE-OD2 3.46Å; K255-D259 PolarHBondContact O-N 3.19Å; V257-D259 PolarHBondContact O-N 3.31Å; D259-Q262 PolarHBondContact O-N 3.03Å; D259-L263 WeakPolarHBondContact O-CB 3.34Å; D259-L263 PolarHBondContact O-N 3.36Å
260	A	89.2	Confident	87.9	Confident	6 Å²	6	44.3 Å²	44.3	5%	0.05	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-42.8	176.2	0	0	0	0	0	112.9	V161 L256 V257 R258 A264	V161-A260 HydrophobicContact CG1-CB 4.08Å; L256-A260 WeakPolarHBondContact O-CB 3.46Å; L256-A260 PolarHBondContact O-N 3.29Å; V257-A260 PolarHBondContact O-N 2.89Å; R258-A260 VanDerWaalsContact C-N 3.35Å; R258-A260 PolarHBondContact O-N 3.26Å; A260-A264 WeakPolarHBondContact O-CB 3.38Å; A260-A264 PolarHBondContact O-N 2.94Å
261	F	88.6	Confident	88	Confident	5 Å²	5	37.6 Å²	37.6	2%	0.022	19%	0.19	C	C	.	.	H	α-helix	trans	-70.5	-35.2	175.8	-80.9	-69.2	0	0	0	112.9	V257 R258 A264 K265 I272 L302 Q305 L306 F309 V317	V257-F261 HydrophobicContact CG1-CD2 3.79Å; V257-F261 HydrophobicContact CG1-CE2 3.75Å; V257-F261 VanDerWaalsContact O-CD2 3.22Å; V257-F261 WeakPolarHBondContact O-CD2 3.41Å; V257-F261 PolarHBondContact O-N 3.33Å; V257-F261 VanDerWaalsContact O-N 3.08Å; R258-F261 PolarHBondContact O-N 3.1Å; F261-A264 PolarHBondContact O-N 3.46Å; F261-K265 WeakPolarHBondContact O-CG 3.44Å; F261-K265 PolarHBondContact O-N 3.35Å; F261-I272 HydrophobicContact CD1-CD1 3.28Å; F261-I272 HydrophobicContact CE1-CD1 3.37Å; F261-I272 HydrophobicContact CG-CD1 4.19Å; F261-I272 HydrophobicContact CZ-CD1 4.25Å; F261-L302 HydrophobicContact CE2-CD1 3.58Å; F261-L302 HydrophobicContact CZ-CD1 3.83Å; F261-Q305 HydrophobicContact CD2-CB 3.46Å; F261-Q305 VanDerWaalsContact CD2-CB 3.46Å; F261-Q305 HydrophobicContact CD2-CG 3.79Å; F261-Q305 HydrophobicContact CE2-CB 3.53Å; F261-Q305 HydrophobicContact CE2-CG 4.23Å; F261-Q305 HydrophobicContact CG-CB 4.06Å; F261-Q305 HydrophobicContact CG-CG 4.48Å; F261-Q305 HydrophobicContact CZ-CB 4.14Å; F261-L306 HydrophobicContact CE1-CD2 4.38Å; F261-L306 HydrophobicContact CZ-CD2 3.94Å; F261-L306 HydrophobicContact CZ-CG 4.32Å; F261-F309 HydrophobicContact CD1-CE1 4.34Å; F261-F309 AromaticContact CD1-CE2 3.84Å; F261-F309 HydrophobicContact CD1-CE2 3.84Å; F261-F309 AromaticContact CD1-CZ 3.26Å; F261-F309 HydrophobicContact CD1-CZ 3.26Å; F261-F309 AromaticContact CE1-CE2 3.49Å; F261-F309 HydrophobicContact CE1-CE2 3.49Å; F261-F309 VanDerWaalsContact CE1-CE2 3.49Å; F261-F309 AromaticContact CE1-CZ 3.45Å; F261-F309 HydrophobicContact CE1-CZ 3.45Å; F261-F309 VanDerWaalsContact CE1-CZ 3.45Å; F261-F309 HydrophobicContact CG-CZ 4.1Å; F261-F309 HydrophobicContact CZ-CE2 4.25Å; F261-F309 HydrophobicContact CZ-CZ 4.47Å; F261-V317 HydrophobicContact CE1-CG2 4.12Å
262	Q	86.7	Confident	88.2	Confident	88 Å²	88	37.1 Å²	37.1	41%	0.411	18%	0.183	S	C	.	.	H	α-helix	trans	-67.5	-41.6	175.7	-171.7	65	19	0	0	111.3	F157 R258 D259 A264 K265 E266	F157-Q262 HydrophobicContact CE1-CB 3.81Å; F157-Q262 HydrophobicContact CE1-CG 3.64Å; F157-Q262 HydrophobicContact CZ-CG 4.07Å; R258-Q262 WeakPolarHBondContact O-CB 3.48Å; R258-Q262 PolarHBondContact O-N 3.32Å; D259-Q262 PolarHBondContact O-N 3.03Å; Q262-A264 VanDerWaalsContact C-N 3.3Å; Q262-A264 PolarHBondContact O-N 3.41Å; Q262-K265 WeakPolarHBondContact O-CB 3.4Å; Q262-K265 PolarHBondContact O-N 3.11Å; Q262-K265 VanDerWaalsContact O-N 3.13Å; Q262-E266 PolarHBondContact O-N 3.43Å; Q262-E266 VanDerWaalsContact O-N 3.08Å
263	L	87.7	Confident	88.3	Confident	7 Å²	7	34.2 Å²	34.2	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-40.9	172.5	-176.3	66.2	0	0	0	111.5	F157 V161 L238 D259 K265 E266 K267	F157-L263 HydrophobicContact CD1-CB 4.43Å; F157-L263 HydrophobicContact CD2-CD1 3.85Å; F157-L263 HydrophobicContact CE1-CB 4.45Å; F157-L263 HydrophobicContact CE2-CD1 3.89Å; F157-L263 HydrophobicContact CG-CD1 4.45Å; V161-L263 HydrophobicContact CG1-CB 4.18Å; V161-L263 HydrophobicContact CG1-CD2 3.67Å; L238-L263 HydrophobicContact CD2-CB 4.42Å; L238-L263 HydrophobicContact CD2-CD2 4.05Å; L238-L263 HydrophobicContact CD2-CG 4.33Å; D259-L263 WeakPolarHBondContact O-CB 3.34Å; D259-L263 PolarHBondContact O-N 3.36Å; L263-K265 VanDerWaalsContact C-N 3.29Å; L263-K265 PolarHBondContact O-N 2.97Å; L263-E266 PolarHBondContact O-N 3.24Å; L263-K267 HydrophobicContact CD1-CD 4.24Å; L263-K267 HydrophobicContact CD1-CG 4.47Å; L263-K267 HydrophobicContact CG-CD 4.46Å; L263-K267 PolarHBondContact O-N 3.12Å
264	A	87.7	Confident	88.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-32.2	175.9	0	0	0	0	0	112.9	L238 A260 F261 Q262 K267 A268 A270 I272 I315	L238-A264 HydrophobicContact CD1-CB 4.17Å; L238-A264 HydrophobicContact CD2-CB 4.32Å; A260-A264 WeakPolarHBondContact O-CB 3.38Å; A260-A264 PolarHBondContact O-N 2.94Å; F261-A264 PolarHBondContact O-N 3.46Å; Q262-A264 VanDerWaalsContact C-N 3.3Å; Q262-A264 PolarHBondContact O-N 3.41Å; A264-K267 CarbonylContact O-C 3.4Å; A264-A268 PolarHBondContact O-N 3.02Å; A264-A270 HydrophobicContact CB-CB 4.05Å; A264-I272 HydrophobicContact CB-CD1 3.74Å; A264-I272 HydrophobicContact CB-CG1 4.03Å; A264-I315 HydrophobicContact CB-CD1 4.19Å; A264-I315 HydrophobicContact CB-CG2 4.26Å
265	K	86.3	Confident	88.5	Confident	74 Å²	74	35.2 Å²	35.2	32%	0.322	17%	0.172	S	C	.	.	H	α-helix	trans	-67.7	-41.5	173.1	-72.6	175.2	-177.2	173.9	0	112.1	F261 Q262 L263 K267 A268 I315	F261-K265 WeakPolarHBondContact O-CG 3.44Å; F261-K265 PolarHBondContact O-N 3.35Å; Q262-K265 WeakPolarHBondContact O-CB 3.4Å; Q262-K265 PolarHBondContact O-N 3.11Å; Q262-K265 VanDerWaalsContact O-N 3.13Å; L263-K265 VanDerWaalsContact C-N 3.29Å; L263-K265 PolarHBondContact O-N 2.97Å; K265-K267 VanDerWaalsContact C-N 3.3Å; K265-K267 PolarHBondContact O-N 3.07Å; K265-A268 WeakPolarHBondContact O-CB 3.34Å; K265-I315 HydrophobicContact CB-CD1 4.26Å; K265-I315 HydrophobicContact CG-CD1 3.5Å; K265-I315 VanDerWaalsContact CG-CD1 3.5Å
266	E	86	Confident	88.5	Confident	101 Å²	101	35 Å²	35	47%	0.472	17%	0.173	S	C	.	.	H	α-helix	trans	-67.4	-32.9	176.7	-69.2	-171.9	176.9	0	0	112.6	P155 F157 Q262 L263	P155-E266 WeakPolarHBondContact CG-OE1 3.45Å; F157-E266 WeakPolarHBondContact CE2-OE2 3.43Å; F157-E266 VanDerWaalsContact CZ-CD 3.46Å; F157-E266 HydrophobicContact CZ-CG 4.4Å; F157-E266 WeakPolarHBondContact CZ-OE1 3.03Å; F157-E266 WeakPolarHBondContact CZ-OE2 3.39Å; Q262-E266 PolarHBondContact O-N 3.43Å; Q262-E266 VanDerWaalsContact O-N 3.08Å; L263-E266 PolarHBondContact O-N 3.24Å
267	K	86.4	Confident	88.4	Confident	70 Å²	70	35.1 Å²	35.1	30%	0.304	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	21.1	-178.7	-61.9	-166.5	170.3	-170.2	0	114.2	E165 T236 L263 A264 K265 P269	E165-K267 WeakPolarHBondContact OE1-CD 3.08Å; E165-K267 IonicContact OE1-NZ 3.95Å; E165-K267 PolarHBondContact OE1-NZ 2.85Å; E165-K267 IonicContact OE2-NZ 3.7Å; E165-K267 PolarHBondContact OE2-NZ 2.86Å; T236-K267 HydrophobicContact CG2-CB 3.83Å; T236-K267 HydrophobicContact CG2-CD 3.84Å; T236-K267 HydrophobicContact CG2-CG 4.47Å; T236-K267 PolarHBondContact OG1-O 3.43Å; T236-K267 VanDerWaalsContact OG1-O 3.05Å; L263-K267 HydrophobicContact CD1-CD 4.24Å; L263-K267 HydrophobicContact CD1-CG 4.47Å; L263-K267 HydrophobicContact CG-CD 4.46Å; L263-K267 PolarHBondContact O-N 3.12Å; A264-K267 CarbonylContact O-C 3.4Å; K265-K267 VanDerWaalsContact C-N 3.3Å; K265-K267 PolarHBondContact O-N 3.07Å; K267-P269 CarbonylContact O-C 3.55Å
268	A	83.3	Confident	88.3	Confident	48 Å²	48	36.6 Å²	36.6	40%	0.397	18%	0.181	S	C	.	.			trans	-57	130.7	176.5	0	0	0	0	0	110.4	A264 K265 D314	A264-A268 PolarHBondContact O-N 3.02Å; K265-A268 WeakPolarHBondContact O-CB 3.34Å; A268-D314 HydrophobicContact CB-CB 4.29Å
269	P	86.3	Confident	88.1	Confident	55 Å²	55	32.6 Å²	32.6	36%	0.357	17%	0.174	S	C	.	.	S	Bend	cis	-80.8	133.5	6.8	32.8	-35.8	0	0	0	114.3	M195 T236 K267 D314	M195-P269 HydrophobicContact CE-CB 3.53Å; M195-P269 HydrophobicContact CE-CG 4.46Å; T236-P269 PolarHBondContact N-O 3.39Å; T236-P269 VanDerWaalsContact N-O 3.12Å; K267-P269 CarbonylContact O-C 3.55Å; P269-D314 WeakPolarHBondContact CA-O 3.33Å; P269-D314 HydrophobicContact CB-CB 3.96Å
270	A	87.4	Confident	87.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	147.6	-173.1	0	0	0	0	0	113.6	T236 L238 A264 D314 I315 K316	T236-A270 CarbonylContact O-C 3.48Å; T236-A270 VanDerWaalsContact O-CA 3.32Å; T236-A270 WeakPolarHBondContact O-CA 3.31Å; L238-A270 HydrophobicContact CD1-CB 4.09Å; A264-A270 HydrophobicContact CB-CB 4.05Å; A270-D314 PolarHBondContact N-O 3.01Å; A270-I315 VanDerWaalsContact O-CA 3.31Å; A270-I315 WeakPolarHBondContact O-CA 3.44Å; A270-K316 PolarHBondContact O-N 2.83Å
271	I	88.6	Confident	87.4	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.3	174.2	-59.6	172	0	0	0	108	V191 M195 T233 T236 F237 L238 K316 I318	V191-I271 HydrophobicContact CG1-CD1 3.74Å; V191-I271 HydrophobicContact CG1-CG1 4.23Å; M195-I271 HydrophobicContact CE-CG1 4.31Å; M195-I271 HydrophobicContact SD-CD1 4.21Å; M195-I271 HydrophobicContact SD-CG1 4.28Å; T233-I271 HydrophobicContact CG2-CD1 4.2Å; T233-I271 WeakPolarHBondContact OG1-CD1 3.31Å; T236-I271 PolarHBondContact O-N 3.15Å; F237-I271 HydrophobicContact CD2-CB 4.25Å; F237-I271 HydrophobicContact CD2-CG2 4.17Å; F237-I271 HydrophobicContact CE2-CG2 4.35Å; L238-I271 PolarHBondContact N-O 2.83Å; I271-K316 WeakPolarHBondContact CA-O 3.49Å; I271-I318 HydrophobicContact CG2-CD1 3.71Å; I271-I318 HydrophobicContact CG2-CG1 4.1Å
272	I	90.5	Very high	87.1	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.9	174.7	-59	170.6	0	0	0	107.9	L238 F261 A264 I274 I315 K316 V317 I318	L238-I272 HydrophobicContact CB-CG1 4.36Å; F261-I272 HydrophobicContact CD1-CD1 3.28Å; F261-I272 HydrophobicContact CE1-CD1 3.37Å; F261-I272 HydrophobicContact CG-CD1 4.19Å; F261-I272 HydrophobicContact CZ-CD1 4.25Å; A264-I272 HydrophobicContact CB-CD1 3.74Å; A264-I272 HydrophobicContact CB-CG1 4.03Å; I272-I274 HydrophobicContact CG2-CG1 4.12Å; I272-I315 HydrophobicContact CD1-CG2 3.84Å; I272-I315 HydrophobicContact CG1-CG2 4.25Å; I272-K316 PolarHBondContact N-O 2.69Å; I272-V317 HydrophobicContact CB-CG2 4.43Å; I272-V317 WeakPolarHBondContact O-CA 3.23Å; I272-I318 PolarHBondContact O-N 2.93Å
273	F	92	Very high	86.5	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.009	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.2	175.3	177.1	-112.9	0	0	0	110.6	T223 A226 F237 L238 K239 L240 D275 I318 A320	T223-F273 HydrophobicContact CG2-CE1 4.02Å; T223-F273 HydrophobicContact CG2-CZ 4.2Å; A226-F273 HydrophobicContact CB-CD2 3.43Å; A226-F273 VanDerWaalsContact CB-CD2 3.43Å; A226-F273 HydrophobicContact CB-CE1 4.39Å; A226-F273 HydrophobicContact CB-CE2 3.29Å; A226-F273 HydrophobicContact CB-CG 4.07Å; A226-F273 HydrophobicContact CB-CZ 3.82Å; F237-F273 HydrophobicContact CD2-CB 4.5Å; F237-F273 HydrophobicContact CE1-CB 4.28Å; F237-F273 HydrophobicContact CE2-CB 3.44Å; F237-F273 VanDerWaalsContact CE2-CB 3.44Å; F237-F273 HydrophobicContact CE2-CG 4.21Å; F237-F273 HydrophobicContact CZ-CB 3.3Å; F237-F273 AromaticContact CZ-CD1 3.91Å; F237-F273 HydrophobicContact CZ-CD1 3.91Å; F237-F273 AromaticContact CZ-CG 3.77Å; F237-F273 HydrophobicContact CZ-CG 3.77Å; L238-F273 PolarHBondContact O-N 2.94Å; K239-F273 HydrophobicContact CG-CD1 4.38Å; L240-F273 PolarHBondContact N-O 3.23Å; L240-F273 VanDerWaalsContact O-O 3.11Å; F273-D275 HydrophobicContact CD1-CB 4.44Å; F273-D275 HydrophobicContact CE1-CB 3.65Å; F273-D275 HydrophobicContact CZ-CB 4Å; F273-I318 CarbonylContact C-O 3.51Å; F273-I318 VanDerWaalsContact CA-O 3.29Å; F273-I318 WeakPolarHBondContact CA-O 3.42Å; F273-I318 HydrophobicContact CD2-CB 3.99Å; F273-I318 HydrophobicContact CD2-CG2 3.77Å; F273-I318 WeakPolarHBondContact CD2-O 3.21Å; F273-I318 HydrophobicContact CE2-CG2 4.11Å; F273-A320 HydrophobicContact CE2-CB 3.91Å; F273-A320 HydrophobicContact CZ-CB 3.97Å
274	I	91.8	Very high	85.7	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	105.6	177.2	-51.2	179.6	0	0	0	108.2	L240 I272 L277 L302 V317 I318 A319 A320	L240-I274 HydrophobicContact CB-CG1 4.37Å; L240-I274 HydrophobicContact CD2-CD1 4.27Å; L240-I274 HydrophobicContact CD2-CG1 3.99Å; L240-I274 CarbonylContact O-C 3.58Å; L240-I274 VanDerWaalsContact O-CA 3.32Å; L240-I274 WeakPolarHBondContact O-CA 3.46Å; I272-I274 HydrophobicContact CG2-CG1 4.12Å; I274-L277 HydrophobicContact CG2-CD1 3.88Å; I274-L302 HydrophobicContact CD1-CD1 3.92Å; I274-L302 HydrophobicContact CD1-CD2 4.08Å; I274-V317 HydrophobicContact CD1-CG1 4.08Å; I274-V317 HydrophobicContact CG1-CG1 4.46Å; I274-I318 PolarHBondContact N-O 2.67Å; I274-A319 HydrophobicContact CB-CB 4.49Å; I274-A319 CarbonylContact O-C 3.52Å; I274-A319 WeakPolarHBondContact O-CA 3.44Å; I274-A320 PolarHBondContact O-N 3.01Å
275	D	91	Very high	84.8	Confident	29 Å²	29	47.4 Å²	47.4	16%	0.155	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	152.7	173.5	-145.1	-13.8	0	0	0	110.6	T223 L240 G242 F273 L277	T223-D275 WeakPolarHBondContact CG2-OD2 3.45Å; T223-D275 PolarHBondContact OG1-OD2 3.37Å; L240-D275 PolarHBondContact O-N 3.42Å; G242-D275 PolarHBondContact N-O 3.08Å; F273-D275 HydrophobicContact CD1-CB 4.44Å; F273-D275 HydrophobicContact CE1-CB 3.65Å; F273-D275 HydrophobicContact CZ-CB 4Å; D275-L277 PolarHBondContact O-N 3.39Å
276	E	89.3	Confident	83.9	Confident	91 Å²	91	52.1 Å²	52.1	43%	0.425	26%	0.263	S	S	.	.			trans	51.7	51.3	178.6	-59.4	-178.3	167.5	0	0	113.6	P243 D278 A279 A320	P243-E276 WeakPolarHBondContact CG-OE2 3.33Å; E276-D278 VanDerWaalsContact CA-OD1 3.28Å; E276-D278 WeakPolarHBondContact CA-OD1 3.31Å; E276-D278 PolarHBondContact O-N 2.96Å; E276-A279 WeakPolarHBondContact O-CB 3.46Å; E276-A279 PolarHBondContact O-N 3.24Å; E276-A320 PolarHBondContact N-O 3.25Å
277	L	88.6	Confident	82.9	Confident	5 Å²	5	50 Å²	50	3%	0.026	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-58.3	-23.2	179.8	-172.1	69.9	0	0	0	112.7	L213 I274 D275 A279 I280 G281 L302 A319 A320 L327 L331	L213-L277 HydrophobicContact CD1-CD2 4.19Å; I274-L277 HydrophobicContact CG2-CD1 3.88Å; D275-L277 PolarHBondContact O-N 3.39Å; L277-A279 PolarHBondContact O-N 2.92Å; L277-I280 HydrophobicContact CD1-CD1 4.02Å; L277-I280 HydrophobicContact CD1-CG1 4.09Å; L277-I280 PolarHBondContact O-N 3.04Å; L277-G281 WeakPolarHBondContact O-CA 3.38Å; L277-G281 PolarHBondContact O-N 2.81Å; L277-L302 HydrophobicContact CD1-CD2 4.26Å; L277-A319 HydrophobicContact CD2-CB 3.98Å; L277-A320 PolarHBondContact N-O 3.41Å; L277-L327 HydrophobicContact CB-CD2 4.47Å; L277-L327 HydrophobicContact CD2-CD1 4.16Å; L277-L327 HydrophobicContact CD2-CD2 4.1Å; L277-L327 HydrophobicContact CG-CD2 4.1Å; L277-L331 HydrophobicContact CD2-CD1 4.29Å
278	D	88.1	Confident	82	Confident	33 Å²	33	55 Å²	55	18%	0.176	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-60.8	-20.8	174.2	43.9	-21.4	0	0	0	114.5	E276 I280 T282 I326	E276-D278 VanDerWaalsContact CA-OD1 3.28Å; E276-D278 WeakPolarHBondContact CA-OD1 3.31Å; E276-D278 PolarHBondContact O-N 2.96Å; D278-I280 VanDerWaalsContact C-N 3.31Å; D278-I280 PolarHBondContact O-N 3.23Å; D278-T282 WeakPolarHBondContact O-CG2 3.5Å; D278-I326 HydrophobicContact CB-CD1 3.41Å; D278-I326 VanDerWaalsContact CB-CD1 3.41Å; D278-I326 HydrophobicContact CB-CG1 4.07Å
279	A	86.1	Confident	81.4	Confident	37 Å²	37	60 Å²	60	31%	0.306	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-66	-32.9	175.9	0	0	0	0	0	113	P243 E276 L277	P243-A279 HydrophobicContact CG-CB 3.98Å; E276-A279 WeakPolarHBondContact O-CB 3.46Å; E276-A279 PolarHBondContact O-N 3.24Å; L277-A279 PolarHBondContact O-N 2.92Å
280	I	85	Confident	80.8	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-21	-177.9	61.7	173.4	0	0	0	113.6	G242 L245 V246 L277 D278 T282 V295 L302	G242-I280 WeakPolarHBondContact O-CG2 3.43Å; L245-I280 HydrophobicContact CB-CG2 4.11Å; L245-I280 HydrophobicContact CD1-CD1 3.58Å; V246-I280 HydrophobicContact CG2-CG2 4.06Å; L277-I280 HydrophobicContact CD1-CD1 4.02Å; L277-I280 HydrophobicContact CD1-CG1 4.09Å; L277-I280 PolarHBondContact O-N 3.04Å; D278-I280 VanDerWaalsContact C-N 3.31Å; D278-I280 PolarHBondContact O-N 3.23Å; I280-T282 VanDerWaalsContact C-N 3.31Å; I280-T282 PolarHBondContact O-N 3.47Å; I280-V295 HydrophobicContact CB-CG1 4.23Å; I280-V295 HydrophobicContact CG2-CG1 4.35Å; I280-L302 HydrophobicContact CD1-CD2 3.51Å
281	G	79.3	Confident	80.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.337	C	S	.	.			trans	-88.6	16.1	-170.6	0	0	0	0	0	114.7	L277 L327 D328	L277-G281 WeakPolarHBondContact O-CA 3.38Å; L277-G281 PolarHBondContact O-N 2.81Å; G281-L327 CarbonylContact O-C 3.43Å; G281-L327 VanDerWaalsContact O-CA 3.23Å; G281-L327 WeakPolarHBondContact O-CA 3.45Å; G281-D328 PolarHBondContact O-N 3.32Å
282	T	80.4	Confident	79.8	Confident	53 Å²	53	66.8 Å²	66.8	33%	0.325	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-64.7	141	-173.7	56.6	0	0	0	0	112	D278 I280 I326	D278-T282 WeakPolarHBondContact O-CG2 3.5Å; I280-T282 VanDerWaalsContact C-N 3.31Å; I280-T282 PolarHBondContact O-N 3.47Å; T282-I326 WeakPolarHBondContact CA-O 3.46Å
283	K	75.1	Confident	79.4	Confident	88 Å²	88	74.3 Å²	74.3	38%	0.383	38%	0.382	S	S	.	.			trans	-55.7	144.6	174.5	-75.3	172.9	-179.2	165.9	0	111.3	F285 D325 I326 L327	K283-F285 HydrophobicContact CB-CE2 4.39Å; K283-F285 WeakPolarHBondContact O-CD2 3.4Å; K283-F285 PolarHBondContact O-N 3.44Å; K283-D325 WeakPolarHBondContact CE-O 3.2Å; K283-D325 PolarHBondContact NZ-O 3.44Å; K283-I326 PolarHBondContact N-O 3.04Å; K283-L327 WeakPolarHBondContact CE-O 3.24Å
284	R	70.9	Confident	79	Confident	156 Å²	156	75.4 Å²	75.4	59%	0.589	39%	0.387	S	S	*	.			trans	-60.2	105.4	174.8	-61.7	-179.1	-170.4	-162.6	-1.1	110
285	F	68.7	Low	78.7	Confident	146 Å²	146	76.1 Å²	76.1	64%	0.64	39%	0.391	S	S	*	.			trans	-96	139.7	158.6	-64.1	-77.1	0	0	0	107.7	K283 S287	K283-F285 HydrophobicContact CB-CE2 4.39Å; K283-F285 WeakPolarHBondContact O-CD2 3.4Å; K283-F285 PolarHBondContact O-N 3.44Å; F285-S287 PolarHBondContact O-N 2.89Å
286	N	66.9	Low	78.4	Confident	173 Å²	173	77 Å²	77	93%	0.925	40%	0.395	S	S	*	.			trans	-69.1	33.8	174.4	-88.7	-0.6	0	0	0	112.6	E288	N286-E288 PolarHBondContact O-N 3.1Å
287	S	65	Low	78.3	Confident	56 Å²	56	77.7 Å²	77.7	39%	0.392	39%	0.393	S	S	.	.			trans	-67	123.9	173.9	-81.4	0	0	0	0	109.7	F285 K289 D292	F285-S287 PolarHBondContact O-N 2.89Å; S287-K289 PolarHBondContact O-N 2.95Å; S287-D292 WeakPolarHBondContact CB-OD2 3.39Å
288	E	67.4	Low	78.3	Confident	174 Å²	174	77.5 Å²	77.5	81%	0.813	39%	0.392	S	S	*	.			trans	-74.5	3.8	175.4	-66	-172.9	146.2	0	0	113.5	N286 A290	N286-E288 PolarHBondContact O-N 3.1Å; E288-A290 PolarHBondContact O-N 2.77Å
289	K	71.9	Confident	78.3	Confident	153 Å²	153	76 Å²	76	67%	0.665	38%	0.384	S	S	*	.			trans	-69.4	128.3	179.9	-66.4	-174.1	-178.6	178.6	0	110.2	S287 G291 D292	S287-K289 PolarHBondContact O-N 2.95Å; K289-G291 PolarHBondContact O-N 2.82Å; K289-G291 VanDerWaalsContact O-N 3.16Å; K289-D292 PolarHBondContact O-N 3.34Å
290	A	73.1	Confident	78.4	Confident	84 Å²	84	77.6 Å²	77.6	69%	0.694	39%	0.387	S	S	*	.	H	α-helix	trans	-57.7	-30.4	-176.9	0	0	0	0	0	114	E288 R293	E288-A290 PolarHBondContact O-N 2.77Å; A290-R293 PolarHBondContact O-N 3.32Å
291	G	74.3	Confident	78.6	Confident	50 Å²	50	79.4 Å²	79.4	52%	0.515	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-42	-179.6	0	0	0	0	0	113.6	K289 R293 E294 V295	K289-G291 PolarHBondContact O-N 2.82Å; K289-G291 VanDerWaalsContact O-N 3.16Å; G291-R293 VanDerWaalsContact C-N 3.29Å; G291-R293 PolarHBondContact O-N 3.26Å; G291-E294 PolarHBondContact O-N 2.81Å; G291-V295 PolarHBondContact O-N 3.09Å
292	D	79.7	Confident	79	Confident	66 Å²	66	79.5 Å²	79.5	35%	0.353	40%	0.396	S	S	.	.	H	α-helix	trans	-68.8	-31.6	-176.5	-62	-19.9	0	0	0	111.5	S287 K289 V295 Q296	S287-D292 WeakPolarHBondContact CB-OD2 3.39Å; K289-D292 PolarHBondContact O-N 3.34Å; D292-V295 PolarHBondContact O-N 2.85Å; D292-Q296 WeakPolarHBondContact O-CB 3.47Å; D292-Q296 WeakPolarHBondContact O-CG 3.29Å; D292-Q296 PolarHBondContact O-N 2.89Å
293	R	82.3	Confident	79.2	Confident	162 Å²	162	77.2 Å²	77.2	61%	0.611	38%	0.382	S	S	*	.	H	α-helix	trans	-66	-38.7	178.8	-70.6	-174.4	174.9	179.6	0.3	112.6	A290 G291 Q296 R297	A290-R293 PolarHBondContact O-N 3.32Å; G291-R293 VanDerWaalsContact C-N 3.29Å; G291-R293 PolarHBondContact O-N 3.26Å; R293-Q296 PolarHBondContact O-N 3.03Å; R293-R297 PolarHBondContact O-N 3.18Å
294	E	83.5	Confident	79.8	Confident	24 Å²	24	77.5 Å²	77.5	11%	0.112	39%	0.388	C	S	.	.	H	α-helix	trans	-69.5	-42.8	178.2	-178	58.7	-165.8	0	0	110.7	G251 G291 Q296 R297 T298	G251-E294 WeakPolarHBondContact CA-OE1 3.36Å; G251-E294 PolarHBondContact N-OE1 3.11Å; G291-E294 PolarHBondContact O-N 2.81Å; E294-Q296 VanDerWaalsContact C-N 3.32Å; E294-Q296 PolarHBondContact O-N 2.89Å; E294-R297 WeakPolarHBondContact O-CB 3.32Å; E294-R297 PolarHBondContact O-N 3.17Å; E294-R297 VanDerWaalsContact O-N 3.07Å; E294-R297 IonicContact OE1-NH2 3.89Å; E294-R297 IonicContact OE2-CZ 3.09Å; E294-R297 IonicContact OE2-NE 3.45Å; E294-R297 PolarHBondContact OE2-NE 3.41Å; E294-R297 IonicContact OE2-NH2 3.45Å; E294-R297 PolarHBondContact OE2-NH2 3.4Å; E294-R297 VanDerWaalsContact OE2-NH2 3.1Å; E294-T298 WeakPolarHBondContact O-CG2 3.39Å; E294-T298 PolarHBondContact O-N 3.41Å
295	V	86.1	Confident	80.5	Confident	18 Å²	18	72.1 Å²	72.1	11%	0.109	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-41.8	175.2	-179.4	0	0	0	0	111.5	V246 I280 G291 D292 R297 T298 M299	V246-V295 HydrophobicContact CG1-CG2 3.96Å; V246-V295 HydrophobicContact CG2-CG2 4.02Å; I280-V295 HydrophobicContact CB-CG1 4.23Å; I280-V295 HydrophobicContact CG2-CG1 4.35Å; G291-V295 PolarHBondContact O-N 3.09Å; D292-V295 PolarHBondContact O-N 2.85Å; V295-R297 VanDerWaalsContact C-N 3.29Å; V295-R297 PolarHBondContact O-N 2.93Å; V295-T298 PolarHBondContact O-N 3.32Å; V295-T298 PolarHBondContact O-OG1 3.38Å; V295-M299 WeakPolarHBondContact O-CB 3.31Å; V295-M299 PolarHBondContact O-N 3.39Å
296	Q	85.2	Confident	81.2	Confident	47 Å²	47	65.7 Å²	65.7	22%	0.22	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-36.8	174.8	-74.2	171.9	11.2	0	0	112.1	D292 R293 E294 M299 L300	D292-Q296 WeakPolarHBondContact O-CB 3.47Å; D292-Q296 WeakPolarHBondContact O-CG 3.29Å; D292-Q296 PolarHBondContact O-N 2.89Å; R293-Q296 PolarHBondContact O-N 3.03Å; E294-Q296 VanDerWaalsContact C-N 3.32Å; E294-Q296 PolarHBondContact O-N 2.89Å; Q296-M299 PolarHBondContact O-N 2.79Å; Q296-L300 VanDerWaalsContact O-CG 3.31Å; Q296-L300 WeakPolarHBondContact O-CG 3.47Å; Q296-L300 PolarHBondContact O-N 3.49Å
297	R	86.6	Confident	81.7	Confident	106 Å²	106	61.3 Å²	61.3	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-41.8	178.3	-167.3	169.1	71.9	151.6	2	112.1	I250 R293 E294 V295 M299 L300 E301	I250-R297 PolarHBondContact O-NH2 3.22Å; R293-R297 PolarHBondContact O-N 3.18Å; E294-R297 WeakPolarHBondContact O-CB 3.32Å; E294-R297 PolarHBondContact O-N 3.17Å; E294-R297 VanDerWaalsContact O-N 3.07Å; E294-R297 IonicContact OE1-NH2 3.89Å; E294-R297 IonicContact OE2-CZ 3.09Å; E294-R297 IonicContact OE2-NE 3.45Å; E294-R297 PolarHBondContact OE2-NE 3.41Å; E294-R297 IonicContact OE2-NH2 3.45Å; E294-R297 PolarHBondContact OE2-NH2 3.4Å; E294-R297 VanDerWaalsContact OE2-NH2 3.1Å; V295-R297 VanDerWaalsContact C-N 3.29Å; V295-R297 PolarHBondContact O-N 2.93Å; R297-M299 VanDerWaalsContact C-N 3.33Å; R297-L300 PolarHBondContact O-N 2.97Å; R297-E301 PolarHBondContact O-N 3.38Å; R297-E301 VanDerWaalsContact O-N 3.08Å
298	T	89.1	Confident	81.8	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-38.1	175	62.8	0	0	0	0	111.4	E294 V295 E301 L302	E294-T298 WeakPolarHBondContact O-CG2 3.39Å; E294-T298 PolarHBondContact O-N 3.41Å; V295-T298 PolarHBondContact O-N 3.32Å; V295-T298 PolarHBondContact O-OG1 3.38Å; T298-E301 PolarHBondContact O-N 3.42Å; T298-L302 PolarHBondContact O-N 2.83Å
299	M	87.8	Confident	81.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-46.3	173.6	-176.7	-169.5	66	0	0	112.2	V295 Q296 R297 E301 L302 L303 D328 L331	V295-M299 WeakPolarHBondContact O-CB 3.31Å; V295-M299 PolarHBondContact O-N 3.39Å; Q296-M299 PolarHBondContact O-N 2.79Å; R297-M299 VanDerWaalsContact C-N 3.33Å; M299-E301 VanDerWaalsContact C-N 3.29Å; M299-E301 PolarHBondContact O-N 3.33Å; M299-L302 WeakPolarHBondContact O-CB 3.36Å; M299-L302 PolarHBondContact O-N 3.07Å; M299-L303 HydrophobicContact CG-CD1 4.43Å; M299-L303 VanDerWaalsContact O-CG 3.31Å; M299-L303 WeakPolarHBondContact O-CG 3.5Å; M299-L303 PolarHBondContact O-N 3.39Å; M299-D328 HydrophobicContact CE-CB 4.44Å; M299-D328 WeakPolarHBondContact CE-OD2 3.48Å; M299-D328 HydrophobicContact SD-CB 4.05Å; M299-L331 HydrophobicContact CG-CD1 4.48Å; M299-L331 HydrophobicContact SD-CD1 4.26Å
300	L	87.7	Confident	81.1	Confident	70 Å²	70	53.3 Å²	53.3	37%	0.366	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-38.3	177.3	-73.9	172.3	0	0	0	111.9	Q296 R297 L303 N304	Q296-L300 VanDerWaalsContact O-CG 3.31Å; Q296-L300 WeakPolarHBondContact O-CG 3.47Å; Q296-L300 PolarHBondContact O-N 3.49Å; R297-L300 PolarHBondContact O-N 2.97Å; L300-L303 HydrophobicContact CD2-CD1 4.39Å; L300-L303 WeakPolarHBondContact O-CB 3.34Å; L300-L303 PolarHBondContact O-N 3.07Å; L300-N304 VanDerWaalsContact O-CG 3.23Å; L300-N304 PolarHBondContact O-N 2.95Å; L300-N304 PolarHBondContact O-ND2 3.5Å
301	E	88.8	Confident	80.3	Confident	39 Å²	39	51.7 Å²	51.7	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-43.6	174.6	-172.8	57.8	-152.1	0	0	111.7	A254 V257 R258 R297 T298 M299 L303 N304 Q305	A254-E301 HydrophobicContact CB-CB 4.02Å; A254-E301 HydrophobicContact CB-CG 4.06Å; V257-E301 HydrophobicContact CG1-CG 4.47Å; R258-E301 VanDerWaalsContact CD-OE1 3.27Å; R258-E301 WeakPolarHBondContact CD-OE1 3.31Å; R258-E301 HydrophobicContact CG-CG 4.04Å; R258-E301 WeakPolarHBondContact CG-OE1 3.33Å; R297-E301 PolarHBondContact O-N 3.38Å; R297-E301 VanDerWaalsContact O-N 3.08Å; T298-E301 PolarHBondContact O-N 3.42Å; M299-E301 VanDerWaalsContact C-N 3.29Å; M299-E301 PolarHBondContact O-N 3.33Å; E301-L303 VanDerWaalsContact C-N 3.29Å; E301-L303 PolarHBondContact O-N 3.05Å; E301-N304 PolarHBondContact O-N 3.41Å; E301-N304 VanDerWaalsContact O-N 3.17Å; E301-Q305 WeakPolarHBondContact O-CG 3.33Å; E301-Q305 PolarHBondContact O-N 2.87Å; E301-Q305 PolarHBondContact OE1-NE2 3.38Å
302	L	88.3	Confident	79.3	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-56.8	-44	172.7	176.6	61.2	0	0	0	111.4	V257 F261 I274 L277 I280 T298 M299 Q305 L306	V257-L302 HydrophobicContact CG1-CB 4.14Å; V257-L302 HydrophobicContact CG1-CD1 4.15Å; F261-L302 HydrophobicContact CE2-CD1 3.58Å; F261-L302 HydrophobicContact CZ-CD1 3.83Å; I274-L302 HydrophobicContact CD1-CD1 3.92Å; I274-L302 HydrophobicContact CD1-CD2 4.08Å; L277-L302 HydrophobicContact CD1-CD2 4.26Å; I280-L302 HydrophobicContact CD1-CD2 3.51Å; T298-L302 PolarHBondContact O-N 2.83Å; M299-L302 WeakPolarHBondContact O-CB 3.36Å; M299-L302 PolarHBondContact O-N 3.07Å; L302-Q305 PolarHBondContact O-N 3.36Å; L302-L306 HydrophobicContact CD1-CD1 4.3Å; L302-L306 HydrophobicContact CD1-CG 4.34Å; L302-L306 HydrophobicContact CG-CD1 4.17Å; L302-L306 WeakPolarHBondContact O-CB 3.33Å; L302-L306 WeakPolarHBondContact O-CG 3.28Å; L302-L306 PolarHBondContact O-N 2.98Å
303	L	85.9	Confident	78.6	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-43.2	175.7	-70.9	176.4	0	0	0	112.4	M299 L300 E301 L306 D307 A330 L331	M299-L303 HydrophobicContact CG-CD1 4.43Å; M299-L303 VanDerWaalsContact O-CG 3.31Å; M299-L303 WeakPolarHBondContact O-CG 3.5Å; M299-L303 PolarHBondContact O-N 3.39Å; L300-L303 HydrophobicContact CD2-CD1 4.39Å; L300-L303 WeakPolarHBondContact O-CB 3.34Å; L300-L303 PolarHBondContact O-N 3.07Å; E301-L303 VanDerWaalsContact C-N 3.29Å; E301-L303 PolarHBondContact O-N 3.05Å; L303-L306 PolarHBondContact O-N 3.44Å; L303-D307 WeakPolarHBondContact O-CB 3.48Å; L303-D307 PolarHBondContact O-N 3.28Å; L303-A330 HydrophobicContact CD1-CB 4.03Å; L303-L331 HydrophobicContact CD2-CB 4.47Å; L303-L331 HydrophobicContact CD2-CD2 3.26Å; L303-L331 HydrophobicContact CD2-CG 3.79Å; L303-L331 HydrophobicContact CG-CD2 4.09Å
304	N	87.2	Confident	78.4	Confident	95 Å²	95	49.9 Å²	49.9	51%	0.508	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-42	177.8	-71.6	-18.7	0	0	0	111.7	L300 E301 D307 G308	L300-N304 VanDerWaalsContact O-CG 3.23Å; L300-N304 PolarHBondContact O-N 2.95Å; L300-N304 PolarHBondContact O-ND2 3.5Å; E301-N304 PolarHBondContact O-N 3.41Å; E301-N304 VanDerWaalsContact O-N 3.17Å; N304-D307 PolarHBondContact O-N 2.84Å; N304-G308 PolarHBondContact O-N 3.07Å
305	Q	86.1	Confident	78.5	Confident	42 Å²	42	49.2 Å²	49.2	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-41	176.2	-66	-56.4	-40.8	0	0	111.4	V257 F261 E301 L302 F309	V257-Q305 HydrophobicContact CG1-CG 4.18Å; F261-Q305 HydrophobicContact CD2-CB 3.46Å; F261-Q305 VanDerWaalsContact CD2-CB 3.46Å; F261-Q305 HydrophobicContact CD2-CG 3.79Å; F261-Q305 HydrophobicContact CE2-CB 3.53Å; F261-Q305 HydrophobicContact CE2-CG 4.23Å; F261-Q305 HydrophobicContact CG-CB 4.06Å; F261-Q305 HydrophobicContact CG-CG 4.48Å; F261-Q305 HydrophobicContact CZ-CB 4.14Å; E301-Q305 WeakPolarHBondContact O-CG 3.33Å; E301-Q305 PolarHBondContact O-N 2.87Å; E301-Q305 PolarHBondContact OE1-NE2 3.38Å; L302-Q305 PolarHBondContact O-N 3.36Å; Q305-F309 WeakPolarHBondContact O-CD2 3.25Å; Q305-F309 WeakPolarHBondContact O-CE2 3.17Å
306	L	83	Confident	78.6	Confident	11 Å²	11	49 Å²	49	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-38.5	175.6	-69.6	172.4	0	0	0	113.3	F261 L302 L303 F309 V317 R336	F261-L306 HydrophobicContact CE1-CD2 4.38Å; F261-L306 HydrophobicContact CZ-CD2 3.94Å; F261-L306 HydrophobicContact CZ-CG 4.32Å; L302-L306 HydrophobicContact CD1-CD1 4.3Å; L302-L306 HydrophobicContact CD1-CG 4.34Å; L302-L306 HydrophobicContact CG-CD1 4.17Å; L302-L306 WeakPolarHBondContact O-CB 3.33Å; L302-L306 WeakPolarHBondContact O-CG 3.28Å; L302-L306 PolarHBondContact O-N 2.98Å; L303-L306 PolarHBondContact O-N 3.44Å; L306-F309 WeakPolarHBondContact O-CD2 3.41Å; L306-V317 HydrophobicContact CD2-CB 4.05Å; L306-V317 HydrophobicContact CD2-CG1 4.06Å; L306-V317 HydrophobicContact CD2-CG2 3.62Å; L306-R336 HydrophobicContact CB-CG 4.47Å
307	D	77.2	Confident	78.8	Confident	82 Å²	82	47.1 Å²	47.1	44%	0.439	25%	0.251	S	S	.	.	H	α-helix	trans	-72.8	-43.9	178.9	-137.2	-24.2	0	0	0	111.3	K210 L303 N304 F309 R336	K210-D307 PolarHBondContact NZ-O 3.02Å; L303-D307 WeakPolarHBondContact O-CB 3.48Å; L303-D307 PolarHBondContact O-N 3.28Å; N304-D307 PolarHBondContact O-N 2.84Å; D307-F309 PolarHBondContact O-N 3.18Å; D307-R336 IonicContact OD2-CZ 2.93Å; D307-R336 IonicContact OD2-NE 3.85Å; D307-R336 IonicContact OD2-NH2 3.65Å; D307-R336 PolarHBondContact OD2-NH2 3.17Å
308	G	66.2	Low	79	Confident	62 Å²	62	42.1 Å²	42.1	64%	0.639	23%	0.232	S	C	*	.	S	Bend	trans	-67.2	-1.8	-174.5	0	0	0	0	0	115.6	N304 Q310	N304-G308 PolarHBondContact O-N 3.07Å; G308-Q310 PolarHBondContact O-N 3.23Å
309	F	63.9	Low	79.2	Confident	22 Å²	22	42.2 Å²	42.2	10%	0.096	23%	0.233	C	C	.	.			trans	-66.5	117.2	170.7	-72.9	-63.7	0	0	0	110.9	K210 F261 Q305 L306 D307 H313 I315	K210-F309 PolarHBondContact NZ-O 2.89Å; K210-F309 VanDerWaalsContact NZ-O 3.11Å; F261-F309 HydrophobicContact CD1-CE1 4.34Å; F261-F309 AromaticContact CD1-CE2 3.84Å; F261-F309 HydrophobicContact CD1-CE2 3.84Å; F261-F309 AromaticContact CD1-CZ 3.26Å; F261-F309 HydrophobicContact CD1-CZ 3.26Å; F261-F309 AromaticContact CE1-CE2 3.49Å; F261-F309 HydrophobicContact CE1-CE2 3.49Å; F261-F309 VanDerWaalsContact CE1-CE2 3.49Å; F261-F309 AromaticContact CE1-CZ 3.45Å; F261-F309 HydrophobicContact CE1-CZ 3.45Å; F261-F309 VanDerWaalsContact CE1-CZ 3.45Å; F261-F309 HydrophobicContact CG-CZ 4.1Å; F261-F309 HydrophobicContact CZ-CE2 4.25Å; F261-F309 HydrophobicContact CZ-CZ 4.47Å; Q305-F309 WeakPolarHBondContact O-CD2 3.25Å; Q305-F309 WeakPolarHBondContact O-CE2 3.17Å; L306-F309 WeakPolarHBondContact O-CD2 3.41Å; D307-F309 PolarHBondContact O-N 3.18Å; F309-H313 HydrophobicContact CD1-CB 4.23Å; F309-I315 HydrophobicContact CE1-CD1 3.94Å
310	Q	60.6	Low	79.4	Confident	130 Å²	130	42.2 Å²	42.2	61%	0.607	23%	0.233	S	C	*	.			trans	-57.2	134.6	153.8	-67	-176.7	-8.2	0	0	107.7	G308 N312 H313	G308-Q310 PolarHBondContact O-N 3.23Å; Q310-N312 PolarHBondContact O-N 3.46Å; Q310-H313 PolarHBondContact O-N 2.87Å; Q310-H313 PolarHBondContact O-ND1 3.25Å
311	P	56.1	Low	79.6	Confident	51 Å²	51	39 Å²	39	33%	0.331	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-12.8	-174.3	23.4	-33.5	0	0	0	113.8	Q207	Q207-P311 HydrophobicContact CG-CB 4.24Å
312	N	55	Low	79.7	Confident	133 Å²	133	40.3 Å²	40.3	71%	0.711	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	0.6	-176.6	-59.9	6.4	0	0	0	114.3	Q310	Q310-N312 PolarHBondContact O-N 3.46Å
313	H	63.9	Low	79.7	Confident	66 Å²	66	46.3 Å²	46.3	31%	0.306	25%	0.247	S	C	.	.			trans	-84	135.5	179.8	-74.8	58.9	0	0	0	111.6	F309 Q310 I315	F309-H313 HydrophobicContact CD1-CB 4.23Å; Q310-H313 PolarHBondContact O-N 2.87Å; Q310-H313 PolarHBondContact O-ND1 3.25Å; H313-I315 HydrophobicContact CB-CD1 4.45Å; H313-I315 HydrophobicContact CB-CG1 4.47Å; H313-I315 PolarHBondContact O-N 3.38Å
314	D	77.8	Confident	79.8	Confident	41 Å²	41	48.7 Å²	48.7	22%	0.219	26%	0.262	C	S	.	.			trans	-78.1	33	-179	-59.2	-24.6	0	0	0	113.3	R198 A268 P269 A270	R198-D314 IonicContact CZ-OD1 3.56Å; R198-D314 IonicContact CZ-OD2 3.28Å; R198-D314 IonicContact NE-OD1 3.11Å; R198-D314 PolarHBondContact NE-OD1 3.28Å; R198-D314 IonicContact NH1-OD1 3.74Å; R198-D314 PolarHBondContact NH1-OD1 3.1Å; R198-D314 IonicContact NH1-OD2 3.1Å; R198-D314 PolarHBondContact NH1-OD2 3.37Å; R198-D314 IonicContact NH2-OD1 3.61Å; R198-D314 PolarHBondContact NH2-OD1 2.78Å; R198-D314 IonicContact NH2-OD2 3.55Å; R198-D314 PolarHBondContact NH2-OD2 2.98Å; A268-D314 HydrophobicContact CB-CB 4.29Å; P269-D314 WeakPolarHBondContact CA-O 3.33Å; P269-D314 HydrophobicContact CB-CB 3.96Å; A270-D314 PolarHBondContact N-O 3.01Å
315	I	85.9	Confident	79.9	Confident	9 Å²	9	48.3 Å²	48.3	5%	0.046	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124	-175.7	-54.5	170.2	0	0	0	107.9	A264 K265 A270 I272 F309 H313	A264-I315 HydrophobicContact CB-CD1 4.19Å; A264-I315 HydrophobicContact CB-CG2 4.26Å; K265-I315 HydrophobicContact CB-CD1 4.26Å; K265-I315 HydrophobicContact CG-CD1 3.5Å; K265-I315 VanDerWaalsContact CG-CD1 3.5Å; A270-I315 VanDerWaalsContact O-CA 3.31Å; A270-I315 WeakPolarHBondContact O-CA 3.44Å; I272-I315 HydrophobicContact CD1-CG2 3.84Å; I272-I315 HydrophobicContact CG1-CG2 4.25Å; F309-I315 HydrophobicContact CE1-CD1 3.94Å; H313-I315 HydrophobicContact CB-CD1 4.45Å; H313-I315 HydrophobicContact CB-CG1 4.47Å; H313-I315 PolarHBondContact O-N 3.38Å
316	K	87.5	Confident	79.9	Confident	13 Å²	13	48.3 Å²	48.3	6%	0.057	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138	176.6	-59.3	-59.3	179	-170	0	110.2	V191 P209 A270 I271 I272	V191-K316 HydrophobicContact CG1-CB 4.26Å; V191-K316 HydrophobicContact CG1-CG 4.39Å; P209-K316 PolarHBondContact O-NZ 3.43Å; A270-K316 PolarHBondContact O-N 2.83Å; I271-K316 WeakPolarHBondContact CA-O 3.49Å; I272-K316 PolarHBondContact N-O 2.69Å
317	V	90	Very high	80.1	Confident	9 Å²	9	47.9 Å²	47.9	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.6	179.7	-175.8	0	0	0	0	110.1	K210 G211 V212 F261 I272 I274 L306	K210-V317 PolarHBondContact O-N 3.03Å; G211-V317 CarbonylContact C-O 3.59Å; G211-V317 WeakPolarHBondContact CA-O 3.41Å; V212-V317 PolarHBondContact N-O 2.83Å; F261-V317 HydrophobicContact CE1-CG2 4.12Å; I272-V317 HydrophobicContact CB-CG2 4.43Å; I272-V317 WeakPolarHBondContact O-CA 3.23Å; I274-V317 HydrophobicContact CD1-CG1 4.08Å; I274-V317 HydrophobicContact CG1-CG1 4.46Å; L306-V317 HydrophobicContact CD2-CB 4.05Å; L306-V317 HydrophobicContact CD2-CG1 4.06Å; L306-V317 HydrophobicContact CD2-CG2 3.62Å
318	I	91.7	Very high	80.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.7	173.3	-56.9	174.7	0	0	0	107	L187 V191 V212 L214 A226 I271 I272 F273 I274	L187-I318 HydrophobicContact CD1-CD1 4.32Å; V191-I318 HydrophobicContact CG2-CD1 4.16Å; V191-I318 HydrophobicContact CG2-CG1 4.23Å; V212-I318 CarbonylContact O-C 3.54Å; V212-I318 WeakPolarHBondContact O-CA 3.49Å; L214-I318 HydrophobicContact CD1-CG2 3.84Å; L214-I318 HydrophobicContact CG-CG2 4.07Å; A226-I318 HydrophobicContact CB-CG2 4.41Å; I271-I318 HydrophobicContact CG2-CD1 3.71Å; I271-I318 HydrophobicContact CG2-CG1 4.1Å; I272-I318 PolarHBondContact O-N 2.93Å; F273-I318 CarbonylContact C-O 3.51Å; F273-I318 VanDerWaalsContact CA-O 3.29Å; F273-I318 WeakPolarHBondContact CA-O 3.42Å; F273-I318 HydrophobicContact CD2-CB 3.99Å; F273-I318 HydrophobicContact CD2-CG2 3.77Å; F273-I318 WeakPolarHBondContact CD2-O 3.21Å; F273-I318 HydrophobicContact CE2-CG2 4.11Å; I274-I318 PolarHBondContact N-O 2.67Å
319	A	92.4	Very high	81.3	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.033	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.7	175.3	0	0	0	0	0	110.5	V212 L213 L214 I274 L277	V212-A319 PolarHBondContact O-N 2.85Å; L213-A319 CarbonylContact C-O 3.53Å; L213-A319 WeakPolarHBondContact CA-O 3.42Å; L213-A319 HydrophobicContact CD1-CB 3.93Å; L214-A319 PolarHBondContact N-O 3.17Å; I274-A319 HydrophobicContact CB-CB 4.49Å; I274-A319 CarbonylContact O-C 3.52Å; I274-A319 WeakPolarHBondContact O-CA 3.44Å; L277-A319 HydrophobicContact CD2-CB 3.98Å
320	A	93	Very high	82.3	Confident	2 Å²	2	45.7 Å²	45.7	2%	0.017	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.2	173.7	0	0	0	0	0	110.7	L214 K222 F273 I274 E276 L277	L214-A320 HydrophobicContact CB-CB 4.42Å; L214-A320 WeakPolarHBondContact O-CA 3.41Å; K222-A320 HydrophobicContact CB-CB 4.45Å; F273-A320 HydrophobicContact CE2-CB 3.91Å; F273-A320 HydrophobicContact CZ-CB 3.97Å; I274-A320 PolarHBondContact O-N 3.01Å; E276-A320 PolarHBondContact N-O 3.25Å; L277-A320 PolarHBondContact N-O 3.41Å
321	T	92	Very high	83.3	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.9	175.1	-176.7	0	0	0	0	110.7	L213 L214 Y215 K222 R323 V324 L327	L213-T321 HydrophobicContact CD1-CG2 3.89Å; L213-T321 HydrophobicContact CG-CG2 4.4Å; L214-T321 PolarHBondContact O-N 2.73Å; Y215-T321 WeakPolarHBondContact CA-O 3.25Å; K222-T321 PolarHBondContact NZ-O 2.8Å; T321-R323 PolarHBondContact OG1-N 3.23Å; T321-R323 PolarHBondContact OG1-O 3.17Å; T321-V324 HydrophobicContact CG2-CB 4.42Å; T321-L327 HydrophobicContact CG2-CD1 3.78Å
322	N	90.9	Very high	84.6	Confident	67 Å²	67	39.1 Å²	39.1	36%	0.358	21%	0.207	S	C	.	.	S	Bend	trans	-84.9	-20.8	170.8	-65.1	-36.6	0	0	0	112.6	G216 K222	G216-N322 VanDerWaalsContact O-O 3.12Å; K222-N322 PolarHBondContact NZ-OD1 3.39Å
323	R	86.6	Confident	86	Confident	128 Å²	128	41.1 Å²	41.1	48%	0.483	20%	0.204	S	C	.	.			trans	-134.9	92.9	-171.2	-69.8	-169.1	66.3	177.9	0	110	T321 D325 I326	T321-R323 PolarHBondContact OG1-N 3.23Å; T321-R323 PolarHBondContact OG1-O 3.17Å; R323-D325 VanDerWaalsContact C-N 3.26Å; R323-D325 WeakPolarHBondContact CA-OD1 3.46Å; R323-D325 VanDerWaalsContact CB-OD1 3.3Å; R323-D325 WeakPolarHBondContact CB-OD1 3.39Å; R323-D325 IonicContact CZ-OD2 2.73Å; R323-D325 IonicContact NE-OD1 3.8Å; R323-D325 IonicContact NE-OD2 2.92Å; R323-D325 IonicContact NH2-OD2 2.9Å; R323-D325 PolarHBondContact NH2-OD2 3.31Å; R323-D325 PolarHBondContact O-N 3.31Å; R323-I326 HydrophobicContact CB-CD1 3.72Å; R323-I326 HydrophobicContact CB-CG1 3.75Å; R323-I326 VanDerWaalsContact O-CG1 3.24Å; R323-I326 WeakPolarHBondContact O-CG1 3.46Å
324	V	88.6	Confident	86.5	Confident	55 Å²	55	42.8 Å²	42.8	33%	0.333	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-73.3	-20.8	178.2	69.7	0	0	0	0	112.3	L213 Y215 T321 I326 L327 L332	L213-V324 HydrophobicContact CD2-CG2 4.41Å; Y215-V324 HydrophobicContact CD2-CB 4.27Å; Y215-V324 HydrophobicContact CD2-CG1 4.05Å; Y215-V324 HydrophobicContact CG-CB 4.33Å; Y215-V324 HydrophobicContact CG-CG2 4.5Å; T321-V324 HydrophobicContact CG2-CB 4.42Å; V324-I326 VanDerWaalsContact C-N 3.33Å; V324-I326 PolarHBondContact O-N 3.19Å; V324-L327 HydrophobicContact CG2-CD1 4.42Å; V324-L327 PolarHBondContact O-N 3.16Å; V324-L332 HydrophobicContact CG2-CD1 4.47Å; V324-L332 HydrophobicContact CG2-CD2 4.33Å
325	D	88.7	Confident	86.3	Confident	87 Å²	87	42 Å²	42	47%	0.465	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-64.5	-32.6	-179.4	57.3	-53.6	0	0	0	113.7	K283 R323	K283-D325 WeakPolarHBondContact CE-O 3.2Å; K283-D325 PolarHBondContact NZ-O 3.44Å; R323-D325 VanDerWaalsContact C-N 3.26Å; R323-D325 WeakPolarHBondContact CA-OD1 3.46Å; R323-D325 VanDerWaalsContact CB-OD1 3.3Å; R323-D325 WeakPolarHBondContact CB-OD1 3.39Å; R323-D325 IonicContact CZ-OD2 2.73Å; R323-D325 IonicContact NE-OD1 3.8Å; R323-D325 IonicContact NE-OD2 2.92Å; R323-D325 IonicContact NH2-OD2 2.9Å; R323-D325 PolarHBondContact NH2-OD2 3.31Å; R323-D325 PolarHBondContact O-N 3.31Å
326	I	87.7	Confident	86	Confident	42 Å²	42	43.2 Å²	43.2	22%	0.215	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-89.4	-10	-177.8	59.6	176.6	0	0	0	113.6	D278 T282 K283 R323 V324	D278-I326 HydrophobicContact CB-CD1 3.41Å; D278-I326 VanDerWaalsContact CB-CD1 3.41Å; D278-I326 HydrophobicContact CB-CG1 4.07Å; T282-I326 WeakPolarHBondContact CA-O 3.46Å; K283-I326 PolarHBondContact N-O 3.04Å; R323-I326 HydrophobicContact CB-CD1 3.72Å; R323-I326 HydrophobicContact CB-CG1 3.75Å; R323-I326 VanDerWaalsContact O-CG1 3.24Å; R323-I326 WeakPolarHBondContact O-CG1 3.46Å; V324-I326 VanDerWaalsContact C-N 3.33Å; V324-I326 PolarHBondContact O-N 3.19Å
327	L	85.8	Confident	85.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-70.2	142.1	-178.6	-69.2	-177.8	0	0	0	112.4	L213 L277 G281 K283 T321 V324 L331 L332	L213-L327 HydrophobicContact CD1-CD1 4.37Å; L213-L327 HydrophobicContact CD2-CD1 4.27Å; L277-L327 HydrophobicContact CB-CD2 4.47Å; L277-L327 HydrophobicContact CD2-CD1 4.16Å; L277-L327 HydrophobicContact CD2-CD2 4.1Å; L277-L327 HydrophobicContact CG-CD2 4.1Å; G281-L327 CarbonylContact O-C 3.43Å; G281-L327 VanDerWaalsContact O-CA 3.23Å; G281-L327 WeakPolarHBondContact O-CA 3.45Å; K283-L327 WeakPolarHBondContact CE-O 3.24Å; T321-L327 HydrophobicContact CG2-CD1 3.78Å; V324-L327 HydrophobicContact CG2-CD1 4.42Å; V324-L327 PolarHBondContact O-N 3.16Å; L327-L331 HydrophobicContact CD2-CD1 4.41Å; L327-L332 HydrophobicContact CD1-CD2 4.44Å
328	D	85.4	Confident	85.3	Confident	16 Å²	16	45.1 Å²	45.1	9%	0.086	24%	0.24	C	C	.	.			trans	-60.6	126.8	171.2	-169.4	-26	0	0	0	109.9	G281 M299 A330 L331	G281-D328 PolarHBondContact O-N 3.32Å; M299-D328 HydrophobicContact CE-CB 4.44Å; M299-D328 WeakPolarHBondContact CE-OD2 3.48Å; M299-D328 HydrophobicContact SD-CB 4.05Å; D328-A330 PolarHBondContact O-N 3.16Å; D328-A330 VanDerWaalsContact OD1-CB 3.31Å; D328-A330 WeakPolarHBondContact OD1-CB 3.37Å; D328-A330 PolarHBondContact OD1-N 2.93Å; D328-L331 HydrophobicContact CB-CD1 4.42Å; D328-L331 WeakPolarHBondContact O-CB 3.45Å; D328-L331 PolarHBondContact O-N 2.87Å
329	P	84.7	Confident	85.1	Confident	80 Å²	80	52 Å²	52	52%	0.519	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-25.7	171.8	-27.6	34.8	0	0	0	114.3	L331 L332 R333	P329-L331 VanDerWaalsContact C-N 3.27Å; P329-L331 PolarHBondContact O-N 2.97Å; P329-L332 PolarHBondContact O-N 2.9Å; P329-L332 VanDerWaalsContact O-N 3.15Å; P329-R333 PolarHBondContact O-N 3.32Å
330	A	83.7	Confident	85.1	Confident	24 Å²	24	56.5 Å²	56.5	20%	0.198	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-29	175.6	0	0	0	0	0	113.4	L303 D328 R336	L303-A330 HydrophobicContact CD1-CB 4.03Å; D328-A330 PolarHBondContact O-N 3.16Å; D328-A330 VanDerWaalsContact OD1-CB 3.31Å; D328-A330 WeakPolarHBondContact OD1-CB 3.37Å; D328-A330 PolarHBondContact OD1-N 2.93Å; A330-R336 WeakPolarHBondContact O-CD 3.28Å; A330-R336 PolarHBondContact O-NH1 2.83Å
331	L	82.9	Confident	85	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.021	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-30.9	173.5	-73.7	161.6	0	0	0	111.8	L277 M299 L303 L327 D328 P329 R333	L277-L331 HydrophobicContact CD2-CD1 4.29Å; M299-L331 HydrophobicContact CG-CD1 4.48Å; M299-L331 HydrophobicContact SD-CD1 4.26Å; L303-L331 HydrophobicContact CD2-CB 4.47Å; L303-L331 HydrophobicContact CD2-CD2 3.26Å; L303-L331 HydrophobicContact CD2-CG 3.79Å; L303-L331 HydrophobicContact CG-CD2 4.09Å; L327-L331 HydrophobicContact CD2-CD1 4.41Å; D328-L331 HydrophobicContact CB-CD1 4.42Å; D328-L331 WeakPolarHBondContact O-CB 3.45Å; D328-L331 PolarHBondContact O-N 2.87Å; P329-L331 VanDerWaalsContact C-N 3.27Å; P329-L331 PolarHBondContact O-N 2.97Å; L331-R333 VanDerWaalsContact C-N 3.32Å; L331-R333 PolarHBondContact O-N 3.05Å
332	L	82.5	Confident	85	Confident	39 Å²	39	61.7 Å²	61.7	20%	0.204	31%	0.308	C	S	.	.	S	Bend	trans	-85.1	-1.4	-174.6	-63.4	178.9	0	0	0	114.3	L213 V324 L327 P329 K340	L213-L332 HydrophobicContact CD2-CD2 3.47Å; L213-L332 VanDerWaalsContact CD2-CD2 3.47Å; V324-L332 HydrophobicContact CG2-CD1 4.47Å; V324-L332 HydrophobicContact CG2-CD2 4.33Å; L327-L332 HydrophobicContact CD1-CD2 4.44Å; P329-L332 PolarHBondContact O-N 2.9Å; P329-L332 VanDerWaalsContact O-N 3.15Å; L332-K340 VanDerWaalsContact O-CE 3.31Å; L332-K340 WeakPolarHBondContact O-CE 3.31Å; L332-K340 PolarHBondContact O-NZ 3.27Å
333	R	83.4	Confident	85	Confident	176 Å²	176	58.5 Å²	58.5	66%	0.664	29%	0.292	S	S	*	.	S	Bend	trans	-73.5	139.3	179.5	-170.7	-177.9	-76.2	-171.5	-4.2	110.5	P329 L331 R336	P329-R333 PolarHBondContact O-N 3.32Å; L331-R333 VanDerWaalsContact C-N 3.32Å; L331-R333 PolarHBondContact O-N 3.05Å; R333-R336 PolarHBondContact O-N 3.48Å
334	S	76.2	Confident	85.2	Confident	101 Å²	101	55.2 Å²	55.2	71%	0.706	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	141.5	172.1	-179.9	0	0	0	0	110.5	D338	S334-D338 PolarHBondContact OG-OD1 3.38Å
335	G	71.9	Confident	85.1	Confident	25 Å²	25	55.3 Å²	55.3	26%	0.258	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.3	-10.7	-168.9	0	0	0	0	0	114	K210 D338	K210-G335 WeakPolarHBondContact CD-O 3.34Å; G335-D338 PolarHBondContact N-OD1 2.93Å
336	R	79.6	Confident	85.2	Confident	34 Å²	34	52.1 Å²	52.1	13%	0.128	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-60.4	176.2	-61.8	173.7	178.6	-179.1	-6.3	110.3	L306 D307 A330 R333	L306-R336 HydrophobicContact CB-CG 4.47Å; D307-R336 IonicContact OD2-CZ 2.93Å; D307-R336 IonicContact OD2-NE 3.85Å; D307-R336 IonicContact OD2-NH2 3.65Å; D307-R336 PolarHBondContact OD2-NH2 3.17Å; A330-R336 WeakPolarHBondContact O-CD 3.28Å; A330-R336 PolarHBondContact O-NH1 2.83Å; R333-R336 PolarHBondContact O-N 3.48Å
337	V	81.5	Confident	85.3	Confident	11 Å²	11	55.8 Å²	55.8	7%	0.067	30%	0.298	C	S	.	.			trans	-123.8	98.4	172.1	-171.6	0	0	0	0	108.8	L213	L213-V337 HydrophobicContact CB-CB 4.48Å; L213-V337 HydrophobicContact CB-CG1 3.32Å
338	D	82.4	Confident	85.6	Confident	51 Å²	51	59.6 Å²	59.6	27%	0.273	32%	0.315	S	S	.	.			trans	-81.8	-39.7	-171.9	-62.3	-50	0	0	0	112	P209 K210 G211 S334 G335	P209-D338 WeakPolarHBondContact CA-OD2 3.44Å; P209-D338 HydrophobicContact CB-CB 3.9Å; K210-D338 PolarHBondContact N-OD2 3.47Å; G211-D338 PolarHBondContact O-N 3.34Å; S334-D338 PolarHBondContact OG-OD1 3.38Å; G335-D338 PolarHBondContact N-OD1 2.93Å
339	R	88	Confident	85.9	Confident	143 Å²	143	66.9 Å²	66.9	54%	0.54	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.3	-178.8	-64.2	-63.2	-175	168.9	0.2	110.5	A190 P209 G211 V212 L213	A190-R339 HydrophobicContact CB-CG 4.14Å; P209-R339 HydrophobicContact CB-CG 4.39Å; G211-R339 PolarHBondContact O-N 2.83Å; V212-R339 CarbonylContact C-O 3.52Å; V212-R339 WeakPolarHBondContact CA-O 3.31Å; V212-R339 HydrophobicContact CG1-CB 4.2Å; V212-R339 HydrophobicContact CG2-CB 4.23Å; L213-R339 PolarHBondContact N-O 3.43Å
340	K	90.8	Very high	86.2	Confident	100 Å²	100	63.4 Å²	63.4	44%	0.435	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	107.1	178.1	-58.4	176.5	-174.4	172.8	0	106.9	L213 Y215 L332	L213-K340 WeakPolarHBondContact O-CA 3.36Å; Y215-K340 HydrophobicContact CD1-CB 4.44Å; Y215-K340 HydrophobicContact CE1-CB 3.85Å; L332-K340 VanDerWaalsContact O-CE 3.31Å; L332-K340 WeakPolarHBondContact O-CE 3.31Å; L332-K340 PolarHBondContact O-NZ 3.27Å
341	I	91.8	Very high	86.7	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.9	-176.5	-54.9	-177.6	0	0	0	107.9	Q183 E186 L187 V212 L213 L214 Y215 F343	Q183-I341 HydrophobicContact CB-CG2 3.69Å; Q183-I341 HydrophobicContact CG-CG2 3.48Å; Q183-I341 VanDerWaalsContact CG-CG2 3.48Å; E186-I341 HydrophobicContact CB-CD1 3.87Å; E186-I341 HydrophobicContact CB-CG1 4.31Å; L187-I341 HydrophobicContact CB-CD1 4.01Å; L187-I341 HydrophobicContact CD1-CD1 4.29Å; V212-I341 HydrophobicContact CG1-CD1 3.48Å; V212-I341 VanDerWaalsContact CG1-CD1 3.48Å; V212-I341 HydrophobicContact CG1-CG1 3.77Å; L213-I341 PolarHBondContact O-N 2.94Å; L214-I341 HydrophobicContact CD2-CB 3.98Å; L214-I341 HydrophobicContact CD2-CD1 4.04Å; L214-I341 HydrophobicContact CD2-CG1 4.37Å; Y215-I341 WeakPolarHBondContact CD1-O 3.44Å; Y215-I341 PolarHBondContact N-O 3.13Å; I341-F343 HydrophobicContact CB-CE2 4.48Å; I341-F343 HydrophobicContact CG2-CD2 4.48Å; I341-F343 HydrophobicContact CG2-CE2 4Å
342	E	92.1	Very high	87.2	Confident	110 Å²	110	63.8 Å²	63.8	51%	0.514	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.5	175.4	-166.3	165.3	153.8	0	0	111.2	Q183 Y215 P344	Q183-E342 WeakPolarHBondContact CG-O 3.38Å; Q183-E342 PolarHBondContact NE2-O 3.25Å; Q183-E342 VanDerWaalsContact NE2-O 3.1Å; Y215-E342 HydrophobicContact CD2-CG 4.25Å; Y215-E342 HydrophobicContact CE1-CB 4.12Å; Y215-E342 HydrophobicContact CE2-CB 3.84Å; Y215-E342 HydrophobicContact CE2-CG 3.54Å; Y215-E342 WeakPolarHBondContact CE2-OE2 3.47Å; Y215-E342 WeakPolarHBondContact OH-CB 3.49Å; Y215-E342 PolarHBondContact OH-OE2 3.17Å; E342-P344 WeakPolarHBondContact O-CD 3.34Å
343	F	91.5	Very high	87.6	Confident	1 Å²	1	67.3 Å²	67.3	0%	0.004	34%	0.337	C	S	.	.			trans	-101.2	98.5	172.2	-74.5	-110	0	0	0	108.6	L180 L214 Y215 P217 T220 K222 L225 I341	L180-F343 HydrophobicContact CD1-CD1 3.85Å; L180-F343 HydrophobicContact CD1-CE1 3.83Å; L180-F343 HydrophobicContact CD2-CD1 4.14Å; L214-F343 HydrophobicContact CB-CD2 4.35Å; L214-F343 HydrophobicContact CB-CE2 3.65Å; L214-F343 HydrophobicContact CB-CZ 4.33Å; L214-F343 HydrophobicContact CD1-CE2 4.36Å; L214-F343 HydrophobicContact CD1-CZ 4.25Å; L214-F343 HydrophobicContact CD2-CE2 3.75Å; L214-F343 HydrophobicContact CD2-CZ 4.14Å; L214-F343 HydrophobicContact CG-CE2 4.09Å; L214-F343 HydrophobicContact CG-CZ 4.46Å; Y215-F343 PolarHBondContact O-N 3.11Å; P217-F343 VanDerWaalsContact CD-O 3.24Å; P217-F343 WeakPolarHBondContact CD-O 3.43Å; T220-F343 HydrophobicContact CG2-CB 4.43Å; K222-F343 HydrophobicContact CB-CZ 4.45Å; K222-F343 HydrophobicContact CD-CD2 4.49Å; K222-F343 HydrophobicContact CG-CB 4.45Å; K222-F343 HydrophobicContact CG-CD1 4Å; K222-F343 HydrophobicContact CG-CD2 3.85Å; K222-F343 HydrophobicContact CG-CE1 4.14Å; K222-F343 HydrophobicContact CG-CE2 4.04Å; K222-F343 HydrophobicContact CG-CG 3.83Å; K222-F343 HydrophobicContact CG-CZ 4.16Å; L225-F343 HydrophobicContact CB-CE1 4.41Å; L225-F343 HydrophobicContact CB-CZ 4.33Å; L225-F343 HydrophobicContact CD2-CE1 4.08Å; L225-F343 HydrophobicContact CD2-CZ 3.54Å; I341-F343 HydrophobicContact CB-CE2 4.48Å; I341-F343 HydrophobicContact CG2-CD2 4.48Å; I341-F343 HydrophobicContact CG2-CE2 4Å
344	P	89.7	Confident	88.1	Confident	59 Å²	59	59.8 Å²	59.8	38%	0.383	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-67.6	162.6	172.8	30.4	-35.1	0	0	0	110.5	Q183 E342	Q183-P344 VanDerWaalsContact NE2-CD 3.32Å; E342-P344 WeakPolarHBondContact O-CD 3.34Å
345	A	88	Confident	88.8	Confident	57 Å²	57	55 Å²	55	47%	0.471	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-60.9	145.9	164.2	0	0	0	0	0	109.6	N347	A345-N347 PolarHBondContact O-N 3.31Å
346	P	89.6	Confident	89.8	Confident	20 Å²	20	58.2 Å²	58.2	13%	0.13	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-67.7	129	-175.9	28.1	-34.5	0	0	0	111.5	A350 R351 I354 F380	P346-A350 HydrophobicContact CB-CB 3.74Å; P346-R351 HydrophobicContact CB-CG 4Å; P346-R351 HydrophobicContact CG-CG 3.92Å; P346-R351 PolarHBondContact O-NH1 2.89Å; P346-R351 VanDerWaalsContact O-NH1 3.09Å; P346-I354 HydrophobicContact CB-CD1 4.01Å; P346-I354 HydrophobicContact CG-CD1 4.46Å; P346-F380 WeakPolarHBondContact CD-O 3.46Å; P346-F380 WeakPolarHBondContact CG-O 3.33Å
347	N	90.5	Very high	90.4	Very high	119 Å²	119	57.3 Å²	57.3	64%	0.636	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-62.2	166.7	170	-63.9	-6.2	0	0	0	111.2	A345 E349 A350 R351	A345-N347 PolarHBondContact O-N 3.31Å; N347-E349 VanDerWaalsContact C-N 3.34Å; N347-E349 PolarHBondContact O-N 3.47Å; N347-A350 WeakPolarHBondContact O-CA 3.48Å; N347-A350 WeakPolarHBondContact O-CB 3.35Å; N347-A350 PolarHBondContact O-N 3.42Å; N347-R351 PolarHBondContact O-N 3.27Å
348	E	91.2	Very high	90.9	Very high	80 Å²	80	59.4 Å²	59.4	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-49.7	-51.1	177.4	-173.2	-177	157.4	0	0	112.1	A350 R351 A352 A374 R375	E348-A350 VanDerWaalsContact C-N 3.3Å; E348-A350 PolarHBondContact O-N 3.41Å; E348-R351 PolarHBondContact O-N 3.3Å; E348-R351 VanDerWaalsContact O-N 3.16Å; E348-A352 PolarHBondContact O-N 2.93Å; E348-A374 HydrophobicContact CG-CB 3.98Å; E348-A374 VanDerWaalsContact O-CB 3.31Å; E348-A374 WeakPolarHBondContact O-CB 3.17Å; E348-R375 HydrophobicContact CG-CG 4.25Å; E348-R375 WeakPolarHBondContact OE1-CG 3.39Å; E348-R375 IonicContact OE1-CZ 2.69Å; E348-R375 IonicContact OE1-NE 2.79Å; E348-R375 PolarHBondContact OE1-NE 3.12Å; E348-R375 IonicContact OE1-NH2 2.81Å
349	E	92.2	Very high	91.3	Very high	169 Å²	169	57.5 Å²	57.5	79%	0.79	28%	0.281	S	S	*	.	H	α-helix	trans	-60	-38.4	176.5	-63.3	-178.6	174.3	0	0	112.9	N347 A352 R353	N347-E349 VanDerWaalsContact C-N 3.34Å; N347-E349 PolarHBondContact O-N 3.47Å; E349-A352 PolarHBondContact O-N 2.97Å; E349-R353 WeakPolarHBondContact O-CB 3.41Å; E349-R353 PolarHBondContact O-N 2.79Å
350	A	91.9	Very high	91.4	Very high	8 Å²	8	58.3 Å²	58.3	7%	0.066	28%	0.284	C	S	.	.	H	α-helix	trans	-67.1	-40.2	177.9	0	0	0	0	0	111.2	P346 N347 E348 R353 I354	P346-A350 HydrophobicContact CB-CB 3.74Å; N347-A350 WeakPolarHBondContact O-CA 3.48Å; N347-A350 WeakPolarHBondContact O-CB 3.35Å; N347-A350 PolarHBondContact O-N 3.42Å; E348-A350 VanDerWaalsContact C-N 3.3Å; E348-A350 PolarHBondContact O-N 3.41Å; A350-R353 PolarHBondContact O-N 2.93Å; A350-I354 WeakPolarHBondContact O-CB 3.34Å; A350-I354 WeakPolarHBondContact O-CD1 3.49Å; A350-I354 WeakPolarHBondContact O-CG1 3.33Å; A350-I354 PolarHBondContact O-N 3.38Å
351	R	93.2	Very high	91.3	Very high	21 Å²	21	63 Å²	63	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-45.8	175.8	-67.4	-169.1	-61.1	-103.9	18	111.5	P346 N347 E348 R353 I354 M355 A374 T377 D378	P346-R351 HydrophobicContact CB-CG 4Å; P346-R351 HydrophobicContact CG-CG 3.92Å; P346-R351 PolarHBondContact O-NH1 2.89Å; P346-R351 VanDerWaalsContact O-NH1 3.09Å; N347-R351 PolarHBondContact O-N 3.27Å; E348-R351 PolarHBondContact O-N 3.3Å; E348-R351 VanDerWaalsContact O-N 3.16Å; R351-R353 VanDerWaalsContact C-N 3.3Å; R351-R353 PolarHBondContact O-N 3.47Å; R351-I354 PolarHBondContact O-N 3.45Å; R351-M355 WeakPolarHBondContact O-CG 3.22Å; R351-M355 PolarHBondContact O-N 3.46Å; R351-A374 HydrophobicContact CB-CB 4.14Å; R351-A374 PolarHBondContact NE-O 3.35Å; R351-A374 PolarHBondContact NH2-O 3.25Å; R351-T377 WeakPolarHBondContact CD-O 3.3Å; R351-T377 PolarHBondContact NE-O 3.04Å; R351-D378 IonicContact NH2-OD1 2.93Å; R351-D378 PolarHBondContact NH2-OD1 2.76Å
352	A	92.6	Very high	91.2	Very high	15 Å²	15	65.9 Å²	65.9	12%	0.124	32%	0.319	C	S	.	.	H	α-helix	trans	-55.4	-47.7	175	0	0	0	0	0	110.8	E348 E349 M355 Q356 F370 A374	E348-A352 PolarHBondContact O-N 2.93Å; E349-A352 PolarHBondContact O-N 2.97Å; A352-M355 PolarHBondContact O-N 3.29Å; A352-Q356 WeakPolarHBondContact O-CB 3.4Å; A352-Q356 PolarHBondContact O-N 3.01Å; A352-F370 HydrophobicContact CB-CB 4.34Å; A352-A374 HydrophobicContact CB-CB 3.81Å
353	R	92.4	Very high	91.2	Very high	112 Å²	112	65.1 Å²	65.1	42%	0.423	32%	0.318	S	S	.	.	H	α-helix	trans	-65.7	-40.6	179.6	-166.9	167.1	-178.2	166.9	-4.4	113.1	D181 E349 A350 R351 Q356 I357	D181-R353 IonicContact OD2-NH1 2.87Å; E349-R353 WeakPolarHBondContact O-CB 3.41Å; E349-R353 PolarHBondContact O-N 2.79Å; A350-R353 PolarHBondContact O-N 2.93Å; R351-R353 VanDerWaalsContact C-N 3.3Å; R351-R353 PolarHBondContact O-N 3.47Å; R353-Q356 PolarHBondContact O-N 2.87Å; R353-I357 HydrophobicContact CG-CD1 4.18Å; R353-I357 WeakPolarHBondContact O-CD1 2.96Å; R353-I357 VanDerWaalsContact O-CG1 3.25Å; R353-I357 WeakPolarHBondContact O-CG1 3.43Å; R353-I357 PolarHBondContact O-N 3.05Å
354	I	92.8	Very high	91.2	Very high	19 Å²	19	66.7 Å²	66.7	10%	0.097	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-46.3	177.3	-69.5	162.7	0	0	0	110.5	P346 A350 R351 Q356 I357 H358 C385	P346-I354 HydrophobicContact CB-CD1 4.01Å; P346-I354 HydrophobicContact CG-CD1 4.46Å; A350-I354 WeakPolarHBondContact O-CB 3.34Å; A350-I354 WeakPolarHBondContact O-CD1 3.49Å; A350-I354 WeakPolarHBondContact O-CG1 3.33Å; A350-I354 PolarHBondContact O-N 3.38Å; R351-I354 PolarHBondContact O-N 3.45Å; I354-Q356 VanDerWaalsContact C-N 3.32Å; I354-Q356 PolarHBondContact O-N 2.86Å; I354-I357 PolarHBondContact O-N 3.43Å; I354-H358 PolarHBondContact O-CD2 3.46Å; I354-H358 VanDerWaalsContact O-CD2 3.3Å; I354-H358 PolarHBondContact O-N 3.45Å; I354-H358 VanDerWaalsContact O-N 3.13Å; I354-C385 HydrophobicContact CB-CB 4.35Å; I354-C385 HydrophobicContact CG2-CB 3.66Å
355	M	92.3	Very high	91.2	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-42.5	176	-69.9	-175.5	-174.4	0	0	111.4	R351 A352 I357 H358 S359 F370 L373 T377 C385 V388	R351-M355 WeakPolarHBondContact O-CG 3.22Å; R351-M355 PolarHBondContact O-N 3.46Å; A352-M355 PolarHBondContact O-N 3.29Å; M355-I357 VanDerWaalsContact C-N 3.32Å; M355-I357 PolarHBondContact O-N 3.05Å; M355-H358 PolarHBondContact O-N 3.09Å; M355-S359 WeakPolarHBondContact O-CB 3.24Å; M355-S359 PolarHBondContact O-N 3.42Å; M355-S359 PolarHBondContact O-OG 3.37Å; M355-F370 HydrophobicContact CB-CD1 3.91Å; M355-F370 HydrophobicContact CB-CE1 4.32Å; M355-L373 HydrophobicContact SD-CB 3.88Å; M355-L373 HydrophobicContact SD-CD1 4.47Å; M355-T377 HydrophobicContact CE-CG2 3.47Å; M355-T377 VanDerWaalsContact CE-CG2 3.47Å; M355-T377 WeakPolarHBondContact CE-OG1 3.2Å; M355-C385 HydrophobicContact CE-CB 4.44Å; M355-C385 HydrophobicContact CG-CB 4.13Å; M355-V388 HydrophobicContact CE-CG1 4.39Å
356	Q	92.8	Very high	91.1	Very high	93 Å²	93	74 Å²	74	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-37.3	177.1	-166	-174.5	28.5	0	0	112.5	A352 R353 I354 S359 R360 F370	A352-Q356 WeakPolarHBondContact O-CB 3.4Å; A352-Q356 PolarHBondContact O-N 3.01Å; R353-Q356 PolarHBondContact O-N 2.87Å; I354-Q356 VanDerWaalsContact C-N 3.32Å; I354-Q356 PolarHBondContact O-N 2.86Å; Q356-S359 WeakPolarHBondContact CA-OG 3.46Å; Q356-S359 PolarHBondContact O-OG 3.13Å; Q356-R360 WeakPolarHBondContact O-CG 3.08Å; Q356-R360 PolarHBondContact O-N 3.22Å; Q356-F370 HydrophobicContact CB-CD2 4.46Å; Q356-F370 HydrophobicContact CB-CG 4.47Å; Q356-F370 HydrophobicContact CG-CD2 4.35Å; Q356-F370 HydrophobicContact CG-CE2 4.29Å
357	I	92.4	Very high	91.1	Very high	15 Å²	15	78.8 Å²	78.8	8%	0.077	37%	0.368	C	S	.	.	H	α-helix	trans	-67	-45.2	177.3	-70.9	161.8	0	0	0	110.5	D176 R353 I354 M355 R360	D176-I357 HydrophobicContact CB-CG2 4.44Å; R353-I357 HydrophobicContact CG-CD1 4.18Å; R353-I357 WeakPolarHBondContact O-CD1 2.96Å; R353-I357 VanDerWaalsContact O-CG1 3.25Å; R353-I357 WeakPolarHBondContact O-CG1 3.43Å; R353-I357 PolarHBondContact O-N 3.05Å; I354-I357 PolarHBondContact O-N 3.43Å; M355-I357 VanDerWaalsContact C-N 3.32Å; M355-I357 PolarHBondContact O-N 3.05Å; I357-R360 WeakPolarHBondContact O-CB 3.43Å; I357-R360 PolarHBondContact O-N 3.17Å
358	H	90.8	Very high	91	Very high	55 Å²	55	73.7 Å²	73.7	26%	0.255	34%	0.342	S	S	.	.	H	α-helix	trans	-71.9	-29.3	-179.2	-71.4	-47.8	0	0	0	113.2	I354 M355 R360 C389	I354-H358 PolarHBondContact O-CD2 3.46Å; I354-H358 VanDerWaalsContact O-CD2 3.3Å; I354-H358 PolarHBondContact O-N 3.45Å; I354-H358 VanDerWaalsContact O-N 3.13Å; M355-H358 PolarHBondContact O-N 3.09Å; H358-R360 VanDerWaalsContact C-N 3.31Å; H358-R360 PolarHBondContact O-N 3.05Å; H358-C389 HydrophobicContact CB-CB 4.11Å
359	S	90.9	Very high	91.1	Very high	10 Å²	10	73.1 Å²	73.1	7%	0.07	34%	0.341	C	S	.	.	H	α-helix	trans	-71.7	-19.5	176.2	64.5	0	0	0	0	113.8	M355 Q356 K361 M362 F370 Y409	M355-S359 WeakPolarHBondContact O-CB 3.24Å; M355-S359 PolarHBondContact O-N 3.42Å; M355-S359 PolarHBondContact O-OG 3.37Å; Q356-S359 WeakPolarHBondContact CA-OG 3.46Å; Q356-S359 PolarHBondContact O-OG 3.13Å; S359-K361 PolarHBondContact O-N 3.37Å; S359-M362 PolarHBondContact O-N 3.01Å; S359-M362 VanDerWaalsContact O-O 3.08Å; S359-F370 WeakPolarHBondContact OG-CZ 3.11Å; S359-Y409 WeakPolarHBondContact CB-OH 3.44Å
360	R	89.7	Confident	91.1	Very high	160 Å²	160	66.9 Å²	66.9	60%	0.604	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.1	177.5	-70.7	178.2	-173.7	169.6	1.6	114.5	Q356 I357 H358 M362	Q356-R360 WeakPolarHBondContact O-CG 3.08Å; Q356-R360 PolarHBondContact O-N 3.22Å; I357-R360 WeakPolarHBondContact O-CB 3.43Å; I357-R360 PolarHBondContact O-N 3.17Å; H358-R360 VanDerWaalsContact C-N 3.31Å; H358-R360 PolarHBondContact O-N 3.05Å; R360-M362 VanDerWaalsContact C-N 3.34Å
361	K	88.6	Confident	91.1	Very high	199 Å²	199	72.5 Å²	72.5	87%	0.865	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.6	178.6	-65.2	-174.9	179.8	-178.6	0	113	S359	S359-K361 PolarHBondContact O-N 3.37Å
362	M	90.5	Very high	91.1	Very high	62 Å²	62	76 Å²	76	31%	0.305	35%	0.354	S	S	.	.	S	Bend	trans	-113.2	155.2	-175.4	-58.7	177.6	-169.3	0	0	110.1	S359 R360 V364 C389	S359-M362 PolarHBondContact O-N 3.01Å; S359-M362 VanDerWaalsContact O-O 3.08Å; R360-M362 VanDerWaalsContact C-N 3.34Å; M362-V364 HydrophobicContact CB-CG2 4.09Å; M362-V364 PolarHBondContact O-N 3.29Å; M362-C389 HydrophobicContact CE-CB 4.28Å; M362-C389 WeakPolarHBondContact CE-O 3.41Å; M362-C389 VanDerWaalsContact SD-O 3.41Å
363	N	91.9	Very high	91.1	Very high	93 Å²	93	75.3 Å²	75.3	50%	0.497	35%	0.348	S	S	.	.			trans	-83.9	105.8	171.7	-167.4	23.4	0	0	0	108.8	S402 E403 V404	N363-S402 WeakPolarHBondContact CB-O 3.48Å; N363-S402 PolarHBondContact ND2-O 3.13Å; N363-S402 VanDerWaalsContact ND2-O 3.12Å; N363-E403 WeakPolarHBondContact ND2-CG 3.29Å; N363-E403 WeakPolarHBondContact O-CA 3.33Å; N363-V404 PolarHBondContact O-N 3.13Å
364	V	91.1	Very high	91	Very high	34 Å²	34	70 Å²	70	21%	0.206	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-113.9	135.4	-174.7	-177.1	0	0	0	0	109.7	M362 V368 V404 Y409	M362-V364 HydrophobicContact CB-CG2 4.09Å; M362-V364 PolarHBondContact O-N 3.29Å; V364-V368 HydrophobicContact CG1-CB 3.83Å; V364-V368 HydrophobicContact CG1-CG1 4.27Å; V364-V368 HydrophobicContact CG1-CG2 3.51Å; V364-V404 HydrophobicContact CG2-CB 4.36Å; V364-Y409 HydrophobicContact CG1-CE2 4.1Å
365	Q	89.7	Confident	91	Very high	63 Å²	63	76.5 Å²	76.5	29%	0.294	35%	0.351	S	S	.	.			trans	-63.9	144.8	177.4	-171	172.8	-21.1	0	0	110.7	D367 V368 V404	Q365-D367 HydrophobicContact CG-CB 4.36Å; Q365-D367 PolarHBondContact NE2-OD2 2.98Å; Q365-D367 PolarHBondContact O-N 3.31Å; Q365-D367 VanDerWaalsContact O-N 3.13Å; Q365-V368 WeakPolarHBondContact O-CG2 3.43Å; Q365-V368 PolarHBondContact O-N 2.97Å; Q365-V404 WeakPolarHBondContact CB-O 3.44Å; Q365-V404 PolarHBondContact N-O 2.97Å
366	K	87.1	Confident	91	Very high	208 Å²	208	78.7 Å²	78.7	90%	0.904	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.2	-178.2	-67.6	-178.8	-179.2	176.1	0	113.9	V368	K366-V368 PolarHBondContact O-N 3Å
367	D	87.7	Confident	90.7	Very high	119 Å²	119	74.2 Å²	74.2	64%	0.636	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-1.3	-178	-57.5	-34.7	0	0	0	113.3	Q365 N369	Q365-D367 HydrophobicContact CG-CB 4.36Å; Q365-D367 PolarHBondContact NE2-OD2 2.98Å; Q365-D367 PolarHBondContact O-N 3.31Å; Q365-D367 VanDerWaalsContact O-N 3.13Å; D367-N369 PolarHBondContact O-N 3.19Å
368	V	89.2	Confident	90.5	Very high	12 Å²	12	78.5 Å²	78.5	7%	0.073	37%	0.368	C	S	.	.			trans	-75	108.6	179.1	178.8	0	0	0	0	111	V364 Q365 K366 F370 L373 H406 Y409	V364-V368 HydrophobicContact CG1-CB 3.83Å; V364-V368 HydrophobicContact CG1-CG1 4.27Å; V364-V368 HydrophobicContact CG1-CG2 3.51Å; Q365-V368 WeakPolarHBondContact O-CG2 3.43Å; Q365-V368 PolarHBondContact O-N 2.97Å; K366-V368 PolarHBondContact O-N 3Å; V368-F370 HydrophobicContact CG1-CD1 4.42Å; V368-F370 HydrophobicContact CG1-CE1 4.08Å; V368-F370 HydrophobicContact CG1-CE2 4.38Å; V368-F370 HydrophobicContact CG1-CZ 4.05Å; V368-F370 PolarHBondContact O-N 3.06Å; V368-L373 HydrophobicContact CG1-CD1 3.79Å; V368-H406 HydrophobicContact CG2-CB 4.4Å; V368-Y409 HydrophobicContact CG1-CD2 3.92Å; V368-Y409 HydrophobicContact CG1-CE2 3.91Å; V368-Y409 HydrophobicContact CG2-CD2 4.33Å; V368-Y409 HydrophobicContact CG2-CE2 4.3Å
369	N	92.5	Very high	90.2	Very high	69 Å²	69	82.1 Å²	82.1	37%	0.369	39%	0.389	S	S	.	.			trans	-85.6	102.3	173.1	-172.6	-1.6	0	0	0	112	D367 E371 E372 L373	D367-N369 PolarHBondContact O-N 3.19Å; N369-E371 VanDerWaalsContact C-N 3.28Å; N369-E371 PolarHBondContact O-N 3.39Å; N369-E371 WeakPolarHBondContact OD1-CB 3.46Å; N369-E371 PolarHBondContact OD1-N 3.01Å; N369-E372 HydrophobicContact CB-CB 4.1Å; N369-E372 PolarHBondContact O-N 3.44Å; N369-L373 WeakPolarHBondContact O-CG 3.5Å; N369-L373 PolarHBondContact O-N 3.14Å
370	F	92.5	Very high	90.1	Very high	37 Å²	37	81.8 Å²	81.8	16%	0.162	39%	0.387	C	S	.	.	H	α-helix	trans	-68.1	-23.6	178.2	-65.4	-76.1	0	0	0	113.9	A352 M355 Q356 S359 V368 L373 A374	A352-F370 HydrophobicContact CB-CB 4.34Å; M355-F370 HydrophobicContact CB-CD1 3.91Å; M355-F370 HydrophobicContact CB-CE1 4.32Å; Q356-F370 HydrophobicContact CB-CD2 4.46Å; Q356-F370 HydrophobicContact CB-CG 4.47Å; Q356-F370 HydrophobicContact CG-CD2 4.35Å; Q356-F370 HydrophobicContact CG-CE2 4.29Å; S359-F370 WeakPolarHBondContact OG-CZ 3.11Å; V368-F370 HydrophobicContact CG1-CD1 4.42Å; V368-F370 HydrophobicContact CG1-CE1 4.08Å; V368-F370 HydrophobicContact CG1-CE2 4.38Å; V368-F370 HydrophobicContact CG1-CZ 4.05Å; V368-F370 PolarHBondContact O-N 3.06Å; F370-L373 HydrophobicContact CD1-CD1 4.26Å; F370-A374 WeakPolarHBondContact O-CB 3.49Å; F370-A374 PolarHBondContact O-N 3.3Å
371	E	92.6	Very high	90.1	Very high	126 Å²	126	76 Å²	76	59%	0.589	37%	0.367	S	S	*	.	H	α-helix	trans	-69	-41.1	176.1	-61.9	-178.8	179.3	0	0	110.6	N369 A374 R375	N369-E371 VanDerWaalsContact C-N 3.28Å; N369-E371 PolarHBondContact O-N 3.39Å; N369-E371 WeakPolarHBondContact OD1-CB 3.46Å; N369-E371 PolarHBondContact OD1-N 3.01Å; E371-A374 WeakPolarHBondContact O-CB 3.38Å; E371-A374 PolarHBondContact O-N 3.41Å; E371-R375 PolarHBondContact O-N 2.98Å; E371-R375 VanDerWaalsContact O-N 3.13Å
372	E	92.5	Very high	90.1	Very high	95 Å²	95	67.1 Å²	67.1	44%	0.444	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-44.5	175.2	-175.5	169.6	-166.9	0	0	111.6	N369 A374 R375 C376 H406	N369-E372 HydrophobicContact CB-CB 4.1Å; N369-E372 PolarHBondContact O-N 3.44Å; E372-A374 PolarHBondContact O-N 3.19Å; E372-R375 WeakPolarHBondContact O-CB 3.46Å; E372-R375 PolarHBondContact O-N 3.38Å; E372-R375 VanDerWaalsContact O-N 3.13Å; E372-C376 PolarHBondContact O-N 3.34Å; E372-C376 VanDerWaalsContact O-N 3.1Å; E372-C376 PolarHBondContact O-SG 3.4Å; E372-H406 IonicContact OE2-CE1 2.81Å; E372-H406 IonicContact OE2-NE2 2.82Å
373	L	92.2	Very high	90	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-34.9	174.6	-63.4	178.7	0	0	0	112.4	M355 V368 N369 F370 C376 T377 Y409 M410 I413	M355-L373 HydrophobicContact SD-CB 3.88Å; M355-L373 HydrophobicContact SD-CD1 4.47Å; V368-L373 HydrophobicContact CG1-CD1 3.79Å; N369-L373 WeakPolarHBondContact O-CG 3.5Å; N369-L373 PolarHBondContact O-N 3.14Å; F370-L373 HydrophobicContact CD1-CD1 4.26Å; L373-C376 PolarHBondContact O-N 3.19Å; L373-T377 WeakPolarHBondContact O-CG2 3.34Å; L373-T377 PolarHBondContact O-N 2.9Å; L373-T377 PolarHBondContact O-OG1 3.41Å; L373-Y409 HydrophobicContact CD1-CD1 3.89Å; L373-Y409 HydrophobicContact CD1-CD2 4.04Å; L373-Y409 HydrophobicContact CD1-CG 3.61Å; L373-Y409 HydrophobicContact CD2-CG 4.46Å; L373-M410 HydrophobicContact CD2-CG 4.4Å; L373-M410 HydrophobicContact CD2-SD 3.97Å; L373-I413 HydrophobicContact CD2-CD1 3.93Å
374	A	92.4	Very high	90	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-34.5	176.7	0	0	0	0	0	112.8	E348 R351 A352 F370 E371 E372 T377	E348-A374 HydrophobicContact CG-CB 3.98Å; E348-A374 VanDerWaalsContact O-CB 3.31Å; E348-A374 WeakPolarHBondContact O-CB 3.17Å; R351-A374 HydrophobicContact CB-CB 4.14Å; R351-A374 PolarHBondContact NE-O 3.35Å; R351-A374 PolarHBondContact NH2-O 3.25Å; A352-A374 HydrophobicContact CB-CB 3.81Å; F370-A374 WeakPolarHBondContact O-CB 3.49Å; F370-A374 PolarHBondContact O-N 3.3Å; E371-A374 WeakPolarHBondContact O-CB 3.38Å; E371-A374 PolarHBondContact O-N 3.41Å; E372-A374 PolarHBondContact O-N 3.19Å; A374-T377 WeakPolarHBondContact CA-OG1 3.44Å; A374-T377 PolarHBondContact O-N 2.75Å; A374-T377 PolarHBondContact O-OG1 3.13Å
375	R	92.4	Very high	90	Very high	157 Å²	157	62.8 Å²	62.8	59%	0.592	32%	0.315	S	S	*	.	H	α-helix	trans	-68.4	-35.8	172.6	-69.9	179	-175.2	171.9	7.3	112.6	E348 E371 E372 T377	E348-R375 HydrophobicContact CG-CG 4.25Å; E348-R375 WeakPolarHBondContact OE1-CG 3.39Å; E348-R375 IonicContact OE1-CZ 2.69Å; E348-R375 IonicContact OE1-NE 2.79Å; E348-R375 PolarHBondContact OE1-NE 3.12Å; E348-R375 IonicContact OE1-NH2 2.81Å; E371-R375 PolarHBondContact O-N 2.98Å; E371-R375 VanDerWaalsContact O-N 3.13Å; E372-R375 WeakPolarHBondContact O-CB 3.46Å; E372-R375 PolarHBondContact O-N 3.38Å; E372-R375 VanDerWaalsContact O-N 3.13Å; R375-T377 VanDerWaalsContact C-N 3.25Å; R375-T377 PolarHBondContact O-N 2.94Å
376	C	90.8	Very high	90.1	Very high	45 Å²	45	65.1 Å²	65.1	30%	0.304	33%	0.325	S	S	.	.	H	α-helix	trans	-74.7	-13.1	177.6	-65.4	0	0	0	0	113.8	E372 L373 M410 I413 Q417	E372-C376 PolarHBondContact O-N 3.34Å; E372-C376 VanDerWaalsContact O-N 3.1Å; E372-C376 PolarHBondContact O-SG 3.4Å; L373-C376 PolarHBondContact O-N 3.19Å; C376-M410 HydrophobicContact CB-SD 4.35Å; C376-I413 HydrophobicContact CB-CD1 4.12Å; C376-Q417 PolarHBondContact O-NE2 3.01Å
377	T	88.4	Confident	90.4	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.296	C	S	.	.			trans	-106.8	55.9	-174.5	47.8	0	0	0	0	113.7	R351 M355 L373 A374 R375 F380 I413	R351-T377 WeakPolarHBondContact CD-O 3.3Å; R351-T377 PolarHBondContact NE-O 3.04Å; M355-T377 HydrophobicContact CE-CG2 3.47Å; M355-T377 VanDerWaalsContact CE-CG2 3.47Å; M355-T377 WeakPolarHBondContact CE-OG1 3.2Å; L373-T377 WeakPolarHBondContact O-CG2 3.34Å; L373-T377 PolarHBondContact O-N 2.9Å; L373-T377 PolarHBondContact O-OG1 3.41Å; A374-T377 WeakPolarHBondContact CA-OG1 3.44Å; A374-T377 PolarHBondContact O-N 2.75Å; A374-T377 PolarHBondContact O-OG1 3.13Å; R375-T377 VanDerWaalsContact C-N 3.25Å; R375-T377 PolarHBondContact O-N 2.94Å; T377-F380 HydrophobicContact CG2-CD2 3.66Å; T377-F380 HydrophobicContact CG2-CE2 3.78Å; T377-F380 HydrophobicContact CG2-CG 4.18Å; T377-F380 HydrophobicContact CG2-CZ 4.37Å; T377-F380 PolarHBondContact O-N 3.16Å; T377-I413 HydrophobicContact CG2-CB 4.49Å; T377-I413 HydrophobicContact CG2-CD1 3.66Å; T377-I413 HydrophobicContact CG2-CG1 3.63Å; T377-I413 HydrophobicContact CG2-CG2 4.03Å
378	D	86.2	Confident	90.7	Very high	105 Å²	105	51.3 Å²	51.3	56%	0.561	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	137.1	176	-68.8	-29.9	0	0	0	112.5	R351 F380	R351-D378 IonicContact NH2-OD1 2.93Å; R351-D378 PolarHBondContact NH2-OD1 2.76Å; D378-F380 VanDerWaalsContact O-CD1 3.31Å; D378-F380 WeakPolarHBondContact O-CD1 3.49Å; D378-F380 PolarHBondContact O-N 3.39Å
379	D	85.6	Confident	90.9	Very high	130 Å²	130	50.8 Å²	50.8	70%	0.695	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	27.9	-178	-59.5	-33.6	0	0	0	115.5
380	F	88.7	Confident	91	Very high	4 Å²	4	51 Å²	51	2%	0.018	27%	0.267	C	S	.	.			trans	-83	133.5	174.3	-84.3	33.9	0	0	0	110.7	P346 T377 D378 Q384 V388 V416 Q417	P346-F380 WeakPolarHBondContact CD-O 3.46Å; P346-F380 WeakPolarHBondContact CG-O 3.33Å; T377-F380 HydrophobicContact CG2-CD2 3.66Å; T377-F380 HydrophobicContact CG2-CE2 3.78Å; T377-F380 HydrophobicContact CG2-CG 4.18Å; T377-F380 HydrophobicContact CG2-CZ 4.37Å; T377-F380 PolarHBondContact O-N 3.16Å; D378-F380 VanDerWaalsContact O-CD1 3.31Å; D378-F380 WeakPolarHBondContact O-CD1 3.49Å; D378-F380 PolarHBondContact O-N 3.39Å; F380-Q384 VanDerWaalsContact CA-OE1 3.31Å; F380-Q384 HydrophobicContact CB-CB 4.14Å; F380-Q384 HydrophobicContact CD2-CB 3.73Å; F380-Q384 HydrophobicContact CE2-CB 4.28Å; F380-Q384 HydrophobicContact CG-CB 3.99Å; F380-V388 HydrophobicContact CD2-CG2 4.06Å; F380-V388 HydrophobicContact CE2-CG2 3.54Å; F380-V416 HydrophobicContact CE2-CB 4.3Å; F380-V416 HydrophobicContact CE2-CG1 3.76Å; F380-V416 HydrophobicContact CZ-CB 4.37Å; F380-V416 HydrophobicContact CZ-CG1 3.9Å; F380-Q417 HydrophobicContact CE1-CG 3.74Å; F380-Q417 HydrophobicContact CZ-CG 3.57Å
381	N	89.1	Confident	91	Very high	37 Å²	37	51 Å²	51	20%	0.198	27%	0.267	C	S	.	.			trans	-83.9	167.6	167.4	67.6	12.7	0	0	0	111	P218 A383 Q384 C385	P218-N381 PolarHBondContact O-ND2 3.29Å; N381-A383 PolarHBondContact O-N 3.25Å; N381-A383 PolarHBondContact OD1-N 2.79Å; N381-Q384 WeakPolarHBondContact O-CB 3.31Å; N381-Q384 PolarHBondContact O-N 3.45Å; N381-Q384 VanDerWaalsContact OD1-CB 3.29Å; N381-Q384 WeakPolarHBondContact OD1-CB 3.15Å; N381-Q384 WeakPolarHBondContact OD1-CG 3.29Å; N381-Q384 PolarHBondContact OD1-N 3.41Å; N381-Q384 PolarHBondContact OD1-OE1 3.36Å; N381-C385 PolarHBondContact O-N 3.33Å
382	G	88.8	Confident	91.1	Very high	14 Å²	14	45 Å²	45	14%	0.144	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-32.8	-179.7	0	0	0	0	0	113.3	G219 K386	G219-G382 PolarHBondContact O-N 3.45Å; G219-G382 VanDerWaalsContact O-N 3.13Å; G382-K386 PolarHBondContact O-N 3.36Å
383	A	89.3	Confident	91.1	Very high	51 Å²	51	41.6 Å²	41.6	42%	0.421	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-38.6	174.1	0	0	0	0	0	113	G219 N381 K386 A387	G219-A383 PolarHBondContact O-N 3.48Å; N381-A383 PolarHBondContact O-N 3.25Å; N381-A383 PolarHBondContact OD1-N 2.79Å; A383-K386 WeakPolarHBondContact O-CB 3.45Å; A383-K386 PolarHBondContact O-N 3.1Å; A383-A387 PolarHBondContact O-N 2.82Å
384	Q	91.4	Very high	91.1	Very high	46 Å²	46	45.9 Å²	45.9	22%	0.215	25%	0.25	C	S	.	.	H	α-helix	trans	-71	-41.8	175.7	-75.9	164.5	-27.4	0	0	111.4	F380 N381 K386 A387 V388 V416	F380-Q384 VanDerWaalsContact CA-OE1 3.31Å; F380-Q384 HydrophobicContact CB-CB 4.14Å; F380-Q384 HydrophobicContact CD2-CB 3.73Å; F380-Q384 HydrophobicContact CE2-CB 4.28Å; F380-Q384 HydrophobicContact CG-CB 3.99Å; N381-Q384 WeakPolarHBondContact O-CB 3.31Å; N381-Q384 PolarHBondContact O-N 3.45Å; N381-Q384 VanDerWaalsContact OD1-CB 3.29Å; N381-Q384 WeakPolarHBondContact OD1-CB 3.15Å; N381-Q384 WeakPolarHBondContact OD1-CG 3.29Å; N381-Q384 PolarHBondContact OD1-N 3.41Å; N381-Q384 PolarHBondContact OD1-OE1 3.36Å; Q384-K386 VanDerWaalsContact C-N 3.26Å; Q384-K386 PolarHBondContact O-N 3.26Å; Q384-A387 WeakPolarHBondContact O-CA 3.42Å; Q384-A387 WeakPolarHBondContact O-CB 3.42Å; Q384-A387 PolarHBondContact O-N 3.24Å; Q384-V388 WeakPolarHBondContact O-CG2 3.41Å; Q384-V388 PolarHBondContact O-N 2.89Å; Q384-V416 HydrophobicContact CB-CG1 4.45Å; Q384-V416 HydrophobicContact CG-CG1 4.45Å
385	C	92	Very high	91.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-41.2	172.2	-64.5	0	0	0	0	111.4	I354 M355 N381 V388 C389	I354-C385 HydrophobicContact CB-CB 4.35Å; I354-C385 HydrophobicContact CG2-CB 3.66Å; M355-C385 HydrophobicContact CE-CB 4.44Å; M355-C385 HydrophobicContact CG-CB 4.13Å; N381-C385 PolarHBondContact O-N 3.33Å; C385-V388 PolarHBondContact O-N 3.05Å; C385-C389 PolarHBondContact O-N 2.94Å; C385-C389 PolarHBondContact O-SG 3.14Å; C385-C389 VanDerWaalsContact O-SG 3.41Å
386	K	91.6	Very high	91.2	Very high	113 Å²	113	39.5 Å²	39.5	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-62.6	-43.1	172.4	-176.1	-178.1	175.7	-176.4	0	112.1	G382 A383 Q384 V388 C389 V390	G382-K386 PolarHBondContact O-N 3.36Å; A383-K386 WeakPolarHBondContact O-CB 3.45Å; A383-K386 PolarHBondContact O-N 3.1Å; Q384-K386 VanDerWaalsContact C-N 3.26Å; Q384-K386 PolarHBondContact O-N 3.26Å; K386-V388 VanDerWaalsContact C-N 3.32Å; K386-V388 PolarHBondContact O-N 2.9Å; K386-C389 PolarHBondContact O-N 2.87Å; K386-V390 WeakPolarHBondContact O-CG2 3.49Å; K386-V390 PolarHBondContact O-N 3.44Å; K386-V390 VanDerWaalsContact O-N 3.14Å
387	A	92.9	Very high	91.3	Very high	37 Å²	37	43 Å²	43	31%	0.306	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-40.3	178.1	0	0	0	0	0	111.8	A383 Q384 C389 V390 E391 V416	A383-A387 PolarHBondContact O-N 2.82Å; Q384-A387 WeakPolarHBondContact O-CA 3.42Å; Q384-A387 WeakPolarHBondContact O-CB 3.42Å; Q384-A387 PolarHBondContact O-N 3.24Å; A387-C389 VanDerWaalsContact C-N 3.34Å; A387-C389 PolarHBondContact O-N 3.13Å; A387-V390 PolarHBondContact O-N 3.41Å; A387-V390 VanDerWaalsContact O-N 3.13Å; A387-E391 WeakPolarHBondContact O-CG 3.49Å; A387-E391 PolarHBondContact O-N 3.24Å; A387-V416 HydrophobicContact CB-CG2 4.33Å
388	V	93.8	Very high	91.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.8	-46.4	174	170.6	0	0	0	0	111.2	M355 F380 Q384 C385 K386 V390 E391 A392 Y409 A412 I413 V416	M355-V388 HydrophobicContact CE-CG1 4.39Å; F380-V388 HydrophobicContact CD2-CG2 4.06Å; F380-V388 HydrophobicContact CE2-CG2 3.54Å; Q384-V388 WeakPolarHBondContact O-CG2 3.41Å; Q384-V388 PolarHBondContact O-N 2.89Å; C385-V388 PolarHBondContact O-N 3.05Å; K386-V388 VanDerWaalsContact C-N 3.32Å; K386-V388 PolarHBondContact O-N 2.9Å; V388-V390 VanDerWaalsContact C-N 3.31Å; V388-V390 PolarHBondContact O-N 3.38Å; V388-E391 PolarHBondContact O-N 3.39Å; V388-A392 WeakPolarHBondContact O-CB 3.48Å; V388-A392 PolarHBondContact O-N 3.47Å; V388-Y409 HydrophobicContact CG1-CD1 3.99Å; V388-A412 HydrophobicContact CG1-CB 4.24Å; V388-I413 HydrophobicContact CG1-CG1 3.74Å; V388-I413 HydrophobicContact CG2-CG1 4.06Å; V388-V416 HydrophobicContact CG2-CB 4.22Å; V388-V416 HydrophobicContact CG2-CG1 4.4Å; V388-V416 HydrophobicContact CG2-CG2 4.02Å
389	C	93.3	Very high	91.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.007	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-39	177.3	-58.6	0	0	0	0	112.4	H358 M362 C385 K386 A387 G393 Y409	H358-C389 HydrophobicContact CB-CB 4.11Å; M362-C389 HydrophobicContact CE-CB 4.28Å; M362-C389 WeakPolarHBondContact CE-O 3.41Å; M362-C389 VanDerWaalsContact SD-O 3.41Å; C385-C389 PolarHBondContact O-N 2.94Å; C385-C389 PolarHBondContact O-SG 3.14Å; C385-C389 VanDerWaalsContact O-SG 3.41Å; K386-C389 PolarHBondContact O-N 2.87Å; A387-C389 VanDerWaalsContact C-N 3.34Å; A387-C389 PolarHBondContact O-N 3.13Å; C389-G393 PolarHBondContact O-N 3.27Å; C389-Y409 HydrophobicContact CB-CE1 4.48Å
390	V	93.9	Very high	91.9	Very high	74 Å²	74	49 Å²	49	45%	0.448	27%	0.265	S	S	.	.	H	α-helix	trans	-67.4	-45.8	178.3	175.7	0	0	0	0	111.1	K386 A387 V388 G393 M394	K386-V390 WeakPolarHBondContact O-CG2 3.49Å; K386-V390 PolarHBondContact O-N 3.44Å; K386-V390 VanDerWaalsContact O-N 3.14Å; A387-V390 PolarHBondContact O-N 3.41Å; A387-V390 VanDerWaalsContact O-N 3.13Å; V388-V390 VanDerWaalsContact C-N 3.31Å; V388-V390 PolarHBondContact O-N 3.38Å; V390-G393 PolarHBondContact O-N 3.19Å; V390-M394 WeakPolarHBondContact O-CG 3.33Å; V390-M394 PolarHBondContact O-N 3.44Å
391	E	93.3	Very high	92	Very high	36 Å²	36	50.7 Å²	50.7	17%	0.168	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-38.9	178.9	-66.6	-64.9	-179.6	0	0	111.7	A387 V388 G393 M394 I395 A412 V416 K419	A387-E391 WeakPolarHBondContact O-CG 3.49Å; A387-E391 PolarHBondContact O-N 3.24Å; V388-E391 PolarHBondContact O-N 3.39Å; E391-G393 VanDerWaalsContact C-N 3.29Å; E391-G393 PolarHBondContact O-N 3.37Å; E391-M394 WeakPolarHBondContact O-CA 3.41Å; E391-M394 WeakPolarHBondContact O-CB 3.46Å; E391-M394 PolarHBondContact O-N 3.19Å; E391-I395 WeakPolarHBondContact O-CG1 3.36Å; E391-I395 PolarHBondContact O-N 3.35Å; E391-A412 HydrophobicContact CB-CB 3.75Å; E391-V416 HydrophobicContact CG-CG2 4.09Å; E391-K419 IonicContact OE1-NZ 2.84Å; E391-K419 PolarHBondContact OE1-NZ 3.42Å
392	A	93.6	Very high	92	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-41.4	174.6	0	0	0	0	0	111.5	V388 M394 I395 A396 V404 D408 Y409 A412	V388-A392 WeakPolarHBondContact O-CB 3.48Å; V388-A392 PolarHBondContact O-N 3.47Å; A392-M394 VanDerWaalsContact C-N 3.34Å; A392-M394 PolarHBondContact O-N 3.04Å; A392-I395 PolarHBondContact O-N 2.74Å; A392-A396 WeakPolarHBondContact O-CB 3.22Å; A392-A396 PolarHBondContact O-N 3.45Å; A392-V404 HydrophobicContact CB-CG1 3.94Å; A392-D408 HydrophobicContact CB-CB 4.41Å; A392-Y409 HydrophobicContact CB-CD1 3.67Å; A392-Y409 HydrophobicContact CB-CD2 4.37Å; A392-Y409 HydrophobicContact CB-CE1 3.83Å; A392-Y409 HydrophobicContact CB-CG 3.96Å; A392-A412 HydrophobicContact CB-CB 3.94Å
393	G	93.4	Very high	92.2	Very high	23 Å²	23	56.9 Å²	56.9	24%	0.237	32%	0.315	C	S	.	.	H	α-helix	trans	-63.5	-37	172.8	0	0	0	0	0	113.2	C389 V390 E391 L397	C389-G393 PolarHBondContact O-N 3.27Å; V390-G393 PolarHBondContact O-N 3.19Å; E391-G393 VanDerWaalsContact C-N 3.29Å; E391-G393 PolarHBondContact O-N 3.37Å; G393-L397 WeakPolarHBondContact O-CB 3.45Å; G393-L397 PolarHBondContact O-N 3.33Å
394	M	93	Very high	92.4	Very high	90 Å²	90	54.8 Å²	54.8	44%	0.443	30%	0.297	S	S	.	.	H	α-helix	trans	-69.3	-39.3	176.1	-70.6	-61.2	-64.3	0	0	112.5	V390 E391 A392 L397 R398	V390-M394 WeakPolarHBondContact O-CG 3.33Å; V390-M394 PolarHBondContact O-N 3.44Å; E391-M394 WeakPolarHBondContact O-CA 3.41Å; E391-M394 WeakPolarHBondContact O-CB 3.46Å; E391-M394 PolarHBondContact O-N 3.19Å; A392-M394 VanDerWaalsContact C-N 3.34Å; A392-M394 PolarHBondContact O-N 3.04Å; M394-L397 WeakPolarHBondContact O-CB 3.45Å; M394-L397 PolarHBondContact O-N 3.43Å; M394-R398 WeakPolarHBondContact O-CG 3.34Å; M394-R398 PolarHBondContact O-N 3.09Å
395	I	93	Very high	92.5	Very high	20 Å²	20	53.9 Å²	53.9	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-44.4	175.5	-65.4	167.7	0	0	0	109.9	E391 A392 L397 R398 R399 D408 D411 A412	E391-I395 WeakPolarHBondContact O-CG1 3.36Å; E391-I395 PolarHBondContact O-N 3.35Å; A392-I395 PolarHBondContact O-N 2.74Å; I395-L397 PolarHBondContact O-N 3.47Å; I395-R398 WeakPolarHBondContact O-CB 3.28Å; I395-R398 PolarHBondContact O-N 3.17Å; I395-R399 PolarHBondContact O-N 3.28Å; I395-R399 VanDerWaalsContact O-N 3.16Å; I395-D408 HydrophobicContact CB-CB 4.38Å; I395-D408 HydrophobicContact CG2-CB 4.19Å; I395-D411 HydrophobicContact CD1-CB 3.7Å; I395-A412 HydrophobicContact CD1-CB 4.1Å
396	A	92.5	Very high	92.5	Very high	4 Å²	4	56 Å²	56	3%	0.033	31%	0.305	C	S	.	.	H	α-helix	trans	-59.6	-34.9	174.5	0	0	0	0	0	112.7	A392 R399 S400 A401 V404	A392-A396 WeakPolarHBondContact O-CB 3.22Å; A392-A396 PolarHBondContact O-N 3.45Å; A396-R399 WeakPolarHBondContact O-CG 3.2Å; A396-S400 PolarHBondContact O-N 2.84Å; A396-A401 PolarHBondContact O-N 3.36Å; A396-V404 HydrophobicContact CB-CB 4.46Å; A396-V404 HydrophobicContact CB-CG2 3.91Å
397	L	93.7	Very high	92.5	Very high	117 Å²	117	57.5 Å²	57.5	61%	0.613	31%	0.313	S	S	*	.	H	α-helix	trans	-69.9	-40.1	173.7	-170.9	66.6	0	0	0	112.3	G393 M394 I395 R399 S400	G393-L397 WeakPolarHBondContact O-CB 3.45Å; G393-L397 PolarHBondContact O-N 3.33Å; M394-L397 WeakPolarHBondContact O-CB 3.45Å; M394-L397 PolarHBondContact O-N 3.43Å; I395-L397 PolarHBondContact O-N 3.47Å; L397-R399 VanDerWaalsContact C-N 3.28Å; L397-R399 PolarHBondContact O-N 2.96Å; L397-S400 PolarHBondContact O-N 3.47Å
398	R	92.7	Very high	92.5	Very high	155 Å²	155	56 Å²	56	59%	0.585	30%	0.3	S	S	*	.	H	α-helix	trans	-61.4	-35.4	177.7	-71	177.2	-136.3	157.9	2	112.3	M394 I395 S400 E415	M394-R398 WeakPolarHBondContact O-CG 3.34Å; M394-R398 PolarHBondContact O-N 3.09Å; I395-R398 WeakPolarHBondContact O-CB 3.28Å; I395-R398 PolarHBondContact O-N 3.17Å; R398-S400 VanDerWaalsContact C-N 3.26Å; R398-S400 PolarHBondContact O-N 3.46Å; R398-E415 IonicContact NH1-OE2 3.98Å; R398-E415 IonicContact NH2-OE2 3.34Å; R398-E415 PolarHBondContact NH2-OE2 2.99Å
399	R	90.7	Very high	92.5	Very high	95 Å²	95	56 Å²	56	36%	0.358	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.4	174.5	66.3	-178	-165	170.2	11.4	114.2	I395 A396 L397 A401 E403 T405 D408	I395-R399 PolarHBondContact O-N 3.28Å; I395-R399 VanDerWaalsContact O-N 3.16Å; A396-R399 WeakPolarHBondContact O-CG 3.2Å; L397-R399 VanDerWaalsContact C-N 3.28Å; L397-R399 PolarHBondContact O-N 2.96Å; R399-A401 HydrophobicContact CG-CB 3.77Å; R399-A401 PolarHBondContact O-N 2.97Å; R399-E403 PolarHBondContact NH2-O 3.24Å; R399-T405 PolarHBondContact NH1-OG1 3.29Å; R399-T405 PolarHBondContact NH2-OG1 2.86Å; R399-D408 IonicContact CZ-OD1 3.38Å; R399-D408 IonicContact CZ-OD2 3.52Å; R399-D408 IonicContact NE-OD1 2.85Å; R399-D408 PolarHBondContact NE-OD1 2.69Å; R399-D408 IonicContact NE-OD2 3.18Å; R399-D408 IonicContact NH1-OD1 3.4Å; R399-D408 PolarHBondContact NH1-OD1 3.1Å; R399-D408 IonicContact NH1-OD2 2.69Å; R399-D408 PolarHBondContact NH1-OD2 3.26Å; R399-D408 IonicContact NH2-OD2 3.69Å; R399-D408 PolarHBondContact NH2-OD2 2.91Å
400	S	89.8	Confident	92.5	Very high	112 Å²	112	59.1 Å²	59.1	78%	0.783	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	30.8	-175.9	-52.7	0	0	0	0	114.4	A396 L397 R398	A396-S400 PolarHBondContact O-N 2.84Å; L397-S400 PolarHBondContact O-N 3.47Å; R398-S400 VanDerWaalsContact C-N 3.26Å; R398-S400 PolarHBondContact O-N 3.46Å
401	A	89.6	Confident	92.4	Very high	40 Å²	40	59.6 Å²	59.6	33%	0.331	32%	0.316	S	S	.	.			trans	-89.9	149.8	176.6	0	0	0	0	0	111.6	A396 R399	A396-A401 PolarHBondContact O-N 3.36Å; R399-A401 HydrophobicContact CG-CB 3.77Å; R399-A401 PolarHBondContact O-N 2.97Å
402	S	90.3	Very high	92.4	Very high	100 Å²	100	57.9 Å²	57.9	70%	0.699	31%	0.308	S	S	*	.	S	Bend	trans	-87.1	-11.8	175.5	54.2	0	0	0	0	114.1	N363	N363-S402 WeakPolarHBondContact CB-O 3.48Å; N363-S402 PolarHBondContact ND2-O 3.13Å; N363-S402 VanDerWaalsContact ND2-O 3.12Å
403	E	92.9	Very high	92.4	Very high	80 Å²	80	58.1 Å²	58.1	37%	0.374	31%	0.309	S	S	.	.	S	Bend	trans	-128.2	147.1	-176.5	-73.4	177.4	-162.4	0	0	109.6	N363 R399	N363-E403 WeakPolarHBondContact ND2-CG 3.29Å; N363-E403 WeakPolarHBondContact O-CA 3.33Å; R399-E403 PolarHBondContact NH2-O 3.24Å
404	V	93.1	Very high	92.2	Very high	8 Å²	8	62.1 Å²	62.1	5%	0.048	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-91.5	125	172.5	-172.9	0	0	0	0	108.9	N363 V364 Q365 A392 A396 D408 Y409	N363-V404 PolarHBondContact O-N 3.13Å; V364-V404 HydrophobicContact CG2-CB 4.36Å; Q365-V404 WeakPolarHBondContact CB-O 3.44Å; Q365-V404 PolarHBondContact N-O 2.97Å; A392-V404 HydrophobicContact CB-CG1 3.94Å; A396-V404 HydrophobicContact CB-CB 4.46Å; A396-V404 HydrophobicContact CB-CG2 3.91Å; V404-D408 HydrophobicContact CG1-CB 3.96Å; V404-Y409 HydrophobicContact CB-CE2 4.33Å; V404-Y409 HydrophobicContact CG1-CD2 3.85Å; V404-Y409 HydrophobicContact CG1-CE2 3.51Å
405	T	92.8	Very high	92.1	Very high	26 Å²	26	60.6 Å²	60.6	16%	0.16	32%	0.316	C	S	.	.			trans	-92.9	168.1	177	58.2	0	0	0	0	111.6	R399 E407 D408 Y409	R399-T405 PolarHBondContact NH1-OG1 3.29Å; R399-T405 PolarHBondContact NH2-OG1 2.86Å; T405-E407 VanDerWaalsContact C-N 3.28Å; T405-E407 PolarHBondContact O-N 3.34Å; T405-D408 PolarHBondContact N-OD2 2.95Å; T405-D408 PolarHBondContact O-N 2.73Å; T405-D408 PolarHBondContact OG1-OD2 3.04Å; T405-Y409 WeakPolarHBondContact O-CD2 3.36Å
406	H	92.5	Very high	91.8	Very high	45 Å²	45	60.3 Å²	60.3	21%	0.208	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-36	175	-173.4	82.1	0	0	0	112.5	V368 E372 D408 Y409 M410	V368-H406 HydrophobicContact CG2-CB 4.4Å; E372-H406 IonicContact OE2-CE1 2.81Å; E372-H406 IonicContact OE2-NE2 2.82Å; H406-D408 VanDerWaalsContact C-N 3.35Å; H406-D408 PolarHBondContact O-N 3.4Å; H406-Y409 WeakPolarHBondContact O-CB 3.49Å; H406-Y409 PolarHBondContact O-N 2.76Å; H406-M410 PolarHBondContact O-N 2.9Å; H406-M410 VanDerWaalsContact O-N 3.17Å
407	E	92.2	Very high	91.5	Very high	145 Å²	145	62.5 Å²	62.5	68%	0.678	32%	0.324	S	S	*	.	H	α-helix	trans	-61.9	-40.1	178.1	-63.9	-178	172	0	0	112.1	T405 Y409 M410 D411	T405-E407 VanDerWaalsContact C-N 3.28Å; T405-E407 PolarHBondContact O-N 3.34Å; E407-Y409 VanDerWaalsContact C-N 3.25Å; E407-Y409 PolarHBondContact O-N 2.67Å; E407-M410 PolarHBondContact O-N 2.92Å; E407-M410 VanDerWaalsContact O-N 3.09Å; E407-D411 PolarHBondContact O-N 2.81Å
408	D	93.5	Very high	90.8	Very high	5 Å²	5	59.6 Å²	59.6	3%	0.027	32%	0.318	C	S	.	.	H	α-helix	trans	-63.4	-33.7	178.1	-50.7	-55.9	0	0	0	111.9	A392 I395 R399 V404 T405 H406 A412	A392-D408 HydrophobicContact CB-CB 4.41Å; I395-D408 HydrophobicContact CB-CB 4.38Å; I395-D408 HydrophobicContact CG2-CB 4.19Å; R399-D408 IonicContact CZ-OD1 3.38Å; R399-D408 IonicContact CZ-OD2 3.52Å; R399-D408 IonicContact NE-OD1 2.85Å; R399-D408 PolarHBondContact NE-OD1 2.69Å; R399-D408 IonicContact NE-OD2 3.18Å; R399-D408 IonicContact NH1-OD1 3.4Å; R399-D408 PolarHBondContact NH1-OD1 3.1Å; R399-D408 IonicContact NH1-OD2 2.69Å; R399-D408 PolarHBondContact NH1-OD2 3.26Å; R399-D408 IonicContact NH2-OD2 3.69Å; R399-D408 PolarHBondContact NH2-OD2 2.91Å; V404-D408 HydrophobicContact CG1-CB 3.96Å; T405-D408 PolarHBondContact N-OD2 2.95Å; T405-D408 PolarHBondContact O-N 2.73Å; T405-D408 PolarHBondContact OG1-OD2 3.04Å; H406-D408 VanDerWaalsContact C-N 3.35Å; H406-D408 PolarHBondContact O-N 3.4Å; D408-A412 WeakPolarHBondContact O-CB 3.39Å; D408-A412 PolarHBondContact O-N 3.07Å
409	Y	93.7	Very high	90	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-69	-39.5	174.7	-82	-77	0	0	0	111.8	S359 V364 V368 L373 V388 C389 A392 V404 T405 H406 E407 A412 I413	S359-Y409 WeakPolarHBondContact CB-OH 3.44Å; V364-Y409 HydrophobicContact CG1-CE2 4.1Å; V368-Y409 HydrophobicContact CG1-CD2 3.92Å; V368-Y409 HydrophobicContact CG1-CE2 3.91Å; V368-Y409 HydrophobicContact CG2-CD2 4.33Å; V368-Y409 HydrophobicContact CG2-CE2 4.3Å; L373-Y409 HydrophobicContact CD1-CD1 3.89Å; L373-Y409 HydrophobicContact CD1-CD2 4.04Å; L373-Y409 HydrophobicContact CD1-CG 3.61Å; L373-Y409 HydrophobicContact CD2-CG 4.46Å; V388-Y409 HydrophobicContact CG1-CD1 3.99Å; C389-Y409 HydrophobicContact CB-CE1 4.48Å; A392-Y409 HydrophobicContact CB-CD1 3.67Å; A392-Y409 HydrophobicContact CB-CD2 4.37Å; A392-Y409 HydrophobicContact CB-CE1 3.83Å; A392-Y409 HydrophobicContact CB-CG 3.96Å; V404-Y409 HydrophobicContact CB-CE2 4.33Å; V404-Y409 HydrophobicContact CG1-CD2 3.85Å; V404-Y409 HydrophobicContact CG1-CE2 3.51Å; T405-Y409 WeakPolarHBondContact O-CD2 3.36Å; H406-Y409 WeakPolarHBondContact O-CB 3.49Å; H406-Y409 PolarHBondContact O-N 2.76Å; E407-Y409 VanDerWaalsContact C-N 3.25Å; E407-Y409 PolarHBondContact O-N 2.67Å; Y409-A412 PolarHBondContact O-N 2.98Å; Y409-I413 WeakPolarHBondContact O-CG1 3.37Å; Y409-I413 PolarHBondContact O-N 2.98Å
410	M	92.9	Very high	88.9	Confident	66 Å²	66	58.6 Å²	58.6	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-44.9	176.9	-70.1	-62.2	-71.1	0	0	111.4	L373 C376 H406 E407 A412 I413 L414	L373-M410 HydrophobicContact CD2-CG 4.4Å; L373-M410 HydrophobicContact CD2-SD 3.97Å; C376-M410 HydrophobicContact CB-SD 4.35Å; H406-M410 PolarHBondContact O-N 2.9Å; H406-M410 VanDerWaalsContact O-N 3.17Å; E407-M410 PolarHBondContact O-N 2.92Å; E407-M410 VanDerWaalsContact O-N 3.09Å; M410-A412 VanDerWaalsContact C-N 3.33Å; M410-A412 PolarHBondContact O-N 3.29Å; M410-I413 PolarHBondContact O-N 2.96Å; M410-I413 HydrophobicContact SD-CD1 4.29Å; M410-L414 PolarHBondContact O-N 3.3Å; M410-L414 VanDerWaalsContact O-N 3.1Å
411	D	92.4	Very high	87.5	Confident	85 Å²	85	60.7 Å²	60.7	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-40.4	174.6	-74.5	-15.3	0	0	0	111.7	I395 E407 I413 L414 E415	I395-D411 HydrophobicContact CD1-CB 3.7Å; E407-D411 PolarHBondContact O-N 2.81Å; D411-I413 PolarHBondContact O-N 3.16Å; D411-L414 PolarHBondContact O-N 3.45Å; D411-E415 PolarHBondContact O-N 3.38Å
412	A	92.8	Very high	85.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-39.6	175.2	0	0	0	0	0	112.6	V388 E391 A392 I395 D408 Y409 M410 L414 E415 V416	V388-A412 HydrophobicContact CG1-CB 4.24Å; E391-A412 HydrophobicContact CB-CB 3.75Å; A392-A412 HydrophobicContact CB-CB 3.94Å; I395-A412 HydrophobicContact CD1-CB 4.1Å; D408-A412 WeakPolarHBondContact O-CB 3.39Å; D408-A412 PolarHBondContact O-N 3.07Å; Y409-A412 PolarHBondContact O-N 2.98Å; M410-A412 VanDerWaalsContact C-N 3.33Å; M410-A412 PolarHBondContact O-N 3.29Å; A412-L414 VanDerWaalsContact C-N 3.34Å; A412-E415 PolarHBondContact O-N 3.3Å; A412-V416 VanDerWaalsContact O-CG2 3.29Å; A412-V416 WeakPolarHBondContact O-CG2 3.43Å; A412-V416 PolarHBondContact O-N 3.45Å
413	I	92.3	Very high	83.9	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-45.5	175.2	-69.8	163.4	0	0	0	109.8	L373 C376 T377 V388 Y409 M410 D411 E415 V416 Q417	L373-I413 HydrophobicContact CD2-CD1 3.93Å; C376-I413 HydrophobicContact CB-CD1 4.12Å; T377-I413 HydrophobicContact CG2-CB 4.49Å; T377-I413 HydrophobicContact CG2-CD1 3.66Å; T377-I413 HydrophobicContact CG2-CG1 3.63Å; T377-I413 HydrophobicContact CG2-CG2 4.03Å; V388-I413 HydrophobicContact CG1-CG1 3.74Å; V388-I413 HydrophobicContact CG2-CG1 4.06Å; Y409-I413 WeakPolarHBondContact O-CG1 3.37Å; Y409-I413 PolarHBondContact O-N 2.98Å; M410-I413 PolarHBondContact O-N 2.96Å; M410-I413 HydrophobicContact SD-CD1 4.29Å; D411-I413 PolarHBondContact O-N 3.16Å; I413-E415 VanDerWaalsContact C-N 3.34Å; I413-E415 PolarHBondContact O-N 3.4Å; I413-V416 PolarHBondContact O-N 3.48Å; I413-Q417 HydrophobicContact CG2-CG 4.2Å; I413-Q417 WeakPolarHBondContact O-CB 3.48Å; I413-Q417 VanDerWaalsContact O-CG 3.28Å; I413-Q417 WeakPolarHBondContact O-CG 3.46Å; I413-Q417 PolarHBondContact O-N 3.02Å
414	L	90.7	Very high	81.8	Confident	107 Å²	107	68.3 Å²	68.3	56%	0.56	34%	0.344	S	S	*	.	H	α-helix	trans	-60.6	-42.6	177	-68	174.4	0	0	0	111.7	M410 D411 A412 Q417 A418	M410-L414 PolarHBondContact O-N 3.3Å; M410-L414 VanDerWaalsContact O-N 3.1Å; D411-L414 PolarHBondContact O-N 3.45Å; A412-L414 VanDerWaalsContact C-N 3.34Å; L414-Q417 PolarHBondContact O-N 3.06Å; L414-A418 VanDerWaalsContact O-CB 3.28Å; L414-A418 WeakPolarHBondContact O-CB 3.28Å; L414-A418 PolarHBondContact O-N 3.23Å
415	E	89.4	Confident	79.9	Confident	58 Å²	58	74.4 Å²	74.4	27%	0.271	38%	0.377	S	S	.	.	H	α-helix	trans	-64.2	-43.9	178	-162.2	-175.8	141.8	0	0	111.8	R398 D411 A412 I413 A418 K419	R398-E415 IonicContact NH1-OE2 3.98Å; R398-E415 IonicContact NH2-OE2 3.34Å; R398-E415 PolarHBondContact NH2-OE2 2.99Å; D411-E415 PolarHBondContact O-N 3.38Å; A412-E415 PolarHBondContact O-N 3.3Å; I413-E415 VanDerWaalsContact C-N 3.34Å; I413-E415 PolarHBondContact O-N 3.4Å; E415-A418 PolarHBondContact O-N 3.4Å; E415-K419 WeakPolarHBondContact O-CG 3.48Å; E415-K419 PolarHBondContact O-N 3.12Å; E415-K419 VanDerWaalsContact O-N 3.12Å; E415-K419 WeakPolarHBondContact OE1-CE 3.41Å; E415-K419 IonicContact OE1-NZ 3.72Å; E415-K419 PolarHBondContact OE1-NZ 3.4Å
416	V	88.5	Confident	78.2	Confident	13 Å²	13	83.9 Å²	83.9	8%	0.079	41%	0.411	C	S	.	.	H	α-helix	trans	-68.9	-37.8	178.2	175.6	0	0	0	0	111.6	F380 Q384 A387 V388 E391 A412 I413 K419 K420	F380-V416 HydrophobicContact CE2-CB 4.3Å; F380-V416 HydrophobicContact CE2-CG1 3.76Å; F380-V416 HydrophobicContact CZ-CB 4.37Å; F380-V416 HydrophobicContact CZ-CG1 3.9Å; Q384-V416 HydrophobicContact CB-CG1 4.45Å; Q384-V416 HydrophobicContact CG-CG1 4.45Å; A387-V416 HydrophobicContact CB-CG2 4.33Å; V388-V416 HydrophobicContact CG2-CB 4.22Å; V388-V416 HydrophobicContact CG2-CG1 4.4Å; V388-V416 HydrophobicContact CG2-CG2 4.02Å; E391-V416 HydrophobicContact CG-CG2 4.09Å; A412-V416 VanDerWaalsContact O-CG2 3.29Å; A412-V416 WeakPolarHBondContact O-CG2 3.43Å; A412-V416 PolarHBondContact O-N 3.45Å; I413-V416 PolarHBondContact O-N 3.48Å; V416-K419 PolarHBondContact O-N 3.36Å; V416-K420 PolarHBondContact O-N 2.85Å
417	Q	86.2	Confident	76.5	Confident	50 Å²	50	91.5 Å²	91.5	23%	0.234	44%	0.44	C	S	.	.	H	α-helix	trans	-67.2	-39.8	173.9	-73.8	-173.8	1.9	0	0	112.1	C376 F380 I413 L414 K419 K420 R421	C376-Q417 PolarHBondContact O-NE2 3.01Å; F380-Q417 HydrophobicContact CE1-CG 3.74Å; F380-Q417 HydrophobicContact CZ-CG 3.57Å; I413-Q417 HydrophobicContact CG2-CG 4.2Å; I413-Q417 WeakPolarHBondContact O-CB 3.48Å; I413-Q417 VanDerWaalsContact O-CG 3.28Å; I413-Q417 WeakPolarHBondContact O-CG 3.46Å; I413-Q417 PolarHBondContact O-N 3.02Å; L414-Q417 PolarHBondContact O-N 3.06Å; Q417-K419 VanDerWaalsContact C-N 3.3Å; Q417-K419 PolarHBondContact O-N 3.05Å; Q417-K420 WeakPolarHBondContact O-CA 3.04Å; Q417-K420 WeakPolarHBondContact O-CB 3.44Å; Q417-K420 PolarHBondContact O-N 3.43Å; Q417-R421 PolarHBondContact O-N 2.85Å
418	A	78.6	Confident	74.1	Confident	57 Å²	57	93.1 Å²	93.1	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-61	-40.9	176.7	0	0	0	0	0	111.2	L414 E415 K420 R421 T422	L414-A418 VanDerWaalsContact O-CB 3.28Å; L414-A418 WeakPolarHBondContact O-CB 3.28Å; L414-A418 PolarHBondContact O-N 3.23Å; E415-A418 PolarHBondContact O-N 3.4Å; A418-K420 PolarHBondContact O-N 2.97Å; A418-R421 PolarHBondContact O-N 3.34Å; A418-T422 PolarHBondContact O-N 3.21Å
419	K	76.3	Confident	73.1	Confident	114 Å²	114	97.6 Å²	97.6	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-59.1	-29.2	173.2	-70.9	171.1	-171.8	167.2	0	112.6	E391 E415 V416 Q417	E391-K419 IonicContact OE1-NZ 2.84Å; E391-K419 PolarHBondContact OE1-NZ 3.42Å; E415-K419 WeakPolarHBondContact O-CG 3.48Å; E415-K419 PolarHBondContact O-N 3.12Å; E415-K419 VanDerWaalsContact O-N 3.12Å; E415-K419 WeakPolarHBondContact OE1-CE 3.41Å; E415-K419 IonicContact OE1-NZ 3.72Å; E415-K419 PolarHBondContact OE1-NZ 3.4Å; V416-K419 PolarHBondContact O-N 3.36Å; Q417-K419 VanDerWaalsContact C-N 3.3Å; Q417-K419 PolarHBondContact O-N 3.05Å
420	K	66.4	Low	72.1	Confident	115 Å²	115	102.7 Å²	102.7	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-79.7	-29.7	174.9	-170.6	178.9	178.1	-179	0	112.8	V416 Q417 A418	V416-K420 PolarHBondContact O-N 2.85Å; Q417-K420 WeakPolarHBondContact O-CA 3.04Å; Q417-K420 WeakPolarHBondContact O-CB 3.44Å; Q417-K420 PolarHBondContact O-N 3.43Å; A418-K420 PolarHBondContact O-N 2.97Å
421	R	61.2	Low	70.9	Confident	155 Å²	155	104.7 Å²	104.7	59%	0.585	54%	0.538	S	S	*	.	H	α-helix	trans	-104.7	10.4	-167	-75.7	-167.8	178.4	-174.2	3.6	115.9	Q417 A418 N423 L424	Q417-R421 PolarHBondContact O-N 2.85Å; A418-R421 PolarHBondContact O-N 3.34Å; R421-N423 PolarHBondContact O-N 3Å; R421-L424 PolarHBondContact O-N 2.65Å
422	T	54.3	Low	69.6	Low	113 Å²	113	105.9 Å²	105.9	69%	0.693	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	0.3	-173.2	39.4	0	0	0	0	117.4	A418	A418-T422 PolarHBondContact O-N 3.21Å
423	N	48.5	Very low	68.2	Low	146 Å²	146	112.5 Å²	112.5	78%	0.781	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	1.9	179	-69.8	-23.1	0	0	0	117.3	R421	R421-N423 PolarHBondContact O-N 3Å
424	L	50.7	Low	66.6	Low	122 Å²	122	119.7 Å²	119.7	64%	0.639	61%	0.613	S	S	*	*			trans	-135.7	8.8	-164.8	-86.8	142.3	0	0	0	119.7	R421 Y426	R421-L424 PolarHBondContact O-N 2.65Å; L424-Y426 VanDerWaalsContact C-N 3.27Å; L424-Y426 PolarHBondContact O-N 3.34Å
425	N	53.1	Low	64.9	Low	136 Å²	136	120.6 Å²	120.6	73%	0.727	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	50.2	-178.4	-70.7	-1.5	0	0	0	114.4
426	Y	56.7	Low	63	Low	224 Å²	224	125.4 Å²	125.4	88%	0.878	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-1.5	171.9	-86.1	-80.4	0	0	0	114.1	L424	L424-Y426 VanDerWaalsContact C-N 3.27Å; L424-Y426 PolarHBondContact O-N 3.34Å
427	Y	55.3	Low	60.9	Low	206 Å²	206	134.8 Å²	134.8	81%	0.808	69%	0.691	S	S	*	*			trans	-96.3	126.9	177.8	-63.8	-74.8	0	0	0	109.9
428	A	42.8	Very low	58.6	Low	179 Å²	179	142.5 Å²	142.5	100%	1.479	73%	0.732	S	S	*	*			trans	-62.5	0	-167.8	0	0	0	0	0	115.2

Retrieved 428 of 428 residues in 129.1 ms (Link to these results)

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