A0A3Q0KQM3_SCHMA Loading...

Putative progesterone-induced-blocking factor

AlphaFold DB , UniProt , Accession A0A3Q0KQM3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 781 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	34.7	Very low	36	Very low	240 Å²	240	151.9 Å²	151.9	100%	1.182	83%	0.83	S	S	*	*				0	139.2	0	-91.4	-173	147.4	0	0	107.4
2	I	36.2	Very low	36.4	Very low	162 Å²	162	148.8 Å²	148.8	83%	0.831	82%	0.82	S	S	*	*			trans	87.3	77.7	-167.5	-46.4	169.5	0	0	0	112.2	T4	I2-T4 HydrophobicContact CG2-CG2 4.39Å
3	S	32.6	Very low	36.6	Very low	121 Å²	121	148.1 Å²	148.1	85%	0.846	81%	0.814	S	S	*	*			trans	-88.8	120.6	158.3	-58.9	0	0	0	0	106.9
4	T	36.6	Very low	37.1	Very low	121 Å²	121	141.7 Å²	141.7	74%	0.742	79%	0.79	S	S	*	*			trans	-97.3	114.4	168.8	42.2	0	0	0	0	108.9	I2 N6	I2-T4 HydrophobicContact CG2-CG2 4.39Å; T4-N6 PolarHBondContact O-N 2.88Å
5	E	35.4	Very low	37.7	Very low	177 Å²	177	141.3 Å²	141.3	83%	0.827	79%	0.786	S	S	*	*			trans	-60.5	112.6	172.6	-68.4	167.9	143.1	0	0	110.6	K7	E5-K7 PolarHBondContact O-N 2.87Å
6	N	35.7	Very low	38.1	Very low	146 Å²	146	140.5 Å²	140.5	78%	0.781	78%	0.78	S	S	*	*			trans	-79	103	162.4	-82	-14.4	0	0	0	108.2	T4 D8	T4-N6 PolarHBondContact O-N 2.88Å; N6-D8 PolarHBondContact O-N 2.86Å; N6-D8 VanDerWaalsContact O-N 3.13Å
7	K	36.3	Very low	38.6	Very low	185 Å²	185	135.7 Å²	135.7	80%	0.804	76%	0.758	S	S	*	*			trans	-71.2	91.2	164.1	-86.1	177.7	172.8	173.3	0	108.9	E5 S9	E5-K7 PolarHBondContact O-N 2.87Å; K7-S9 VanDerWaalsContact C-N 3.29Å; K7-S9 PolarHBondContact O-N 3.05Å
8	D	37	Very low	39.3	Very low	156 Å²	156	132.2 Å²	132.2	83%	0.834	74%	0.744	S	S	*	*			trans	-81.2	80.2	160.1	-77.6	-30.6	0	0	0	108.5	N6	N6-D8 PolarHBondContact O-N 2.86Å; N6-D8 VanDerWaalsContact O-N 3.13Å
9	S	34.9	Very low	39.8	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	74%	0.739	S	S	*	*			trans	-78.3	117	163.6	51.1	0	0	0	0	108.8	K7	K7-S9 VanDerWaalsContact C-N 3.29Å; K7-S9 PolarHBondContact O-N 3.05Å
10	S	38.8	Very low	40.4	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	73%	0.734	S	S	*	*			trans	-64.9	127.8	-175.6	39.2	0	0	0	0	114.6	T12	S10-T12 VanDerWaalsContact C-N 3.29Å; S10-T12 PolarHBondContact O-N 2.62Å
11	D	37.5	Very low	40.8	Very low	156 Å²	156	132.5 Å²	132.5	83%	0.834	73%	0.725	S	S	*	*			trans	-71	64.6	172.4	-78.7	-37.5	0	0	0	113.1
12	T	41.3	Very low	41.7	Very low	115 Å²	115	123.6 Å²	123.6	71%	0.706	69%	0.69	S	S	*	*			trans	-112.7	-0.6	171.3	50.9	0	0	0	0	114.7	S10	S10-T12 VanDerWaalsContact C-N 3.29Å; S10-T12 PolarHBondContact O-N 2.62Å
13	N	39.4	Very low	42.5	Very low	139 Å²	139	121.7 Å²	121.7	74%	0.743	68%	0.677	S	S	*	*	S	Bend	trans	-100.8	-0.6	176.6	-83.2	-22.1	0	0	0	115
14	A	42.5	Very low	43.5	Very low	59 Å²	59	120.6 Å²	120.6	49%	0.488	66%	0.661	S	S	.	*	H	α-helix	trans	-79.3	-35	-175.6	0	0	0	0	0	114	N16 S17 S18	A14-N16 PolarHBondContact O-N 2.74Å; A14-S17 PolarHBondContact O-N 3.37Å; A14-S18 PolarHBondContact O-N 2.76Å
15	D	46	Very low	44.3	Very low	136 Å²	136	118 Å²	118	73%	0.727	64%	0.642	S	S	*	*	H	α-helix	trans	-71	-32.2	-174	-85.9	-16.3	0	0	0	113.4	H19	D15-H19 PolarHBondContact O-N 3.46Å
16	N	44.5	Very low	45.3	Very low	128 Å²	128	114.2 Å²	114.2	68%	0.684	63%	0.628	S	S	*	*	H	α-helix	trans	-75.4	-27.2	176.6	-72	-13.7	0	0	0	112.7	A14 F20	A14-N16 PolarHBondContact O-N 2.74Å; N16-F20 PolarHBondContact O-N 3.34Å
17	S	46.7	Very low	46.1	Very low	59 Å²	59	111.3 Å²	111.3	41%	0.413	62%	0.619	S	S	.	*	H	α-helix	trans	-73.5	-36.9	175.4	-173.5	0	0	0	0	111.8	A14 H19 F20 Q21	A14-S17 PolarHBondContact O-N 3.37Å; S17-H19 PolarHBondContact O-N 3.49Å; S17-F20 PolarHBondContact O-N 2.79Å; S17-Q21 WeakPolarHBondContact O-CB 3.23Å; S17-Q21 WeakPolarHBondContact O-CG 3.28Å; S17-Q21 PolarHBondContact O-N 2.85Å
18	S	50.6	Low	46.8	Very low	72 Å²	72	107.9 Å²	107.9	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-58.4	-46.9	176.2	161.6	0	0	0	0	111.6	A14 Q21 A22	A14-S18 PolarHBondContact O-N 2.76Å; S18-Q21 PolarHBondContact O-N 3.07Å; S18-A22 WeakPolarHBondContact O-CB 3.38Å; S18-A22 PolarHBondContact O-N 2.99Å
19	H	50.5	Low	47.7	Very low	139 Å²	139	106.2 Å²	106.2	64%	0.644	60%	0.598	S	S	*	*	H	α-helix	trans	-70.3	-37.6	-176.5	-150.8	-5.3	0	0	0	112.6	D15 S17 Q23	D15-H19 PolarHBondContact O-N 3.46Å; S17-H19 PolarHBondContact O-N 3.49Å; H19-Q23 PolarHBondContact O-N 2.81Å
20	F	50.5	Low	48.4	Very low	147 Å²	147	106.3 Å²	106.3	65%	0.645	59%	0.591	S	S	*	*	H	α-helix	trans	-68.5	-38.3	175.1	-116.3	-85.9	0	0	0	112.3	N16 S17 Q23 I24	N16-F20 PolarHBondContact O-N 3.34Å; S17-F20 PolarHBondContact O-N 2.79Å; F20-Q23 PolarHBondContact O-N 2.91Å; F20-I24 WeakPolarHBondContact O-CG1 3.15Å; F20-I24 PolarHBondContact O-N 3.06Å; F20-I24 VanDerWaalsContact O-N 3.09Å
21	Q	49.2	Very low	48.6	Very low	118 Å²	118	103.9 Å²	103.9	55%	0.551	58%	0.581	S	S	*	*	H	α-helix	trans	-68.1	-39.4	176.7	-82.7	176.1	-29.2	0	0	112.2	S17 S18 Q23 I24 L25	S17-Q21 WeakPolarHBondContact O-CB 3.23Å; S17-Q21 WeakPolarHBondContact O-CG 3.28Å; S17-Q21 PolarHBondContact O-N 2.85Å; S18-Q21 PolarHBondContact O-N 3.07Å; Q21-Q23 VanDerWaalsContact C-N 3.31Å; Q21-Q23 PolarHBondContact O-N 3.32Å; Q21-I24 PolarHBondContact O-N 2.87Å; Q21-L25 WeakPolarHBondContact O-CB 3.12Å; Q21-L25 WeakPolarHBondContact O-CD1 3.06Å; Q21-L25 PolarHBondContact O-N 2.93Å
22	A	53.9	Low	48.7	Very low	52 Å²	52	104.1 Å²	104.1	43%	0.43	58%	0.582	S	S	.	*	H	α-helix	trans	-61.7	-40.1	174.8	0	0	0	0	0	111.8	S18 L25 D26	S18-A22 WeakPolarHBondContact O-CB 3.38Å; S18-A22 PolarHBondContact O-N 2.99Å; A22-L25 WeakPolarHBondContact O-CB 3.5Å; A22-L25 PolarHBondContact O-N 2.82Å; A22-D26 PolarHBondContact O-N 3.44Å
23	Q	52	Low	48.8	Very low	122 Å²	122	105.7 Å²	105.7	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-71.3	-35.8	-179.5	-151.5	169.5	30.9	0	0	112.8	H19 F20 Q21 L25 S27	H19-Q23 PolarHBondContact O-N 2.81Å; F20-Q23 PolarHBondContact O-N 2.91Å; Q21-Q23 VanDerWaalsContact C-N 3.31Å; Q21-Q23 PolarHBondContact O-N 3.32Å; Q23-L25 VanDerWaalsContact C-N 3.35Å; Q23-S27 WeakPolarHBondContact O-CB 3.07Å; Q23-S27 PolarHBondContact O-N 3.39Å; Q23-S27 VanDerWaalsContact O-N 3.15Å; Q23-S27 PolarHBondContact O-OG 3.22Å
24	I	55.3	Low	48.8	Very low	98 Å²	98	103.1 Å²	103.1	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-64.8	-41.1	170.7	-67.7	169.9	0	0	0	110.4	F20 Q21 S27 I28	F20-I24 WeakPolarHBondContact O-CG1 3.15Å; F20-I24 PolarHBondContact O-N 3.06Å; F20-I24 VanDerWaalsContact O-N 3.09Å; Q21-I24 PolarHBondContact O-N 2.87Å; I24-S27 PolarHBondContact O-N 2.98Å; I24-I28 HydrophobicContact CG2-CD1 3.98Å; I24-I28 WeakPolarHBondContact O-CG1 3.44Å; I24-I28 PolarHBondContact O-N 2.73Å
25	L	52.9	Low	48.5	Very low	67 Å²	67	108.5 Å²	108.5	35%	0.351	60%	0.598	S	S	.	*	H	α-helix	trans	-63.9	-42.3	178.6	-92.3	152.8	0	0	0	112.7	Q21 A22 Q23 I28 L29	Q21-L25 WeakPolarHBondContact O-CB 3.12Å; Q21-L25 WeakPolarHBondContact O-CD1 3.06Å; Q21-L25 PolarHBondContact O-N 2.93Å; A22-L25 WeakPolarHBondContact O-CB 3.5Å; A22-L25 PolarHBondContact O-N 2.82Å; Q23-L25 VanDerWaalsContact C-N 3.35Å; L25-I28 PolarHBondContact O-N 3.4Å; L25-L29 PolarHBondContact O-N 3.11Å; L25-L29 VanDerWaalsContact O-N 3.09Å
26	D	55.1	Low	48.3	Very low	98 Å²	98	106.8 Å²	106.8	52%	0.524	59%	0.593	S	S	.	*	H	α-helix	trans	-70.5	-34.8	-179.9	-139.1	38.9	0	0	0	111.8	A22 I28 L29 N30	A22-D26 PolarHBondContact O-N 3.44Å; D26-I28 VanDerWaalsContact C-N 3.29Å; D26-I28 PolarHBondContact O-N 2.87Å; D26-L29 PolarHBondContact O-N 2.85Å; D26-N30 PolarHBondContact O-N 2.63Å
27	S	52.8	Low	47.9	Very low	84 Å²	84	104.8 Å²	104.8	59%	0.587	60%	0.602	S	S	*	*	H	α-helix	trans	-65	-31.8	174.6	-55.6	0	0	0	0	112.7	Q23 I24	Q23-S27 WeakPolarHBondContact O-CB 3.07Å; Q23-S27 PolarHBondContact O-N 3.39Å; Q23-S27 VanDerWaalsContact O-N 3.15Å; Q23-S27 PolarHBondContact O-OG 3.22Å; I24-S27 PolarHBondContact O-N 2.98Å
28	I	52.4	Low	47.5	Very low	113 Å²	113	110 Å²	110	58%	0.579	62%	0.62	S	S	*	*	H	α-helix	trans	-81.1	-32.8	177.8	-65.5	167.8	0	0	0	111.1	I24 L25 D26	I24-I28 HydrophobicContact CG2-CD1 3.98Å; I24-I28 WeakPolarHBondContact O-CG1 3.44Å; I24-I28 PolarHBondContact O-N 2.73Å; L25-I28 PolarHBondContact O-N 3.4Å; D26-I28 VanDerWaalsContact C-N 3.29Å; D26-I28 PolarHBondContact O-N 2.87Å
29	L	54.8	Low	47	Very low	121 Å²	121	113.1 Å²	113.1	63%	0.634	63%	0.631	S	S	*	*	H	α-helix	trans	-71.2	-34.9	177.7	-89.6	157.3	0	0	0	112.8	L25 D26 G31	L25-L29 PolarHBondContact O-N 3.11Å; L25-L29 VanDerWaalsContact O-N 3.09Å; D26-L29 PolarHBondContact O-N 2.85Å; L29-G31 VanDerWaalsContact C-N 3.34Å
30	N	50.8	Low	46.6	Very low	110 Å²	110	113.6 Å²	113.6	59%	0.588	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	14.3	179.3	-65.9	-28.2	0	0	0	113.9	D26 D32	D26-N30 PolarHBondContact O-N 2.63Å; N30-D32 PolarHBondContact O-N 2.67Å
31	G	43	Very low	46.3	Very low	48 Å²	48	110.2 Å²	110.2	50%	0.495	63%	0.629	S	S	.	*			trans	-68.7	84.1	166.2	0	0	0	0	0	110.1	L29 I33	L29-G31 VanDerWaalsContact C-N 3.34Å; G31-I33 PolarHBondContact O-N 3.06Å
32	D	38.9	Very low	46.3	Very low	161 Å²	161	110.6 Å²	110.6	86%	0.861	64%	0.64	S	S	*	*			trans	-51.5	106.9	168.5	-76.8	-34.4	0	0	0	109.4	N30	N30-D32 PolarHBondContact O-N 2.67Å
33	I	44	Very low	46	Very low	149 Å²	149	113.7 Å²	113.7	76%	0.764	65%	0.645	S	S	*	*			trans	-121.6	102	164.8	-49.5	178.3	0	0	0	106.9	G31	G31-I33 PolarHBondContact O-N 3.06Å
34	S	38.7	Very low	46.2	Very low	85 Å²	85	111.4 Å²	111.4	59%	0.594	64%	0.64	S	S	*	*			trans	-45.5	140.3	175.2	52.7	0	0	0	0	113	T36	S34-T36 VanDerWaalsContact C-N 3.3Å; S34-T36 PolarHBondContact O-N 3.38Å
35	D	36.4	Very low	46.1	Very low	172 Å²	172	110.7 Å²	110.7	92%	0.92	64%	0.636	S	S	*	*			trans	-56.5	80.1	168	-160.3	16.2	0	0	0	111.1
36	T	40.7	Very low	46.7	Very low	100 Å²	100	111 Å²	111	61%	0.613	64%	0.644	S	S	*	*			trans	-116.6	104.9	171.9	52.5	0	0	0	0	108.8	S34 E38	S34-T36 VanDerWaalsContact C-N 3.3Å; S34-T36 PolarHBondContact O-N 3.38Å; T36-E38 PolarHBondContact O-N 2.89Å
37	G	36.1	Very low	47.2	Very low	85 Å²	85	112.4 Å²	112.4	88%	0.876	65%	0.645	S	S	*	*			trans	-69.5	68.5	179.8	0	0	0	0	0	113.8
38	E	38.6	Very low	48.3	Very low	168 Å²	168	110.3 Å²	110.3	79%	0.785	64%	0.637	S	S	*	*			trans	-120.5	119.9	170.1	-76.1	-176.1	159.6	0	0	109.6	T36	T36-E38 PolarHBondContact O-N 2.89Å
39	D	41	Very low	49.4	Very low	138 Å²	138	111.7 Å²	111.7	74%	0.738	64%	0.639	S	S	*	*			trans	36.8	110.5	162.8	-65.7	-24.3	0	0	0	117.1	T41	D39-T41 HydrophobicContact CB-CG2 4.32Å; D39-T41 PolarHBondContact O-N 3.37Å
40	L	41.3	Very low	50.4	Low	149 Å²	149	110.9 Å²	110.9	78%	0.78	64%	0.635	S	S	*	*			trans	-56.5	68.4	159.9	-80.6	144.6	0	0	0	110.3	I45	L40-I45 HydrophobicContact CD2-CD1 4.24Å; L40-I45 HydrophobicContact CD2-CG1 4Å
41	T	45.4	Very low	51.9	Low	76 Å²	76	111.6 Å²	111.6	47%	0.466	63%	0.633	S	S	.	*			trans	-65.3	139.3	163.7	52.9	0	0	0	0	106.4	D39 E43 T44	D39-T41 HydrophobicContact CB-CG2 4.32Å; D39-T41 PolarHBondContact O-N 3.37Å; T41-E43 PolarHBondContact O-N 2.75Å; T41-T44 PolarHBondContact O-N 3.45Å; T41-T44 PolarHBondContact O-OG1 3.31Å
42	T	49.2	Very low	53.7	Low	126 Å²	126	114.2 Å²	114.2	77%	0.773	63%	0.632	S	S	*	*	H	α-helix	trans	-47.5	-22.1	179.1	43.1	0	0	0	0	113.7	S46	T42-S46 WeakPolarHBondContact O-CB 3.46Å; T42-S46 PolarHBondContact O-N 3.22Å
43	E	47.3	Very low	55.7	Low	117 Å²	117	112.3 Å²	112.3	55%	0.547	62%	0.618	S	S	.	*	H	α-helix	trans	-66.2	-40.2	174.5	-156.3	-176.5	156.1	0	0	114.4	T41 S46 K47	T41-E43 PolarHBondContact O-N 2.75Å; E43-S46 WeakPolarHBondContact O-CB 3.46Å; E43-S46 PolarHBondContact O-N 3.15Å; E43-K47 PolarHBondContact O-N 3.46Å; E43-K47 IonicContact OE1-NZ 3.51Å
44	T	54.8	Low	57.5	Low	75 Å²	75	109.9 Å²	109.9	46%	0.46	61%	0.605	S	S	.	*	H	α-helix	trans	-69.8	-39.3	177.2	39	0	0	0	0	111.7	T41 S46 K47 G48	T41-T44 PolarHBondContact O-N 3.45Å; T41-T44 PolarHBondContact O-OG1 3.31Å; T44-S46 VanDerWaalsContact C-N 3.27Å; T44-S46 PolarHBondContact O-N 2.96Å; T44-K47 PolarHBondContact O-N 2.9Å; T44-G48 PolarHBondContact O-N 3.09Å
45	I	54.1	Low	59.7	Low	82 Å²	82	112.2 Å²	112.2	42%	0.421	60%	0.6	S	S	.	*	H	α-helix	trans	-61.6	-39.8	172	-61	174.8	0	0	0	109.9	L40 G48 K49	L40-I45 HydrophobicContact CD2-CD1 4.24Å; L40-I45 HydrophobicContact CD2-CG1 4Å; I45-G48 PolarHBondContact O-N 3.25Å; I45-K49 HydrophobicContact CG2-CD 4.44Å; I45-K49 WeakPolarHBondContact O-CB 3.34Å; I45-K49 WeakPolarHBondContact O-CG 3.47Å; I45-K49 PolarHBondContact O-N 3.42Å
46	S	64.7	Low	61.9	Low	74 Å²	74	107.8 Å²	107.8	52%	0.517	58%	0.575	S	S	.	*	H	α-helix	trans	-64.5	-47	176	-162.1	0	0	0	0	112	T42 E43 T44 G48 K49 L50	T42-S46 WeakPolarHBondContact O-CB 3.46Å; T42-S46 PolarHBondContact O-N 3.22Å; E43-S46 WeakPolarHBondContact O-CB 3.46Å; E43-S46 PolarHBondContact O-N 3.15Å; T44-S46 VanDerWaalsContact C-N 3.27Å; T44-S46 PolarHBondContact O-N 2.96Å; S46-G48 VanDerWaalsContact C-N 3.34Å; S46-G48 PolarHBondContact O-N 3.3Å; S46-K49 PolarHBondContact O-N 3.14Å; S46-L50 WeakPolarHBondContact O-CB 3.4Å; S46-L50 PolarHBondContact O-N 3.02Å
47	K	67.1	Low	64.1	Low	127 Å²	127	108.1 Å²	108.1	55%	0.552	57%	0.573	S	S	*	*	H	α-helix	trans	-60.9	-40.9	174.8	-76.9	179.9	-178.3	168.9	0	112.2	E43 T44 L50 K51	E43-K47 PolarHBondContact O-N 3.46Å; E43-K47 IonicContact OE1-NZ 3.51Å; T44-K47 PolarHBondContact O-N 2.9Å; K47-L50 PolarHBondContact O-N 2.84Å; K47-K51 WeakPolarHBondContact O-CB 3.47Å; K47-K51 PolarHBondContact O-N 3.35Å
48	G	75.2	Confident	66.5	Low	41 Å²	41	109.4 Å²	109.4	42%	0.423	56%	0.555	S	S	.	*	H	α-helix	trans	-63	-45.7	176	0	0	0	0	0	112.8	T44 I45 S46 K51 H52	T44-G48 PolarHBondContact O-N 3.09Å; I45-G48 PolarHBondContact O-N 3.25Å; S46-G48 VanDerWaalsContact C-N 3.34Å; S46-G48 PolarHBondContact O-N 3.3Å; G48-K51 PolarHBondContact O-N 3.24Å; G48-H52 PolarHBondContact O-N 2.88Å
49	K	75.3	Confident	68.7	Low	142 Å²	142	104.6 Å²	104.6	62%	0.617	54%	0.538	S	S	*	.	H	α-helix	trans	-62	-46.5	174.4	-77.1	-177.8	178.3	-177.7	0	111.7	I45 S46 K51 H52 E53	I45-K49 HydrophobicContact CG2-CD 4.44Å; I45-K49 WeakPolarHBondContact O-CB 3.34Å; I45-K49 WeakPolarHBondContact O-CG 3.47Å; I45-K49 PolarHBondContact O-N 3.42Å; S46-K49 PolarHBondContact O-N 3.14Å; K49-K51 PolarHBondContact O-N 3.44Å; K49-H52 WeakPolarHBondContact O-CB 3.32Å; K49-H52 PolarHBondContact O-N 3.31Å; K49-H52 VanDerWaalsContact O-N 3.14Å; K49-E53 PolarHBondContact O-N 3.43Å
50	L	75.9	Confident	71	Confident	103 Å²	103	105.3 Å²	105.3	54%	0.539	53%	0.53	S	S	.	.	H	α-helix	trans	-61.4	-42.6	178.1	-164.7	75.4	0	0	0	111.7	S46 K47 H52 E53 M54	S46-L50 WeakPolarHBondContact O-CB 3.4Å; S46-L50 PolarHBondContact O-N 3.02Å; K47-L50 PolarHBondContact O-N 2.84Å; L50-H52 VanDerWaalsContact C-N 3.31Å; L50-H52 PolarHBondContact O-N 2.95Å; L50-E53 PolarHBondContact O-N 3.45Å; L50-M54 WeakPolarHBondContact O-CB 3.4Å; L50-M54 PolarHBondContact O-N 3.24Å
51	K	82.9	Confident	73.3	Confident	126 Å²	126	105.5 Å²	105.5	55%	0.548	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-33	175.6	-173.6	173.4	-176.6	172.5	0	112.6	K47 G48 K49 R55	K47-K51 WeakPolarHBondContact O-CB 3.47Å; K47-K51 PolarHBondContact O-N 3.35Å; G48-K51 PolarHBondContact O-N 3.24Å; K49-K51 PolarHBondContact O-N 3.44Å; K51-R55 PolarHBondContact O-N 3.44Å; K51-R55 PolarHBondContact O-NE 3.03Å
52	H	79.8	Confident	75.4	Confident	102 Å²	102	107.2 Å²	107.2	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-71.1	-47.2	173.2	-179.3	70.4	0	0	0	111.1	G48 K49 L50 M54 R55 M56	G48-H52 PolarHBondContact O-N 2.88Å; K49-H52 WeakPolarHBondContact O-CB 3.32Å; K49-H52 PolarHBondContact O-N 3.31Å; K49-H52 VanDerWaalsContact O-N 3.14Å; L50-H52 VanDerWaalsContact C-N 3.31Å; L50-H52 PolarHBondContact O-N 2.95Å; H52-M54 VanDerWaalsContact C-N 3.34Å; H52-M54 PolarHBondContact O-N 2.87Å; H52-R55 PolarHBondContact O-N 2.76Å; H52-R55 VanDerWaalsContact O-N 3.17Å; H52-M56 WeakPolarHBondContact O-CG 3.46Å; H52-M56 PolarHBondContact O-N 2.71Å
53	E	81.7	Confident	77.3	Confident	122 Å²	122	106 Å²	106	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-59.3	-42.2	176	-76.5	-171.1	165.8	0	0	112.2	K49 L50 R55 M56 L57	K49-E53 PolarHBondContact O-N 3.43Å; L50-E53 PolarHBondContact O-N 3.45Å; E53-R55 PolarHBondContact O-N 3.44Å; E53-M56 PolarHBondContact O-N 3Å; E53-L57 WeakPolarHBondContact O-CB 3.34Å; E53-L57 WeakPolarHBondContact O-CG 3.49Å; E53-L57 PolarHBondContact O-N 3.21Å
54	M	81.5	Confident	79.3	Confident	98 Å²	98	105.6 Å²	105.6	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-59.5	-44.8	173.7	-82.7	-176.1	63.9	0	0	112.4	L50 H52 M56 L57 Q58	L50-M54 WeakPolarHBondContact O-CB 3.4Å; L50-M54 PolarHBondContact O-N 3.24Å; H52-M54 VanDerWaalsContact C-N 3.34Å; H52-M54 PolarHBondContact O-N 2.87Å; M54-M56 VanDerWaalsContact C-N 3.33Å; M54-M56 PolarHBondContact O-N 2.93Å; M54-L57 PolarHBondContact O-N 3.27Å; M54-Q58 WeakPolarHBondContact O-CB 3.3Å; M54-Q58 PolarHBondContact O-N 3.48Å
55	R	84.3	Confident	81	Confident	134 Å²	134	104.7 Å²	104.7	51%	0.506	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-37.9	175.5	-83	-177.1	-77.8	160.6	-7.8	112.2	K51 H52 E53 Q58 T59	K51-R55 PolarHBondContact O-N 3.44Å; K51-R55 PolarHBondContact O-NE 3.03Å; H52-R55 PolarHBondContact O-N 2.76Å; H52-R55 VanDerWaalsContact O-N 3.17Å; E53-R55 PolarHBondContact O-N 3.44Å; R55-Q58 PolarHBondContact O-N 2.76Å; R55-T59 WeakPolarHBondContact O-CG2 3.49Å; R55-T59 PolarHBondContact O-N 3.46Å; R55-T59 PolarHBondContact O-OG1 2.9Å; R55-T59 VanDerWaalsContact O-OG1 3.12Å
56	M	83.4	Confident	82.6	Confident	79 Å²	79	104.2 Å²	104.2	39%	0.389	52%	0.519	S	S	.	.	H	α-helix	trans	-67.8	-39	175.8	-69.6	-57.4	-61.5	0	0	112.1	H52 E53 M54 T59 R60	H52-M56 WeakPolarHBondContact O-CG 3.46Å; H52-M56 PolarHBondContact O-N 2.71Å; E53-M56 PolarHBondContact O-N 3Å; M54-M56 VanDerWaalsContact C-N 3.33Å; M54-M56 PolarHBondContact O-N 2.93Å; M56-T59 WeakPolarHBondContact CA-OG1 3.47Å; M56-T59 PolarHBondContact O-OG1 2.92Å; M56-R60 WeakPolarHBondContact O-CB 3.43Å; M56-R60 VanDerWaalsContact O-CG 3.3Å; M56-R60 WeakPolarHBondContact O-CG 3.4Å; M56-R60 PolarHBondContact O-N 3.18Å
57	L	86.6	Confident	83.7	Confident	107 Å²	107	103 Å²	103	56%	0.56	51%	0.513	S	S	*	.	H	α-helix	trans	-66.1	-40.3	173.7	-76.7	168.3	0	0	0	111.4	E53 M54 R60 F61	E53-L57 WeakPolarHBondContact O-CB 3.34Å; E53-L57 WeakPolarHBondContact O-CG 3.49Å; E53-L57 PolarHBondContact O-N 3.21Å; M54-L57 PolarHBondContact O-N 3.27Å; L57-R60 PolarHBondContact O-N 3.24Å; L57-F61 WeakPolarHBondContact O-CB 3.28Å; L57-F61 PolarHBondContact O-N 3.36Å
58	Q	86.5	Confident	84.7	Confident	111 Å²	111	102.7 Å²	102.7	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-42.9	178.1	-167.1	174.9	14.7	0	0	112.1	M54 R55 F61 L62	M54-Q58 WeakPolarHBondContact O-CB 3.3Å; M54-Q58 PolarHBondContact O-N 3.48Å; R55-Q58 PolarHBondContact O-N 2.76Å; Q58-F61 PolarHBondContact O-N 3.47Å; Q58-L62 WeakPolarHBondContact O-CB 3.37Å; Q58-L62 PolarHBondContact O-N 3.45Å
59	T	84.7	Confident	85.4	Confident	68 Å²	68	106.3 Å²	106.3	42%	0.417	52%	0.523	S	S	.	.	H	α-helix	trans	-66.3	-38.9	175.2	52.3	0	0	0	0	111.9	R55 M56 N63	R55-T59 WeakPolarHBondContact O-CG2 3.49Å; R55-T59 PolarHBondContact O-N 3.46Å; R55-T59 PolarHBondContact O-OG1 2.9Å; R55-T59 VanDerWaalsContact O-OG1 3.12Å; M56-T59 WeakPolarHBondContact CA-OG1 3.47Å; M56-T59 PolarHBondContact O-OG1 2.92Å; T59-N63 WeakPolarHBondContact O-CB 3.48Å; T59-N63 PolarHBondContact O-N 3.17Å; T59-N63 PolarHBondContact O-ND2 3.28Å; T59-N63 PolarHBondContact O-OD1 2.89Å
60	R	88.5	Confident	86	Confident	152 Å²	152	104.6 Å²	104.6	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-48.5	171.6	-76.1	177.2	-174.2	170.9	3.2	111.9	M56 L57 L62 N63 D64	M56-R60 WeakPolarHBondContact O-CB 3.43Å; M56-R60 VanDerWaalsContact O-CG 3.3Å; M56-R60 WeakPolarHBondContact O-CG 3.4Å; M56-R60 PolarHBondContact O-N 3.18Å; L57-R60 PolarHBondContact O-N 3.24Å; R60-L62 VanDerWaalsContact C-N 3.34Å; R60-L62 PolarHBondContact O-N 3.27Å; R60-N63 PolarHBondContact O-N 3.47Å; R60-D64 WeakPolarHBondContact O-CB 3.05Å; R60-D64 VanDerWaalsContact O-CG 3.22Å; R60-D64 PolarHBondContact O-N 3.09Å
61	F	90.2	Very high	86.7	Confident	153 Å²	153	103.5 Å²	103.5	67%	0.671	52%	0.518	S	S	*	.	H	α-helix	trans	-62.6	-40.9	-179.5	-167.4	-91.6	0	0	0	112.2	L57 Q58 D64 S65	L57-F61 WeakPolarHBondContact O-CB 3.28Å; L57-F61 PolarHBondContact O-N 3.36Å; Q58-F61 PolarHBondContact O-N 3.47Å; F61-D64 PolarHBondContact O-N 3.43Å; F61-S65 VanDerWaalsContact O-CB 3.25Å; F61-S65 WeakPolarHBondContact O-CB 3.33Å; F61-S65 PolarHBondContact O-N 3.39Å
62	L	89.4	Confident	87.1	Confident	113 Å²	113	104.5 Å²	104.5	59%	0.592	52%	0.523	S	S	*	.	H	α-helix	trans	-64.2	-44.5	174.9	-169.2	69.3	0	0	0	111.1	Q58 R60 S65 T66	Q58-L62 WeakPolarHBondContact O-CB 3.37Å; Q58-L62 PolarHBondContact O-N 3.45Å; R60-L62 VanDerWaalsContact C-N 3.34Å; R60-L62 PolarHBondContact O-N 3.27Å; L62-S65 PolarHBondContact O-N 2.98Å; L62-T66 WeakPolarHBondContact O-CG2 3.37Å; L62-T66 PolarHBondContact O-N 2.98Å; L62-T66 PolarHBondContact O-OG1 3.42Å
63	N	88.7	Confident	87.6	Confident	99 Å²	99	103 Å²	103	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-61.6	-46.8	176.4	-72.2	-13.3	0	0	0	111.6	T59 R60 S65 T66 A67	T59-N63 WeakPolarHBondContact O-CB 3.48Å; T59-N63 PolarHBondContact O-N 3.17Å; T59-N63 PolarHBondContact O-ND2 3.28Å; T59-N63 PolarHBondContact O-OD1 2.89Å; R60-N63 PolarHBondContact O-N 3.47Å; N63-S65 VanDerWaalsContact C-N 3.32Å; N63-S65 PolarHBondContact O-N 3.32Å; N63-T66 WeakPolarHBondContact CA-OG1 3.38Å; N63-T66 PolarHBondContact O-N 3.46Å; N63-T66 PolarHBondContact O-OG1 2.83Å; N63-A67 WeakPolarHBondContact O-CB 3.48Å; N63-A67 PolarHBondContact O-N 3.21Å
64	D	90.8	Very high	88	Confident	109 Å²	109	102.6 Å²	102.6	58%	0.583	53%	0.525	S	S	*	.	H	α-helix	trans	-63.2	-39.4	178.2	-67	-16.6	0	0	0	111.2	R60 F61 A67 L68	R60-D64 WeakPolarHBondContact O-CB 3.05Å; R60-D64 VanDerWaalsContact O-CG 3.22Å; R60-D64 PolarHBondContact O-N 3.09Å; F61-D64 PolarHBondContact O-N 3.43Å; D64-A67 PolarHBondContact O-N 3.32Å; D64-L68 WeakPolarHBondContact O-CB 3.39Å; D64-L68 PolarHBondContact O-N 2.98Å
65	S	89.6	Confident	88.5	Confident	57 Å²	57	101.8 Å²	101.8	40%	0.399	53%	0.529	S	S	.	.	H	α-helix	trans	-63.1	-44.8	174.8	-172.8	0	0	0	0	112	F61 L62 N63 L68 Q69	F61-S65 VanDerWaalsContact O-CB 3.25Å; F61-S65 WeakPolarHBondContact O-CB 3.33Å; F61-S65 PolarHBondContact O-N 3.39Å; L62-S65 PolarHBondContact O-N 2.98Å; N63-S65 VanDerWaalsContact C-N 3.32Å; N63-S65 PolarHBondContact O-N 3.32Å; S65-L68 PolarHBondContact O-N 3.12Å; S65-Q69 WeakPolarHBondContact O-CG 3.44Å; S65-Q69 PolarHBondContact O-N 3.01Å
66	T	88.1	Confident	88.8	Confident	72 Å²	72	101.9 Å²	101.9	44%	0.442	53%	0.533	S	S	.	.	H	α-helix	trans	-66.7	-38.6	175.6	59	0	0	0	0	112.5	L62 N63 L68 Q69 N70	L62-T66 WeakPolarHBondContact O-CG2 3.37Å; L62-T66 PolarHBondContact O-N 2.98Å; L62-T66 PolarHBondContact O-OG1 3.42Å; N63-T66 WeakPolarHBondContact CA-OG1 3.38Å; N63-T66 PolarHBondContact O-N 3.46Å; N63-T66 PolarHBondContact O-OG1 2.83Å; T66-L68 VanDerWaalsContact C-N 3.35Å; T66-Q69 PolarHBondContact O-N 2.91Å; T66-N70 WeakPolarHBondContact O-CB 3.48Å; T66-N70 VanDerWaalsContact O-CG 3.24Å; T66-N70 PolarHBondContact O-N 3.49Å; T66-N70 PolarHBondContact O-ND2 2.85Å
67	A	87.8	Confident	89.2	Confident	48 Å²	48	100.8 Å²	100.8	40%	0.397	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-43.2	175.2	0	0	0	0	0	111	N63 D64 N70 T71	N63-A67 WeakPolarHBondContact O-CB 3.48Å; N63-A67 PolarHBondContact O-N 3.21Å; D64-A67 PolarHBondContact O-N 3.32Å; A67-N70 PolarHBondContact O-N 3.3Å; A67-T71 WeakPolarHBondContact O-CG2 3.47Å; A67-T71 PolarHBondContact O-N 2.87Å; A67-T71 PolarHBondContact O-OG1 3.22Å
68	L	88.5	Confident	89.5	Confident	121 Å²	121	101.4 Å²	101.4	63%	0.634	53%	0.531	S	S	*	.	H	α-helix	trans	-66.1	-38	177.3	-173.1	64.4	0	0	0	112.8	D64 S65 T66 T71 K72	D64-L68 WeakPolarHBondContact O-CB 3.39Å; D64-L68 PolarHBondContact O-N 2.98Å; S65-L68 PolarHBondContact O-N 3.12Å; T66-L68 VanDerWaalsContact C-N 3.35Å; L68-T71 WeakPolarHBondContact CA-OG1 3.48Å; L68-T71 PolarHBondContact O-OG1 2.79Å; L68-K72 WeakPolarHBondContact O-CB 3.39Å; L68-K72 PolarHBondContact O-N 3.27Å
69	Q	88.1	Confident	89.8	Confident	116 Å²	116	102.3 Å²	102.3	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-65.5	-41.7	173.6	-76.4	-67.3	-6	0	0	111.8	S65 T66 K72 S73	S65-Q69 WeakPolarHBondContact O-CG 3.44Å; S65-Q69 PolarHBondContact O-N 3.01Å; T66-Q69 PolarHBondContact O-N 2.91Å; Q69-K72 PolarHBondContact O-N 3.48Å; Q69-S73 PolarHBondContact O-N 3.43Å; Q69-S73 PolarHBondContact O-OG 2.84Å
70	N	89.6	Confident	90.2	Very high	106 Å²	106	103.5 Å²	103.5	57%	0.567	54%	0.539	S	S	*	.	H	α-helix	trans	-63.2	-45.1	176.2	-71.4	-18.3	0	0	0	111.4	T66 A67 K72 S73 L74	T66-N70 WeakPolarHBondContact O-CB 3.48Å; T66-N70 VanDerWaalsContact O-CG 3.24Å; T66-N70 PolarHBondContact O-N 3.49Å; T66-N70 PolarHBondContact O-ND2 2.85Å; A67-N70 PolarHBondContact O-N 3.3Å; N70-K72 VanDerWaalsContact C-N 3.35Å; N70-K72 PolarHBondContact O-N 3.19Å; N70-S73 PolarHBondContact O-N 3.33Å; N70-S73 PolarHBondContact O-OG 3.49Å; N70-L74 WeakPolarHBondContact O-CB 3.5Å; N70-L74 PolarHBondContact O-N 2.96Å
71	T	90.1	Very high	90.5	Very high	80 Å²	80	100.6 Å²	100.6	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-38.3	177	57.3	0	0	0	0	112.2	A67 L68 L74 S75	A67-T71 WeakPolarHBondContact O-CG2 3.47Å; A67-T71 PolarHBondContact O-N 2.87Å; A67-T71 PolarHBondContact O-OG1 3.22Å; L68-T71 WeakPolarHBondContact CA-OG1 3.48Å; L68-T71 PolarHBondContact O-OG1 2.79Å; T71-L74 PolarHBondContact O-N 3.49Å; T71-S75 WeakPolarHBondContact O-CB 3.49Å; T71-S75 PolarHBondContact O-N 3.33Å
72	K	91.9	Very high	90.7	Very high	147 Å²	147	96.9 Å²	96.9	64%	0.639	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-43	174	-171.3	173.8	-176.3	174	0	112	L68 Q69 N70 K76	L68-K72 WeakPolarHBondContact O-CB 3.39Å; L68-K72 PolarHBondContact O-N 3.27Å; Q69-K72 PolarHBondContact O-N 3.48Å; N70-K72 VanDerWaalsContact C-N 3.35Å; N70-K72 PolarHBondContact O-N 3.19Å; K72-K76 PolarHBondContact O-N 2.98Å; K72-K76 VanDerWaalsContact O-N 3.07Å
73	S	90.1	Very high	90.9	Very high	71 Å²	71	95.8 Å²	95.8	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176.8	72.1	0	0	0	0	112.6	Q69 N70 K76 A77	Q69-S73 PolarHBondContact O-N 3.43Å; Q69-S73 PolarHBondContact O-OG 2.84Å; N70-S73 PolarHBondContact O-N 3.33Å; N70-S73 PolarHBondContact O-OG 3.49Å; S73-K76 PolarHBondContact O-N 3.32Å; S73-A77 PolarHBondContact O-N 2.84Å
74	L	90.4	Very high	91.1	Very high	114 Å²	114	96.1 Å²	96.1	60%	0.597	51%	0.512	S	S	*	.	H	α-helix	trans	-67.2	-42.9	177	-174.4	67.1	0	0	0	111.8	N70 T71 K76 A77 R78	N70-L74 WeakPolarHBondContact O-CB 3.5Å; N70-L74 PolarHBondContact O-N 2.96Å; T71-L74 PolarHBondContact O-N 3.49Å; L74-K76 VanDerWaalsContact C-N 3.31Å; L74-K76 PolarHBondContact O-N 2.74Å; L74-A77 PolarHBondContact O-N 2.79Å; L74-R78 WeakPolarHBondContact O-CB 3.37Å; L74-R78 PolarHBondContact O-N 3.28Å
75	S	90.3	Very high	91.4	Very high	80 Å²	80	95.1 Å²	95.1	56%	0.559	50%	0.504	S	S	*	.	H	α-helix	trans	-59.8	-42.4	175.3	-173.6	0	0	0	0	111.4	T71 R78 E79	T71-S75 WeakPolarHBondContact O-CB 3.49Å; T71-S75 PolarHBondContact O-N 3.33Å; S75-R78 PolarHBondContact O-N 2.84Å; S75-E79 PolarHBondContact O-N 3.22Å
76	K	92.4	Very high	91.6	Very high	136 Å²	136	97.8 Å²	97.8	59%	0.591	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-43.6	177.5	-172.1	169.9	-176	172.3	0	112.1	K72 S73 L74 R78 E79 D80	K72-K76 PolarHBondContact O-N 2.98Å; K72-K76 VanDerWaalsContact O-N 3.07Å; S73-K76 PolarHBondContact O-N 3.32Å; L74-K76 VanDerWaalsContact C-N 3.31Å; L74-K76 PolarHBondContact O-N 2.74Å; K76-R78 PolarHBondContact O-N 3.39Å; K76-E79 PolarHBondContact O-N 3.49Å; K76-D80 PolarHBondContact O-N 3.48Å
77	A	91.8	Very high	91.9	Very high	56 Å²	56	99.4 Å²	99.4	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-37.4	174.9	0	0	0	0	0	112.1	S73 L74 E81	S73-A77 PolarHBondContact O-N 2.84Å; L74-A77 PolarHBondContact O-N 2.79Å; A77-E81 WeakPolarHBondContact O-CB 3.37Å; A77-E81 PolarHBondContact O-N 2.88Å
78	R	92.2	Very high	92.2	Very high	120 Å²	120	99.9 Å²	99.9	45%	0.453	51%	0.511	S	S	.	.	H	α-helix	trans	-68.5	-40	175.7	-177.1	56.7	175.7	174.6	1.1	112.5	L74 S75 K76 E81 L82	L74-R78 WeakPolarHBondContact O-CB 3.37Å; L74-R78 PolarHBondContact O-N 3.28Å; S75-R78 PolarHBondContact O-N 2.84Å; K76-R78 PolarHBondContact O-N 3.39Å; R78-E81 IonicContact CZ-OE2 3.49Å; R78-E81 IonicContact NH1-OE1 2.7Å; R78-E81 PolarHBondContact NH1-OE1 2.91Å; R78-E81 VanDerWaalsContact NH1-OE1 3.16Å; R78-E81 IonicContact NH1-OE2 3.55Å; R78-E81 PolarHBondContact NH1-OE2 3.44Å; R78-E81 PolarHBondContact O-N 3.2Å; R78-L82 HydrophobicContact CG-CD1 4.46Å; R78-L82 WeakPolarHBondContact O-CG 3.39Å; R78-L82 PolarHBondContact O-N 3.44Å
79	E	93	Very high	92.5	Very high	131 Å²	131	98.8 Å²	98.8	61%	0.612	51%	0.505	S	S	*	.	H	α-helix	trans	-62.6	-44.5	175.3	-169.6	178.7	179.2	0	0	111.2	S75 K76 E81 L82 L83	S75-E79 PolarHBondContact O-N 3.22Å; K76-E79 PolarHBondContact O-N 3.49Å; E79-E81 VanDerWaalsContact C-N 3.34Å; E79-E81 PolarHBondContact O-N 3.49Å; E79-L82 PolarHBondContact O-N 2.79Å; E79-L83 WeakPolarHBondContact O-CB 3.43Å; E79-L83 PolarHBondContact O-N 3.37Å
80	D	93.1	Very high	92.9	Very high	93 Å²	93	96.1 Å²	96.1	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-61.8	-40.9	176.1	-71.3	-28.6	0	0	0	111.8	K76 L83 E84	K76-D80 PolarHBondContact O-N 3.48Å; D80-L83 PolarHBondContact O-N 3.42Å; D80-E84 PolarHBondContact O-N 3.43Å; D80-E84 VanDerWaalsContact O-N 3.08Å
81	E	93.9	Very high	93.1	Very high	91 Å²	91	96.7 Å²	96.7	43%	0.425	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-46.3	175.3	-169.4	-162.6	160.6	0	0	111.9	A77 R78 E79 L83 E84 Q85	A77-E81 WeakPolarHBondContact O-CB 3.37Å; A77-E81 PolarHBondContact O-N 2.88Å; R78-E81 IonicContact CZ-OE2 3.49Å; R78-E81 IonicContact NH1-OE1 2.7Å; R78-E81 PolarHBondContact NH1-OE1 2.91Å; R78-E81 VanDerWaalsContact NH1-OE1 3.16Å; R78-E81 IonicContact NH1-OE2 3.55Å; R78-E81 PolarHBondContact NH1-OE2 3.44Å; R78-E81 PolarHBondContact O-N 3.2Å; E79-E81 VanDerWaalsContact C-N 3.34Å; E79-E81 PolarHBondContact O-N 3.49Å; E81-L83 VanDerWaalsContact C-N 3.32Å; E81-L83 PolarHBondContact O-N 3.49Å; E81-E84 PolarHBondContact O-N 3.5Å; E81-Q85 WeakPolarHBondContact O-CG 3.22Å; E81-Q85 PolarHBondContact O-N 3.42Å; E81-Q85 PolarHBondContact OE1-NE2 2.89Å
82	L	95.1	Very high	93.2	Very high	74 Å²	74	100.4 Å²	100.4	39%	0.387	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-39.4	177.2	-73.7	174.2	0	0	0	111.5	R78 E79 E84 Q85 I86	R78-L82 HydrophobicContact CG-CD1 4.46Å; R78-L82 WeakPolarHBondContact O-CG 3.39Å; R78-L82 PolarHBondContact O-N 3.44Å; E79-L82 PolarHBondContact O-N 2.79Å; L82-E84 VanDerWaalsContact C-N 3.3Å; L82-E84 PolarHBondContact O-N 2.95Å; L82-Q85 PolarHBondContact O-N 3.48Å; L82-I86 VanDerWaalsContact O-CG1 3.28Å; L82-I86 WeakPolarHBondContact O-CG1 3.43Å; L82-I86 PolarHBondContact O-N 3.38Å
83	L	93.1	Very high	93.3	Very high	90 Å²	90	98.9 Å²	98.9	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-61	-40.7	176.5	-162.3	81.4	0	0	0	111.4	E79 D80 E81 I86 K87	E79-L83 WeakPolarHBondContact O-CB 3.43Å; E79-L83 PolarHBondContact O-N 3.37Å; D80-L83 PolarHBondContact O-N 3.42Å; E81-L83 VanDerWaalsContact C-N 3.32Å; E81-L83 PolarHBondContact O-N 3.49Å; L83-I86 PolarHBondContact O-N 3.43Å; L83-K87 WeakPolarHBondContact O-CG 3.48Å; L83-K87 PolarHBondContact O-N 3.29Å
84	E	93.9	Very high	93.5	Very high	107 Å²	107	100.3 Å²	100.3	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-69.2	-38	177.6	-167.4	58.1	-155.2	0	0	112.5	D80 E81 L82 K87 T88	D80-E84 PolarHBondContact O-N 3.43Å; D80-E84 VanDerWaalsContact O-N 3.08Å; E81-E84 PolarHBondContact O-N 3.5Å; L82-E84 VanDerWaalsContact C-N 3.3Å; L82-E84 PolarHBondContact O-N 2.95Å; E84-K87 PolarHBondContact O-N 3.38Å; E84-K87 IonicContact OE2-NZ 3.06Å; E84-T88 WeakPolarHBondContact O-CB 3.44Å; E84-T88 PolarHBondContact O-N 3.19Å; E84-T88 PolarHBondContact O-OG1 2.92Å
85	Q	96.4	Very high	93.6	Very high	88 Å²	88	99.2 Å²	99.2	41%	0.411	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-43.5	172.6	-69.2	-178.5	33.2	0	0	111.5	E81 L82 K87 T88 L89	E81-Q85 WeakPolarHBondContact O-CG 3.22Å; E81-Q85 PolarHBondContact O-N 3.42Å; E81-Q85 PolarHBondContact OE1-NE2 2.89Å; L82-Q85 PolarHBondContact O-N 3.48Å; Q85-K87 PolarHBondContact O-N 2.77Å; Q85-T88 PolarHBondContact O-N 3.2Å; Q85-L89 WeakPolarHBondContact O-CB 3.43Å; Q85-L89 WeakPolarHBondContact O-CG 3.16Å; Q85-L89 PolarHBondContact O-N 3.03Å
86	I	93.5	Very high	93.7	Very high	113 Å²	113	98 Å²	98	58%	0.579	50%	0.495	S	S	*	.	H	α-helix	trans	-61.4	-44.8	176.4	-70.7	166.6	0	0	0	110.7	L82 L83 T88 L89 S90	L82-I86 VanDerWaalsContact O-CG1 3.28Å; L82-I86 WeakPolarHBondContact O-CG1 3.43Å; L82-I86 PolarHBondContact O-N 3.38Å; L83-I86 PolarHBondContact O-N 3.43Å; I86-T88 PolarHBondContact O-N 2.97Å; I86-L89 PolarHBondContact O-N 2.82Å; I86-S90 WeakPolarHBondContact O-CB 3.39Å; I86-S90 PolarHBondContact O-N 3.37Å
87	K	95.4	Very high	93.7	Very high	106 Å²	106	94.8 Å²	94.8	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-59.8	-46.1	174.8	-73.6	173.1	-170	166.9	0	111.7	L83 E84 Q85 L89 S90 I91	L83-K87 WeakPolarHBondContact O-CG 3.48Å; L83-K87 PolarHBondContact O-N 3.29Å; E84-K87 PolarHBondContact O-N 3.38Å; E84-K87 IonicContact OE2-NZ 3.06Å; Q85-K87 PolarHBondContact O-N 2.77Å; K87-L89 PolarHBondContact O-N 2.92Å; K87-S90 WeakPolarHBondContact O-CB 3.42Å; K87-S90 PolarHBondContact O-N 3.34Å; K87-I91 WeakPolarHBondContact O-CG1 3.25Å; K87-I91 PolarHBondContact O-N 3.5Å
88	T	93.7	Very high	93.8	Very high	57 Å²	57	94.4 Å²	94.4	35%	0.35	48%	0.484	S	S	.	.	H	α-helix	trans	-60.3	-44.8	178.2	-61.9	0	0	0	0	111.6	E84 Q85 I86 I91 R92	E84-T88 WeakPolarHBondContact O-CB 3.44Å; E84-T88 PolarHBondContact O-N 3.19Å; E84-T88 PolarHBondContact O-OG1 2.92Å; Q85-T88 PolarHBondContact O-N 3.2Å; I86-T88 PolarHBondContact O-N 2.97Å; T88-I91 PolarHBondContact O-N 3.46Å; T88-R92 WeakPolarHBondContact O-CB 3.37Å; T88-R92 PolarHBondContact O-N 2.82Å
89	L	94.8	Very high	93.8	Very high	99 Å²	99	96.6 Å²	96.6	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-39.2	176.9	-72.5	173.5	0	0	0	111.9	Q85 I86 K87 R92 L93	Q85-L89 WeakPolarHBondContact O-CB 3.43Å; Q85-L89 WeakPolarHBondContact O-CG 3.16Å; Q85-L89 PolarHBondContact O-N 3.03Å; I86-L89 PolarHBondContact O-N 2.82Å; K87-L89 PolarHBondContact O-N 2.92Å; L89-R92 PolarHBondContact O-N 3.42Å; L89-L93 WeakPolarHBondContact O-CB 3.38Å; L89-L93 PolarHBondContact O-N 2.89Å
90	S	95.6	Very high	93.7	Very high	59 Å²	59	97.6 Å²	97.6	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-61.2	-45.1	175.6	-178.3	0	0	0	0	112	I86 K87 R92 L93 N94	I86-S90 WeakPolarHBondContact O-CB 3.39Å; I86-S90 PolarHBondContact O-N 3.37Å; K87-S90 WeakPolarHBondContact O-CB 3.42Å; K87-S90 PolarHBondContact O-N 3.34Å; S90-R92 VanDerWaalsContact C-N 3.34Å; S90-R92 PolarHBondContact O-N 3.33Å; S90-L93 PolarHBondContact O-N 2.77Å; S90-N94 VanDerWaalsContact O-CG 3.24Å; S90-N94 PolarHBondContact O-N 3.01Å; S90-N94 PolarHBondContact O-ND2 3.4Å
91	I	94.5	Very high	93.7	Very high	118 Å²	118	97.6 Å²	97.6	61%	0.605	49%	0.491	S	S	*	.	H	α-helix	trans	-61.3	-44.3	174.9	-66.1	165.7	0	0	0	110.7	K87 T88 L93 N94 L95	K87-I91 WeakPolarHBondContact O-CG1 3.25Å; K87-I91 PolarHBondContact O-N 3.5Å; T88-I91 PolarHBondContact O-N 3.46Å; I91-L93 VanDerWaalsContact C-N 3.33Å; I91-L93 PolarHBondContact O-N 3.39Å; I91-N94 PolarHBondContact O-N 3.25Å; I91-L95 PolarHBondContact O-N 3.06Å
92	R	92.4	Very high	93.5	Very high	159 Å²	159	97.3 Å²	97.3	60%	0.6	50%	0.496	S	S	*	.	H	α-helix	trans	-64.7	-38.6	-179.5	-146.4	-175.1	-61.5	174.2	0.4	111.8	T88 L89 S90 A96	T88-R92 WeakPolarHBondContact O-CB 3.37Å; T88-R92 PolarHBondContact O-N 2.82Å; L89-R92 PolarHBondContact O-N 3.42Å; S90-R92 VanDerWaalsContact C-N 3.34Å; S90-R92 PolarHBondContact O-N 3.33Å; R92-A96 WeakPolarHBondContact O-CB 3.33Å; R92-A96 PolarHBondContact O-N 3.43Å
93	L	93.7	Very high	93.3	Very high	114 Å²	114	98.8 Å²	98.8	60%	0.597	50%	0.504	S	S	*	.	H	α-helix	trans	-65.1	-48.7	175.2	-177.2	63.2	0	0	0	111	L89 S90 I91 L95 A96 T97	L89-L93 WeakPolarHBondContact O-CB 3.38Å; L89-L93 PolarHBondContact O-N 2.89Å; S90-L93 PolarHBondContact O-N 2.77Å; I91-L93 VanDerWaalsContact C-N 3.33Å; I91-L93 PolarHBondContact O-N 3.39Å; L93-L95 VanDerWaalsContact C-N 3.29Å; L93-L95 PolarHBondContact O-N 3.31Å; L93-A96 WeakPolarHBondContact O-CB 3.36Å; L93-A96 PolarHBondContact O-N 2.92Å; L93-T97 PolarHBondContact O-N 3.49Å; L93-T97 PolarHBondContact O-OG1 3.12Å; L93-T97 VanDerWaalsContact O-OG1 3.11Å
94	N	95	Very high	93.3	Very high	101 Å²	101	97.5 Å²	97.5	54%	0.54	50%	0.5	S	S	.	.	H	α-helix	trans	-59.2	-40.3	178	-68.9	-21.4	0	0	0	112.2	S90 I91 T97 A98	S90-N94 VanDerWaalsContact O-CG 3.24Å; S90-N94 PolarHBondContact O-N 3.01Å; S90-N94 PolarHBondContact O-ND2 3.4Å; I91-N94 PolarHBondContact O-N 3.25Å; N94-T97 PolarHBondContact O-N 2.98Å; N94-A98 PolarHBondContact O-N 3.16Å
95	L	91.5	Very high	93.2	Very high	91 Å²	91	98 Å²	98	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-39.1	175.1	-177.7	65.4	0	0	0	112.2	I91 L93 A98 R99	I91-L95 PolarHBondContact O-N 3.06Å; L93-L95 VanDerWaalsContact C-N 3.29Å; L93-L95 PolarHBondContact O-N 3.31Å; L95-A98 PolarHBondContact O-N 3.5Å; L95-R99 WeakPolarHBondContact O-CG 3.49Å; L95-R99 PolarHBondContact O-N 2.81Å
96	A	91.8	Very high	92.8	Very high	54 Å²	54	96.1 Å²	96.1	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-41.2	176.1	0	0	0	0	0	111.7	R92 L93 R99 Y100	R92-A96 WeakPolarHBondContact O-CB 3.33Å; R92-A96 PolarHBondContact O-N 3.43Å; L93-A96 WeakPolarHBondContact O-CB 3.36Å; L93-A96 PolarHBondContact O-N 2.92Å; A96-R99 PolarHBondContact O-N 3.2Å; A96-Y100 PolarHBondContact O-N 3.23Å
97	T	93.1	Very high	92.6	Very high	69 Å²	69	94.5 Å²	94.5	42%	0.423	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-48.3	173.7	-55.7	0	0	0	0	111.2	L93 N94 R99 Y100 D101	L93-T97 PolarHBondContact O-N 3.49Å; L93-T97 PolarHBondContact O-OG1 3.12Å; L93-T97 VanDerWaalsContact O-OG1 3.11Å; N94-T97 PolarHBondContact O-N 2.98Å; T97-R99 VanDerWaalsContact C-N 3.3Å; T97-R99 PolarHBondContact O-N 2.93Å; T97-Y100 WeakPolarHBondContact O-CB 3.35Å; T97-Y100 PolarHBondContact O-N 3.39Å; T97-D101 PolarHBondContact O-N 3.5Å
98	A	93.6	Very high	92.4	Very high	48 Å²	48	92.9 Å²	92.9	40%	0.397	50%	0.496	S	S	.	.	H	α-helix	trans	-59.3	-39.4	177.1	0	0	0	0	0	112.8	N94 L95 D101 T102	N94-A98 PolarHBondContact O-N 3.16Å; L95-A98 PolarHBondContact O-N 3.5Å; A98-D101 PolarHBondContact O-N 3.48Å; A98-T102 WeakPolarHBondContact O-CG2 3.48Å; A98-T102 PolarHBondContact O-N 3.24Å; A98-T102 PolarHBondContact O-OG1 3.18Å
99	R	91.7	Very high	92.3	Very high	167 Å²	167	95.3 Å²	95.3	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-39.8	174.4	-75	174.9	175.2	-176.8	-1.4	112.3	L95 A96 T97 T102 L103	L95-R99 WeakPolarHBondContact O-CG 3.49Å; L95-R99 PolarHBondContact O-N 2.81Å; A96-R99 PolarHBondContact O-N 3.2Å; T97-R99 VanDerWaalsContact C-N 3.3Å; T97-R99 PolarHBondContact O-N 2.93Å; R99-T102 WeakPolarHBondContact CA-OG1 3.45Å; R99-T102 PolarHBondContact O-N 3.34Å; R99-T102 PolarHBondContact O-OG1 3.43Å; R99-L103 WeakPolarHBondContact O-CB 3.28Å; R99-L103 PolarHBondContact O-N 2.97Å
100	Y	91.9	Very high	92	Very high	151 Å²	151	93.2 Å²	93.2	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-63.4	-44	176.3	-172.8	-96	0	0	0	111.1	A96 T97 T102 L103 V104	A96-Y100 PolarHBondContact O-N 3.23Å; T97-Y100 WeakPolarHBondContact O-CB 3.35Å; T97-Y100 PolarHBondContact O-N 3.39Å; Y100-T102 PolarHBondContact O-N 3.08Å; Y100-L103 WeakPolarHBondContact O-CB 3.3Å; Y100-L103 PolarHBondContact O-N 2.77Å; Y100-L103 VanDerWaalsContact O-N 3.14Å; Y100-V104 HydrophobicContact CD1-CG2 4.04Å; Y100-V104 HydrophobicContact CE1-CG2 3.7Å; Y100-V104 WeakPolarHBondContact O-CG2 3.46Å; Y100-V104 PolarHBondContact O-N 3.46Å
101	D	92.2	Very high	91.7	Very high	93 Å²	93	93.9 Å²	93.9	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-45.2	177.2	-62.6	-25.4	0	0	0	111.4	T97 A98 L103 V104 E105	T97-D101 PolarHBondContact O-N 3.5Å; A98-D101 PolarHBondContact O-N 3.48Å; D101-L103 VanDerWaalsContact C-N 3.29Å; D101-L103 PolarHBondContact O-N 2.85Å; D101-V104 PolarHBondContact O-N 3.05Å; D101-E105 PolarHBondContact O-N 3.38Å
102	T	91.4	Very high	91.5	Very high	85 Å²	85	94.4 Å²	94.4	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-32.4	175.4	57.3	0	0	0	0	113.2	A98 R99 Y100 A106	A98-T102 WeakPolarHBondContact O-CG2 3.48Å; A98-T102 PolarHBondContact O-N 3.24Å; A98-T102 PolarHBondContact O-OG1 3.18Å; R99-T102 WeakPolarHBondContact CA-OG1 3.45Å; R99-T102 PolarHBondContact O-N 3.34Å; R99-T102 PolarHBondContact O-OG1 3.43Å; Y100-T102 PolarHBondContact O-N 3.08Å; T102-A106 WeakPolarHBondContact O-CB 3.45Å; T102-A106 PolarHBondContact O-N 3.3Å
103	L	90.9	Very high	91.4	Very high	105 Å²	105	92.5 Å²	92.5	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-70.1	-41.2	176	-179.8	66	0	0	0	110.6	R99 Y100 D101 A106 T107	R99-L103 WeakPolarHBondContact O-CB 3.28Å; R99-L103 PolarHBondContact O-N 2.97Å; Y100-L103 WeakPolarHBondContact O-CB 3.3Å; Y100-L103 PolarHBondContact O-N 2.77Å; Y100-L103 VanDerWaalsContact O-N 3.14Å; D101-L103 VanDerWaalsContact C-N 3.29Å; D101-L103 PolarHBondContact O-N 2.85Å; L103-A106 PolarHBondContact O-N 3.44Å; L103-T107 VanDerWaalsContact O-CG2 3.29Å; L103-T107 WeakPolarHBondContact O-CG2 3.44Å; L103-T107 PolarHBondContact O-N 2.81Å; L103-T107 PolarHBondContact O-OG1 3.31Å
104	V	92	Very high	91.4	Very high	63 Å²	63	94 Å²	94	38%	0.382	51%	0.505	S	S	.	.	H	α-helix	trans	-61.5	-46.3	175.7	172.6	0	0	0	0	110.2	Y100 D101 A106 T107 T108	Y100-V104 HydrophobicContact CD1-CG2 4.04Å; Y100-V104 HydrophobicContact CE1-CG2 3.7Å; Y100-V104 WeakPolarHBondContact O-CG2 3.46Å; Y100-V104 PolarHBondContact O-N 3.46Å; D101-V104 PolarHBondContact O-N 3.05Å; V104-A106 PolarHBondContact O-N 3.37Å; V104-T107 WeakPolarHBondContact CA-OG1 3.32Å; V104-T107 PolarHBondContact O-N 2.98Å; V104-T107 VanDerWaalsContact O-N 3.12Å; V104-T107 PolarHBondContact O-OG1 3.39Å; V104-T108 PolarHBondContact O-N 3.38Å; V104-T108 PolarHBondContact O-OG1 2.88Å
105	E	91.8	Very high	91.2	Very high	118 Å²	118	92 Å²	92	55%	0.551	50%	0.502	S	S	*	.	H	α-helix	trans	-57.5	-49.5	175.7	-170.8	172	-159.7	0	0	111.7	D101 T107 T108 E109	D101-E105 PolarHBondContact O-N 3.38Å; E105-T107 VanDerWaalsContact C-N 3.27Å; E105-T107 PolarHBondContact O-N 2.98Å; E105-T108 WeakPolarHBondContact CA-OG1 3.38Å; E105-T108 PolarHBondContact O-N 2.84Å; E105-T108 PolarHBondContact O-OG1 3.25Å; E105-E109 WeakPolarHBondContact O-CG 3.49Å; E105-E109 PolarHBondContact O-N 3.26Å
106	A	88.2	Confident	91.4	Very high	49 Å²	49	91.6 Å²	91.6	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-34.2	176.1	0	0	0	0	0	113.1	T102 L103 V104 S110	T102-A106 WeakPolarHBondContact O-CB 3.45Å; T102-A106 PolarHBondContact O-N 3.3Å; L103-A106 PolarHBondContact O-N 3.44Å; V104-A106 PolarHBondContact O-N 3.37Å; A106-S110 WeakPolarHBondContact O-CB 3.41Å; A106-S110 PolarHBondContact O-N 3.17Å
107	T	89.3	Confident	91.4	Very high	78 Å²	78	94 Å²	94	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-70.1	-34.8	174.6	60.2	0	0	0	0	112.5	L103 V104 E105 S110 S111	L103-T107 VanDerWaalsContact O-CG2 3.29Å; L103-T107 WeakPolarHBondContact O-CG2 3.44Å; L103-T107 PolarHBondContact O-N 2.81Å; L103-T107 PolarHBondContact O-OG1 3.31Å; V104-T107 WeakPolarHBondContact CA-OG1 3.32Å; V104-T107 PolarHBondContact O-N 2.98Å; V104-T107 VanDerWaalsContact O-N 3.12Å; V104-T107 PolarHBondContact O-OG1 3.39Å; E105-T107 VanDerWaalsContact C-N 3.27Å; E105-T107 PolarHBondContact O-N 2.98Å; T107-S110 PolarHBondContact O-N 3.49Å; T107-S111 PolarHBondContact O-N 2.92Å; T107-S111 VanDerWaalsContact O-N 3.09Å
108	T	90.9	Very high	91.4	Very high	73 Å²	73	93.5 Å²	93.5	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-68.6	-44.9	174.8	53.2	0	0	0	0	111.5	V104 E105 S110 S111 E112	V104-T108 PolarHBondContact O-N 3.38Å; V104-T108 PolarHBondContact O-OG1 2.88Å; E105-T108 WeakPolarHBondContact CA-OG1 3.38Å; E105-T108 PolarHBondContact O-N 2.84Å; E105-T108 PolarHBondContact O-OG1 3.25Å; T108-S110 VanDerWaalsContact C-N 3.32Å; T108-S110 PolarHBondContact O-N 2.98Å; T108-S111 PolarHBondContact O-N 3.08Å; T108-S111 PolarHBondContact O-OG 3.36Å; T108-E112 PolarHBondContact O-N 2.87Å
109	E	92.3	Very high	91.4	Very high	107 Å²	107	97.4 Å²	97.4	50%	0.5	52%	0.518	S	S	.	.	H	α-helix	trans	-59.8	-41.2	174	-68.1	179.8	169.5	0	0	111.8	E105 S111 E112 L113	E105-E109 WeakPolarHBondContact O-CG 3.49Å; E105-E109 PolarHBondContact O-N 3.26Å; E109-S111 VanDerWaalsContact C-N 3.27Å; E109-S111 PolarHBondContact O-N 3.4Å; E109-E112 PolarHBondContact O-N 3.42Å; E109-L113 PolarHBondContact O-N 3Å
110	S	88.5	Confident	91.5	Very high	55 Å²	55	93.8 Å²	93.8	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-33	175.7	-173.3	0	0	0	0	112.7	A106 T107 T108 K114	A106-S110 WeakPolarHBondContact O-CB 3.41Å; A106-S110 PolarHBondContact O-N 3.17Å; T107-S110 PolarHBondContact O-N 3.49Å; T108-S110 VanDerWaalsContact C-N 3.32Å; T108-S110 PolarHBondContact O-N 2.98Å; S110-K114 WeakPolarHBondContact O-CG 3.4Å; S110-K114 PolarHBondContact O-N 2.94Å
111	S	88.5	Confident	91.5	Very high	73 Å²	73	90.2 Å²	90.2	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-73.4	-37	177	73.1	0	0	0	0	112.7	T107 T108 E109 K114 A115	T107-S111 PolarHBondContact O-N 2.92Å; T107-S111 VanDerWaalsContact O-N 3.09Å; T108-S111 PolarHBondContact O-N 3.08Å; T108-S111 PolarHBondContact O-OG 3.36Å; E109-S111 VanDerWaalsContact C-N 3.27Å; E109-S111 PolarHBondContact O-N 3.4Å; S111-K114 PolarHBondContact O-N 2.99Å; S111-A115 PolarHBondContact O-N 3.28Å; S111-A115 VanDerWaalsContact O-N 3.12Å
112	E	91	Very high	91.5	Very high	129 Å²	129	87.7 Å²	87.7	60%	0.603	50%	0.497	S	S	*	.	H	α-helix	trans	-66	-47.7	174.8	-169.7	170.7	-168	0	0	110.9	T108 E109 K114 A115 D116	T108-E112 PolarHBondContact O-N 2.87Å; E109-E112 PolarHBondContact O-N 3.42Å; E112-K114 PolarHBondContact O-N 3.04Å; E112-A115 WeakPolarHBondContact O-CA 3.31Å; E112-A115 WeakPolarHBondContact O-CB 3.36Å; E112-A115 PolarHBondContact O-N 2.8Å; E112-D116 PolarHBondContact O-N 3.49Å
113	L	91.2	Very high	91.6	Very high	120 Å²	120	86.2 Å²	86.2	63%	0.628	49%	0.489	S	S	*	.	H	α-helix	trans	-56.9	-35.7	173.8	-91.2	161.5	0	0	0	113.5	E109 L117	E109-L113 PolarHBondContact O-N 3Å; L113-L117 WeakPolarHBondContact O-CB 3.32Å; L113-L117 PolarHBondContact O-N 2.69Å
114	K	92.6	Very high	91.8	Very high	145 Å²	145	88.2 Å²	88.2	63%	0.63	49%	0.494	S	S	*	.	H	α-helix	trans	-69	-36.7	174.8	-79.2	175.2	-177.8	174.6	0	112.1	S110 S111 E112 A118	S110-K114 WeakPolarHBondContact O-CG 3.4Å; S110-K114 PolarHBondContact O-N 2.94Å; S111-K114 PolarHBondContact O-N 2.99Å; E112-K114 PolarHBondContact O-N 3.04Å; K114-A118 WeakPolarHBondContact O-CB 3.49Å; K114-A118 PolarHBondContact O-N 3Å; K114-A118 VanDerWaalsContact O-N 3.08Å
115	A	92	Very high	91.9	Very high	58 Å²	58	93.3 Å²	93.3	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-65.9	-46.6	176	0	0	0	0	0	110.9	S111 E112 L117 A118 E119	S111-A115 PolarHBondContact O-N 3.28Å; S111-A115 VanDerWaalsContact O-N 3.12Å; E112-A115 WeakPolarHBondContact O-CA 3.31Å; E112-A115 WeakPolarHBondContact O-CB 3.36Å; E112-A115 PolarHBondContact O-N 2.8Å; A115-L117 VanDerWaalsContact C-N 3.33Å; A115-L117 PolarHBondContact O-N 2.9Å; A115-A118 WeakPolarHBondContact O-CB 3.45Å; A115-A118 PolarHBondContact O-N 3.31Å; A115-A118 VanDerWaalsContact O-N 3.11Å; A115-E119 PolarHBondContact O-N 3.42Å
116	D	94	Very high	92.1	Very high	84 Å²	84	95.1 Å²	95.1	45%	0.449	51%	0.508	S	S	.	.	H	α-helix	trans	-61	-40.8	177.3	-71.4	-8.1	0	0	0	112.3	E112 E119 T120	E112-D116 PolarHBondContact O-N 3.49Å; D116-E119 PolarHBondContact O-N 2.91Å; D116-T120 WeakPolarHBondContact O-CB 3.41Å; D116-T120 PolarHBondContact O-N 3.05Å; D116-T120 PolarHBondContact O-OG1 3.43Å
117	L	92.6	Very high	92.2	Very high	105 Å²	105	97.5 Å²	97.5	55%	0.55	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-41.3	175.2	-179.5	62.5	0	0	0	111.5	L113 A115 T120 I121	L113-L117 WeakPolarHBondContact O-CB 3.32Å; L113-L117 PolarHBondContact O-N 2.69Å; A115-L117 VanDerWaalsContact C-N 3.33Å; A115-L117 PolarHBondContact O-N 2.9Å; L117-T120 PolarHBondContact O-N 3.14Å; L117-I121 HydrophobicContact CD1-CD1 4.38Å; L117-I121 HydrophobicContact CG-CD1 4.13Å; L117-I121 VanDerWaalsContact O-CG1 3.29Å; L117-I121 WeakPolarHBondContact O-CG1 3.4Å; L117-I121 PolarHBondContact O-N 3.39Å
118	A	93.4	Very high	92.4	Very high	58 Å²	58	98.1 Å²	98.1	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-41.3	177.3	0	0	0	0	0	111.8	K114 A115 I121 A122	K114-A118 WeakPolarHBondContact O-CB 3.49Å; K114-A118 PolarHBondContact O-N 3Å; K114-A118 VanDerWaalsContact O-N 3.08Å; A115-A118 WeakPolarHBondContact O-CB 3.45Å; A115-A118 PolarHBondContact O-N 3.31Å; A115-A118 VanDerWaalsContact O-N 3.11Å; A118-I121 PolarHBondContact O-N 3.36Å; A118-A122 PolarHBondContact O-N 2.95Å
119	E	93.2	Very high	92.5	Very high	129 Å²	129	99.5 Å²	99.5	60%	0.603	52%	0.518	S	S	*	.	H	α-helix	trans	-62.7	-43.5	174.3	-177.2	168.3	-168.5	0	0	111.7	A115 D116 I121 A122 C123	A115-E119 PolarHBondContact O-N 3.42Å; D116-E119 PolarHBondContact O-N 2.91Å; E119-I121 VanDerWaalsContact C-N 3.33Å; E119-I121 PolarHBondContact O-N 3.05Å; E119-A122 WeakPolarHBondContact O-CB 3.48Å; E119-A122 PolarHBondContact O-N 3.02Å; E119-A122 VanDerWaalsContact O-N 3.15Å; E119-C123 PolarHBondContact O-N 3.49Å
120	T	93	Very high	92.5	Very high	92 Å²	92	99.7 Å²	99.7	56%	0.564	52%	0.519	S	S	*	.	H	α-helix	trans	-60.2	-42.3	176.4	-59.6	0	0	0	0	111.7	D116 L117 C123 K124	D116-T120 WeakPolarHBondContact O-CB 3.41Å; D116-T120 PolarHBondContact O-N 3.05Å; D116-T120 PolarHBondContact O-OG1 3.43Å; L117-T120 PolarHBondContact O-N 3.14Å; T120-C123 PolarHBondContact O-N 3.45Å; T120-K124 WeakPolarHBondContact O-CB 3.47Å; T120-K124 PolarHBondContact O-N 3.18Å
121	I	92.1	Very high	92.5	Very high	75 Å²	75	101.3 Å²	101.3	39%	0.385	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-41.6	175.6	-69.2	165.5	0	0	0	110.9	L117 A118 E119 K124 R125	L117-I121 HydrophobicContact CD1-CD1 4.38Å; L117-I121 HydrophobicContact CG-CD1 4.13Å; L117-I121 VanDerWaalsContact O-CG1 3.29Å; L117-I121 WeakPolarHBondContact O-CG1 3.4Å; L117-I121 PolarHBondContact O-N 3.39Å; A118-I121 PolarHBondContact O-N 3.36Å; E119-I121 VanDerWaalsContact C-N 3.33Å; E119-I121 PolarHBondContact O-N 3.05Å; I121-K124 PolarHBondContact O-N 2.95Å; I121-R125 WeakPolarHBondContact O-CG 3.33Å; I121-R125 PolarHBondContact O-N 2.99Å
122	A	92.9	Very high	92.6	Very high	40 Å²	40	104 Å²	104	33%	0.331	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-40	177.2	0	0	0	0	0	112.2	A118 E119 R125 R126	A118-A122 PolarHBondContact O-N 2.95Å; E119-A122 WeakPolarHBondContact O-CB 3.48Å; E119-A122 PolarHBondContact O-N 3.02Å; E119-A122 VanDerWaalsContact O-N 3.15Å; A122-R125 PolarHBondContact O-N 2.97Å; A122-R126 PolarHBondContact O-N 2.72Å; A122-R126 VanDerWaalsContact O-N 3.14Å
123	C	93.8	Very high	92.7	Very high	54 Å²	54	103.6 Å²	103.6	37%	0.365	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-46.2	173.6	-173.8	0	0	0	0	111.4	E119 T120 R125 R126 L127	E119-C123 PolarHBondContact O-N 3.49Å; T120-C123 PolarHBondContact O-N 3.45Å; C123-R125 VanDerWaalsContact C-N 3.32Å; C123-R125 PolarHBondContact O-N 3.39Å; C123-R126 WeakPolarHBondContact O-CB 3.47Å; C123-R126 PolarHBondContact O-N 2.98Å; C123-R126 VanDerWaalsContact O-N 3.14Å; C123-L127 PolarHBondContact O-N 3.26Å
124	K	95.8	Very high	92.5	Very high	148 Å²	148	101.8 Å²	101.8	64%	0.643	52%	0.516	S	S	*	.	H	α-helix	trans	-59.4	-39.5	176.7	-175.6	176.4	179.3	178.3	0	112.8	T120 I121 L127 L128	T120-K124 WeakPolarHBondContact O-CB 3.47Å; T120-K124 PolarHBondContact O-N 3.18Å; I121-K124 PolarHBondContact O-N 2.95Å; K124-L127 PolarHBondContact O-N 3.07Å; K124-L128 PolarHBondContact O-N 3.36Å; K124-L128 VanDerWaalsContact O-N 3.09Å
125	R	94	Very high	92.1	Very high	169 Å²	169	100.3 Å²	100.3	64%	0.638	51%	0.511	S	S	*	.	H	α-helix	trans	-64.9	-40.7	175.4	-73.4	177.4	-177.9	164.8	1.3	112.2	I121 A122 C123 L128 N129	I121-R125 WeakPolarHBondContact O-CG 3.33Å; I121-R125 PolarHBondContact O-N 2.99Å; A122-R125 PolarHBondContact O-N 2.97Å; C123-R125 VanDerWaalsContact C-N 3.32Å; C123-R125 PolarHBondContact O-N 3.39Å; R125-L128 PolarHBondContact O-N 3.45Å; R125-N129 PolarHBondContact O-N 3.34Å; R125-N129 VanDerWaalsContact O-N 3.11Å; R125-N129 PolarHBondContact O-OD1 2.95Å
126	R	94.3	Very high	91.7	Very high	157 Å²	157	101 Å²	101	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-60.4	-47.1	175.3	-82	-178.3	-97.2	145.1	-8.3	112.1	A122 C123 L128 N129 E130	A122-R126 PolarHBondContact O-N 2.72Å; A122-R126 VanDerWaalsContact O-N 3.14Å; C123-R126 WeakPolarHBondContact O-CB 3.47Å; C123-R126 PolarHBondContact O-N 2.98Å; C123-R126 VanDerWaalsContact O-N 3.14Å; R126-L128 VanDerWaalsContact C-N 3.31Å; R126-L128 PolarHBondContact O-N 2.93Å; R126-N129 PolarHBondContact O-N 2.88Å; R126-E130 PolarHBondContact O-N 3.38Å
127	L	91.9	Very high	91.4	Very high	99 Å²	99	101.6 Å²	101.6	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-33.8	177.6	-69.5	174	0	0	0	113	C123 K124 N131	C123-L127 PolarHBondContact O-N 3.26Å; K124-L127 PolarHBondContact O-N 3.07Å; L127-N131 WeakPolarHBondContact O-CB 3.37Å; L127-N131 PolarHBondContact O-N 3.23Å
128	L	93.1	Very high	90.8	Very high	90 Å²	90	100.3 Å²	100.3	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-46.7	173.5	-97.4	164.2	0	0	0	111.7	K124 R125 R126 E130 N131 E132	K124-L128 PolarHBondContact O-N 3.36Å; K124-L128 VanDerWaalsContact O-N 3.09Å; R125-L128 PolarHBondContact O-N 3.45Å; R126-L128 VanDerWaalsContact C-N 3.31Å; R126-L128 PolarHBondContact O-N 2.93Å; L128-E130 VanDerWaalsContact C-N 3.34Å; L128-E130 PolarHBondContact O-N 3.45Å; L128-N131 WeakPolarHBondContact O-CB 3.39Å; L128-N131 PolarHBondContact O-N 2.98Å; L128-E132 WeakPolarHBondContact O-CG 3.33Å; L128-E132 PolarHBondContact O-N 3.33Å
129	N	91.9	Very high	90.2	Very high	102 Å²	102	102 Å²	102	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-41.7	177.9	-66.3	-3.5	0	0	0	111.8	R125 R126 N131 E132 E133	R125-N129 PolarHBondContact O-N 3.34Å; R125-N129 VanDerWaalsContact O-N 3.11Å; R125-N129 PolarHBondContact O-OD1 2.95Å; R126-N129 PolarHBondContact O-N 2.88Å; N129-N131 VanDerWaalsContact C-N 3.34Å; N129-N131 PolarHBondContact O-N 3.41Å; N129-E132 PolarHBondContact O-N 3.37Å; N129-E133 PolarHBondContact O-N 2.92Å
130	E	93.3	Very high	89.5	Confident	112 Å²	112	99 Å²	99	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-39.9	176	-171.7	178.2	178.6	0	0	111.7	R126 L128 E133 L134	R126-E130 PolarHBondContact O-N 3.38Å; L128-E130 VanDerWaalsContact C-N 3.34Å; L128-E130 PolarHBondContact O-N 3.45Å; E130-E133 PolarHBondContact O-N 2.98Å; E130-L134 WeakPolarHBondContact O-CG 3.26Å; E130-L134 PolarHBondContact O-N 3.42Å
131	N	88.8	Confident	88.8	Confident	89 Å²	89	98.7 Å²	98.7	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-41	173.6	-101.7	-21.2	0	0	0	112.5	L127 L128 N129 E133 L134 H135	L127-N131 WeakPolarHBondContact O-CB 3.37Å; L127-N131 PolarHBondContact O-N 3.23Å; L128-N131 WeakPolarHBondContact O-CB 3.39Å; L128-N131 PolarHBondContact O-N 2.98Å; N129-N131 VanDerWaalsContact C-N 3.34Å; N129-N131 PolarHBondContact O-N 3.41Å; N131-E133 VanDerWaalsContact C-N 3.32Å; N131-L134 PolarHBondContact O-N 3.48Å; N131-H135 WeakPolarHBondContact O-CB 3.39Å; N131-H135 PolarHBondContact O-CD2 2.88Å; N131-H135 PolarHBondContact O-N 2.93Å
132	E	90.8	Very high	88.1	Confident	130 Å²	130	98 Å²	98	61%	0.607	49%	0.487	S	S	*	.	H	α-helix	trans	-63	-39.7	175.3	-72.9	-179.5	177.5	0	0	111.6	L128 N129 H135 S136	L128-E132 WeakPolarHBondContact O-CG 3.33Å; L128-E132 PolarHBondContact O-N 3.33Å; N129-E132 PolarHBondContact O-N 3.37Å; E132-H135 PolarHBondContact O-N 3.19Å; E132-S136 PolarHBondContact O-N 3.29Å
133	E	91.3	Very high	87.3	Confident	120 Å²	120	101.3 Å²	101.3	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-64.9	-48.1	175.5	-171.7	177	172.6	0	0	112	N129 E130 N131 H135 S136 Q137	N129-E133 PolarHBondContact O-N 2.92Å; E130-E133 PolarHBondContact O-N 2.98Å; N131-E133 VanDerWaalsContact C-N 3.32Å; E133-H135 VanDerWaalsContact C-N 3.28Å; E133-H135 PolarHBondContact O-N 2.96Å; E133-S136 WeakPolarHBondContact O-CB 3.41Å; E133-S136 PolarHBondContact O-N 3.37Å; E133-S136 VanDerWaalsContact O-N 3.08Å; E133-Q137 WeakPolarHBondContact O-CG 3.32Å; E133-Q137 PolarHBondContact O-N 2.88Å
134	L	87.8	Confident	86.2	Confident	82 Å²	82	103.1 Å²	103.1	43%	0.429	50%	0.5	S	S	.	.	H	α-helix	trans	-59.5	-39.1	175.4	-73.2	173.9	0	0	0	111.8	E130 N131 Q137 L138	E130-L134 WeakPolarHBondContact O-CG 3.26Å; E130-L134 PolarHBondContact O-N 3.42Å; N131-L134 PolarHBondContact O-N 3.48Å; L134-Q137 PolarHBondContact O-N 3.35Å; L134-L138 WeakPolarHBondContact O-CB 3.35Å; L134-L138 PolarHBondContact O-N 3.24Å
135	H	84.6	Confident	84.7	Confident	114 Å²	114	97.2 Å²	97.2	53%	0.528	48%	0.475	S	S	.	.	H	α-helix	trans	-64.7	-39.2	173.8	-83.8	-54.6	0	0	0	112.6	N131 E132 E133 L138 N139	N131-H135 WeakPolarHBondContact O-CB 3.39Å; N131-H135 PolarHBondContact O-CD2 2.88Å; N131-H135 PolarHBondContact O-N 2.93Å; E132-H135 PolarHBondContact O-N 3.19Å; E133-H135 VanDerWaalsContact C-N 3.28Å; E133-H135 PolarHBondContact O-N 2.96Å; H135-L138 PolarHBondContact O-N 2.9Å; H135-N139 WeakPolarHBondContact O-CB 3.41Å; H135-N139 PolarHBondContact O-N 2.89Å; H135-N139 PolarHBondContact O-ND2 3.01Å
136	S	84.2	Confident	83.4	Confident	71 Å²	71	91.9 Å²	91.9	50%	0.497	46%	0.459	S	S	.	.	H	α-helix	trans	-64.3	-42.8	174.9	-171.6	0	0	0	0	112.1	E132 E133 N139 S140	E132-S136 PolarHBondContact O-N 3.29Å; E133-S136 WeakPolarHBondContact O-CB 3.41Å; E133-S136 PolarHBondContact O-N 3.37Å; E133-S136 VanDerWaalsContact O-N 3.08Å; S136-N139 PolarHBondContact O-N 2.71Å; S136-S140 PolarHBondContact O-N 2.83Å; S136-S140 PolarHBondContact O-OG 3.27Å
137	Q	86.3	Confident	82	Confident	98 Å²	98	88.3 Å²	88.3	46%	0.458	46%	0.455	S	S	.	.	H	α-helix	trans	-63.4	-44.8	174.5	-67.9	179.5	10.6	0	0	111.5	E133 L134 N139 S140 I141	E133-Q137 WeakPolarHBondContact O-CG 3.32Å; E133-Q137 PolarHBondContact O-N 2.88Å; L134-Q137 PolarHBondContact O-N 3.35Å; Q137-N139 VanDerWaalsContact C-N 3.32Å; Q137-N139 PolarHBondContact O-N 3.39Å; Q137-S140 WeakPolarHBondContact O-CB 3.46Å; Q137-S140 PolarHBondContact O-N 2.85Å; Q137-I141 WeakPolarHBondContact O-CG1 3.47Å; Q137-I141 PolarHBondContact O-N 3.43Å
138	L	80.5	Confident	80.3	Confident	77 Å²	77	91.1 Å²	91.1	40%	0.403	46%	0.463	S	S	.	.	H	α-helix	trans	-59.1	-41	175	-96.9	165.5	0	0	0	112.5	L134 H135 I141 R142 T187	L134-L138 WeakPolarHBondContact O-CB 3.35Å; L134-L138 PolarHBondContact O-N 3.24Å; H135-L138 PolarHBondContact O-N 2.9Å; L138-I141 PolarHBondContact O-N 3.3Å; L138-R142 WeakPolarHBondContact O-CB 3.17Å; L138-R142 PolarHBondContact O-N 3.46Å; L138-T187 HydrophobicContact CD2-CG2 3.94Å
139	N	81.5	Confident	78.4	Confident	94 Å²	94	89.9 Å²	89.9	50%	0.503	46%	0.456	S	S	.	.	H	α-helix	trans	-67.7	-39.2	176.3	-77.2	-18.6	0	0	0	111.8	H135 S136 Q137 I141 R142 E143	H135-N139 WeakPolarHBondContact O-CB 3.41Å; H135-N139 PolarHBondContact O-N 2.89Å; H135-N139 PolarHBondContact O-ND2 3.01Å; S136-N139 PolarHBondContact O-N 2.71Å; Q137-N139 VanDerWaalsContact C-N 3.32Å; Q137-N139 PolarHBondContact O-N 3.39Å; N139-I141 PolarHBondContact O-N 3.33Å; N139-R142 WeakPolarHBondContact O-CB 3.37Å; N139-R142 PolarHBondContact O-N 3.34Å; N139-E143 PolarHBondContact O-N 3.34Å
140	S	78.7	Confident	76.4	Confident	65 Å²	65	88.2 Å²	88.2	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-62.2	-44	175.3	-60.1	0	0	0	0	111.8	S136 Q137 R142 E143 I144	S136-S140 PolarHBondContact O-N 2.83Å; S136-S140 PolarHBondContact O-OG 3.27Å; Q137-S140 WeakPolarHBondContact O-CB 3.46Å; Q137-S140 PolarHBondContact O-N 2.85Å; S140-R142 VanDerWaalsContact C-N 3.31Å; S140-R142 PolarHBondContact O-N 3.37Å; S140-E143 PolarHBondContact O-N 3.13Å; S140-I144 VanDerWaalsContact O-CG1 3.27Å; S140-I144 WeakPolarHBondContact O-CG1 3.46Å; S140-I144 PolarHBondContact O-N 2.82Å
141	I	77.3	Confident	74.1	Confident	86 Å²	86	89.8 Å²	89.8	44%	0.441	46%	0.463	S	S	.	.	H	α-helix	trans	-60.6	-43.9	173.9	-67.8	167.8	0	0	0	110.4	Q137 L138 N139 I144 L145 T187	Q137-I141 WeakPolarHBondContact O-CG1 3.47Å; Q137-I141 PolarHBondContact O-N 3.43Å; L138-I141 PolarHBondContact O-N 3.3Å; N139-I141 PolarHBondContact O-N 3.33Å; I141-I144 PolarHBondContact O-N 3.19Å; I141-L145 HydrophobicContact CG2-CD1 3.94Å; I141-L145 WeakPolarHBondContact O-CG 3.49Å; I141-L145 PolarHBondContact O-N 2.96Å; I141-T187 HydrophobicContact CG2-CG2 4.21Å
142	R	77.1	Confident	72.1	Confident	62 Å²	62	94.8 Å²	94.8	23%	0.234	48%	0.481	C	S	.	.	H	α-helix	trans	-62	-45	178.5	-170.4	176.8	-173.3	156.9	4.9	112.2	L138 N139 S140 L145 L146 N183 L185 T187 L190	L138-R142 WeakPolarHBondContact O-CB 3.17Å; L138-R142 PolarHBondContact O-N 3.46Å; N139-R142 WeakPolarHBondContact O-CB 3.37Å; N139-R142 PolarHBondContact O-N 3.34Å; S140-R142 VanDerWaalsContact C-N 3.31Å; S140-R142 PolarHBondContact O-N 3.37Å; R142-L145 PolarHBondContact O-N 3.44Å; R142-L146 HydrophobicContact CG-CD1 4.12Å; R142-L146 WeakPolarHBondContact O-CG 3.38Å; R142-L146 PolarHBondContact O-N 2.98Å; R142-N183 PolarHBondContact NH2-O 3.41Å; R142-L185 PolarHBondContact NH2-O 3Å; R142-L185 VanDerWaalsContact NH2-O 3.11Å; R142-T187 HydrophobicContact CB-CG2 4.24Å; R142-L190 HydrophobicContact CG-CD2 4.27Å
143	E	76.2	Confident	69.7	Low	108 Å²	108	91.5 Å²	91.5	51%	0.505	47%	0.467	S	S	.	.	H	α-helix	trans	-62.1	-42.3	176.1	-78.7	-59	131.7	0	0	111.9	N139 S140 L145 L146 T147	N139-E143 PolarHBondContact O-N 3.34Å; S140-E143 PolarHBondContact O-N 3.13Å; E143-L145 VanDerWaalsContact C-N 3.34Å; E143-L145 PolarHBondContact O-N 3.39Å; E143-L146 PolarHBondContact O-N 2.96Å; E143-T147 WeakPolarHBondContact O-CB 3.35Å; E143-T147 WeakPolarHBondContact O-CG2 3.46Å; E143-T147 PolarHBondContact O-N 2.75Å; E143-T147 PolarHBondContact O-OG1 3.04Å
144	I	71.1	Confident	67.2	Low	93 Å²	93	93.7 Å²	93.7	48%	0.477	48%	0.477	S	S	.	.	H	α-helix	trans	-61.1	-43.9	175.9	-68.8	165	0	0	0	111	S140 I141 L146 K148	S140-I144 VanDerWaalsContact O-CG1 3.27Å; S140-I144 WeakPolarHBondContact O-CG1 3.46Å; S140-I144 PolarHBondContact O-N 2.82Å; I141-I144 PolarHBondContact O-N 3.19Å; I144-L146 VanDerWaalsContact C-N 3.34Å; I144-L146 PolarHBondContact O-N 3.33Å; I144-K148 HydrophobicContact CG2-CB 4.48Å; I144-K148 PolarHBondContact O-N 3.45Å
145	L	65.2	Low	64.9	Low	23 Å²	23	97.3 Å²	97.3	12%	0.12	50%	0.497	C	S	.	.	H	α-helix	trans	-65.2	-35.3	178.4	-73.3	167.3	0	0	0	112.8	I141 R142 E143 L190 V191	I141-L145 HydrophobicContact CG2-CD1 3.94Å; I141-L145 WeakPolarHBondContact O-CG 3.49Å; I141-L145 PolarHBondContact O-N 2.96Å; R142-L145 PolarHBondContact O-N 3.44Å; E143-L145 VanDerWaalsContact C-N 3.34Å; E143-L145 PolarHBondContact O-N 3.39Å; L145-L190 HydrophobicContact CB-CD2 3.79Å; L145-L190 HydrophobicContact CD1-CD2 4.07Å; L145-V191 HydrophobicContact CD1-CG2 3.49Å; L145-V191 VanDerWaalsContact CD1-CG2 3.49Å
146	L	64.9	Low	62.9	Low	57 Å²	57	96.8 Å²	96.8	30%	0.298	50%	0.497	S	S	.	.	H	α-helix	trans	-78.9	-38.6	178.4	-70.4	171.9	0	0	0	112.6	R142 E143 I144 L190	R142-L146 HydrophobicContact CG-CD1 4.12Å; R142-L146 WeakPolarHBondContact O-CG 3.38Å; R142-L146 PolarHBondContact O-N 2.98Å; E143-L146 PolarHBondContact O-N 2.96Å; I144-L146 VanDerWaalsContact C-N 3.34Å; I144-L146 PolarHBondContact O-N 3.33Å; L146-L190 HydrophobicContact CD2-CD1 4.45Å; L146-L190 HydrophobicContact CD2-CD2 4.25Å; L146-L190 HydrophobicContact CG-CD2 4.26Å
147	T	64.7	Low	60.9	Low	82 Å²	82	101.2 Å²	101.2	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-97.4	-41.9	-169	60.3	0	0	0	0	114.6	E143	E143-T147 WeakPolarHBondContact O-CB 3.35Å; E143-T147 WeakPolarHBondContact O-CG2 3.46Å; E143-T147 PolarHBondContact O-N 2.75Å; E143-T147 PolarHBondContact O-OG1 3.04Å
148	K	57.4	Low	58.7	Low	159 Å²	159	99.4 Å²	99.4	69%	0.691	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-26.2	-165.5	-65.4	-146.1	177.7	-172.9	0	114.8	I144 P150	I144-K148 HydrophobicContact CG2-CB 4.48Å; I144-K148 PolarHBondContact O-N 3.45Å; K148-P150 VanDerWaalsContact C-CD 3.42Å
149	L	53.4	Low	56.8	Low	63 Å²	63	102.7 Å²	102.7	33%	0.33	53%	0.526	S	S	.	.	S	Bend	trans	-74.1	-25.4	-179.1	-128.9	80	0	0	0	116.4	N151 L153 W194	L149-N151 VanDerWaalsContact C-N 3.32Å; L149-N151 PolarHBondContact O-N 2.95Å; L149-L153 HydrophobicContact CG-CD1 4.35Å; L149-W194 HydrophobicContact CB-CH2 4.39Å; L149-W194 HydrophobicContact CB-CZ2 4.45Å; L149-W194 HydrophobicContact CD2-CB 4.45Å; L149-W194 HydrophobicContact CD2-CD2 3.83Å; L149-W194 HydrophobicContact CD2-CE3 3.63Å; L149-W194 HydrophobicContact CD2-CG 4.22Å; L149-W194 HydrophobicContact CD2-CZ3 4.08Å
150	P	49.5	Very low	55	Low	67 Å²	67	107.2 Å²	107.2	44%	0.435	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.2	-172.5	-23	32.6	0	0	0	116.1	K148	K148-P150 VanDerWaalsContact C-CD 3.42Å
151	N	45.9	Very low	53.2	Low	146 Å²	146	106.5 Å²	106.5	78%	0.781	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	2.8	-158.6	-68.6	-6.2	0	0	0	117.1	L149	L149-N151 VanDerWaalsContact C-N 3.32Å; L149-N151 PolarHBondContact O-N 2.95Å
152	K	45.2	Very low	51.8	Low	193 Å²	193	107 Å²	107	84%	0.839	54%	0.538	S	S	*	.			trans	-132.8	19.6	-171.5	-78.1	-169.8	175.7	-175.3	0	116.7	E154	K152-E154 VanDerWaalsContact C-N 3.33Å; K152-E154 PolarHBondContact O-N 3.24Å
153	L	40.8	Very low	50.4	Low	62 Å²	62	106.5 Å²	106.5	33%	0.325	54%	0.539	S	S	.	.			trans	-92.4	59.1	179.1	-88.9	151.4	0	0	0	111.7	L149 I156 F198	L149-L153 HydrophobicContact CG-CD1 4.35Å; L153-I156 HydrophobicContact CD2-CD1 4.21Å; L153-F198 HydrophobicContact CD1-CD2 4.3Å; L153-F198 HydrophobicContact CD2-CD2 3.58Å; L153-F198 HydrophobicContact CD2-CE2 3.29Å
154	E	38.9	Very low	49.1	Very low	165 Å²	165	106.1 Å²	106.1	77%	0.771	55%	0.548	S	S	*	.	S	Bend	trans	-108.8	-11.1	-178.8	-133.4	172.2	-157.9	0	0	115	K152	K152-E154 VanDerWaalsContact C-N 3.33Å; K152-E154 PolarHBondContact O-N 3.24Å
155	N	40.7	Very low	48.1	Very low	158 Å²	158	107.8 Å²	107.8	85%	0.845	56%	0.558	S	S	*	*			trans	-146.8	90.2	-179.3	-73.6	-46.4	0	0	0	111.8
156	I	41.9	Very low	47.4	Very low	104 Å²	104	113.5 Å²	113.5	53%	0.533	58%	0.579	S	S	.	*			trans	-130.9	121.7	159.1	-48.7	178	0	0	0	108.4	L153 M158 F198	L153-I156 HydrophobicContact CD2-CD1 4.21Å; I156-M158 HydrophobicContact CB-CE 4.32Å; I156-M158 HydrophobicContact CB-CG 4.11Å; I156-M158 HydrophobicContact CG2-CE 3.63Å; I156-M158 HydrophobicContact CG2-CG 3.78Å; I156-M158 HydrophobicContact CG2-SD 3.71Å; I156-M158 WeakPolarHBondContact O-CG 3.36Å; I156-M158 PolarHBondContact O-N 2.99Å; I156-F198 HydrophobicContact CD1-CE2 4.18Å; I156-F198 HydrophobicContact CD1-CZ 4.18Å
157	D	42.1	Very low	46.7	Very low	163 Å²	163	111.9 Å²	111.9	87%	0.872	57%	0.573	S	S	*	*			trans	-72.9	111.3	177.9	-163.3	9.7	0	0	0	109.1
158	M	40.1	Very low	46.3	Very low	60 Å²	60	115.2 Å²	115.2	30%	0.296	59%	0.587	S	S	.	*			trans	-140	95.3	-161.2	-70.8	-62.2	-142.4	0	0	113.6	I156 I161 F198 I202	I156-M158 HydrophobicContact CB-CE 4.32Å; I156-M158 HydrophobicContact CB-CG 4.11Å; I156-M158 HydrophobicContact CG2-CE 3.63Å; I156-M158 HydrophobicContact CG2-CG 3.78Å; I156-M158 HydrophobicContact CG2-SD 3.71Å; I156-M158 WeakPolarHBondContact O-CG 3.36Å; I156-M158 PolarHBondContact O-N 2.99Å; M158-I161 HydrophobicContact CE-CD1 3.29Å; M158-I161 HydrophobicContact SD-CD1 3.54Å; M158-I161 VanDerWaalsContact SD-CD1 3.54Å; M158-I161 HydrophobicContact SD-CG1 4.49Å; M158-F198 HydrophobicContact CE-CE1 4.47Å; M158-F198 HydrophobicContact CE-CZ 4.05Å; M158-I202 HydrophobicContact CB-CG2 4.4Å; M158-I202 HydrophobicContact CE-CD1 3.79Å
159	D	41.1	Very low	46	Very low	147 Å²	147	108.5 Å²	108.5	79%	0.786	56%	0.558	S	S	*	*	S	Bend	trans	-109.3	11.1	176.6	-97.2	-9.5	0	0	0	115
160	Q	42.9	Very low	46.2	Very low	188 Å²	188	109.7 Å²	109.7	88%	0.879	57%	0.568	S	S	*	*			trans	-138.5	18.5	-172.3	-68.9	-169.9	9.1	0	0	118.5
161	I	41.9	Very low	46.6	Very low	51 Å²	51	110.5 Å²	110.5	26%	0.262	58%	0.575	S	S	.	*			trans	-105.2	104.2	-173.1	-65	175.4	0	0	0	112.6	M158 Y166 F199 I202	M158-I161 HydrophobicContact CE-CD1 3.29Å; M158-I161 HydrophobicContact SD-CD1 3.54Å; M158-I161 VanDerWaalsContact SD-CD1 3.54Å; M158-I161 HydrophobicContact SD-CG1 4.49Å; I161-Y166 HydrophobicContact CG2-CD2 4.39Å; I161-F199 HydrophobicContact CD1-CE1 4.31Å; I161-F199 HydrophobicContact CG2-CD1 3.32Å; I161-F199 HydrophobicContact CG2-CE1 3.33Å; I161-I202 HydrophobicContact CB-CG2 4.21Å; I161-I202 HydrophobicContact CD1-CD1 4Å; I161-I202 HydrophobicContact CG2-CG2 4.42Å
162	N	46.9	Very low	47.3	Very low	97 Å²	97	111.8 Å²	111.8	52%	0.519	57%	0.574	S	S	.	*			trans	-83.2	109.6	168.8	-170.4	-8.3	0	0	0	110	S164 N165	N162-S164 PolarHBondContact O-N 3.18Å; N162-S164 VanDerWaalsContact O-N 3.14Å; N162-N165 PolarHBondContact O-N 2.97Å
163	I	47.2	Very low	48	Very low	51 Å²	51	107.1 Å²	107.1	26%	0.262	56%	0.555	S	S	.	*	H	α-helix	trans	-52.8	-36.7	-174.6	-56.4	134.7	0	0	0	112.4	N165 Y166 S167 F199 S203	I163-N165 PolarHBondContact O-N 3.43Å; I163-Y166 PolarHBondContact O-N 3.4Å; I163-S167 WeakPolarHBondContact O-CB 3.42Å; I163-S167 PolarHBondContact O-N 3.49Å; I163-F199 HydrophobicContact CG2-CB 4.38Å; I163-S203 WeakPolarHBondContact CD1-OG 3.39Å
164	S	50.3	Low	49	Very low	99 Å²	99	105.7 Å²	105.7	69%	0.692	55%	0.546	S	S	*	.	H	α-helix	trans	-63.4	-24.9	-172.9	-56.7	0	0	0	0	113.6	N162	N162-S164 PolarHBondContact O-N 3.18Å; N162-S164 VanDerWaalsContact O-N 3.14Å
165	N	50.1	Low	50.1	Low	128 Å²	128	102.3 Å²	102.3	68%	0.684	53%	0.534	S	S	*	.	H	α-helix	trans	-88.6	-20.5	-180	-73.3	-2.8	0	0	0	113.4	N162 I163	N162-N165 PolarHBondContact O-N 2.97Å; I163-N165 PolarHBondContact O-N 3.43Å
166	Y	49.4	Very low	51.4	Low	143 Å²	143	99.2 Å²	99.2	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-110	-20	-174.2	-67	-82.5	0	0	0	114	I161 I163 L168 F199	I161-Y166 HydrophobicContact CG2-CD2 4.39Å; I163-Y166 PolarHBondContact O-N 3.4Å; Y166-L168 PolarHBondContact O-N 3.01Å; Y166-F199 AromaticContact CD1-CZ 3.96Å; Y166-F199 HydrophobicContact CD1-CZ 3.96Å; Y166-F199 HydrophobicContact CD2-CE1 4.16Å; Y166-F199 HydrophobicContact CD2-CZ 4.32Å; Y166-F199 AromaticContact CG-CE1 3.92Å; Y166-F199 HydrophobicContact CG-CE1 3.92Å; Y166-F199 HydrophobicContact CG-CE2 4.17Å; Y166-F199 AromaticContact CG-CZ 3.62Å; Y166-F199 HydrophobicContact CG-CZ 3.62Å
167	S	51	Low	52.3	Low	23 Å²	23	95.1 Å²	95.1	16%	0.161	50%	0.499	C	S	.	.			trans	-88.3	94.5	173.2	171.2	0	0	0	0	110.4	I163 L169 H196	I163-S167 WeakPolarHBondContact O-CB 3.42Å; I163-S167 PolarHBondContact O-N 3.49Å; S167-L169 PolarHBondContact O-N 2.94Å; S167-L169 PolarHBondContact OG-O 3.24Å; S167-H196 PolarHBondContact OG-CD2 2.95Å
168	L	55	Low	53.5	Low	152 Å²	152	90.5 Å²	90.5	80%	0.796	48%	0.475	S	S	*	.			trans	-69.6	-3.5	171	-124.3	101.6	0	0	0	113.8	Y166	Y166-L168 PolarHBondContact O-N 3.01Å
169	L	51.6	Low	54.8	Low	18 Å²	18	94.2 Å²	94.2	9%	0.094	50%	0.496	C	S	.	.	S	Bend	trans	-98	132	-179.9	-80.8	172.7	0	0	0	109.7	S167 E173 L177 K192 H196	S167-L169 PolarHBondContact O-N 2.94Å; S167-L169 PolarHBondContact OG-O 3.24Å; L169-E173 HydrophobicContact CD2-CB 3.68Å; L169-L177 HydrophobicContact CD1-CD1 4.06Å; L169-L177 HydrophobicContact CD2-CD1 3.64Å; L169-K192 HydrophobicContact CD1-CB 3.8Å; L169-K192 HydrophobicContact CG-CB 4.27Å; L169-H196 HydrophobicContact CD1-CB 4.21Å
170	T	58	Low	56.1	Low	88 Å²	88	92.1 Å²	92.1	54%	0.54	48%	0.48	S	S	.	.			trans	-73.7	148.7	166.2	-51.9	0	0	0	0	108.9	K172 E173 F174	T170-K172 PolarHBondContact O-N 3.37Å; T170-E173 PolarHBondContact N-OE2 3.13Å; T170-E173 WeakPolarHBondContact O-CB 3.37Å; T170-E173 PolarHBondContact O-N 3.49Å; T170-F174 PolarHBondContact O-N 2.7Å
171	S	57.7	Low	56.9	Low	84 Å²	84	86 Å²	86	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-54.1	-27.4	178.7	-50.1	0	0	0	0	113.9	N175	S171-N175 PolarHBondContact O-N 2.86Å
172	K	60	Low	57.9	Low	173 Å²	173	86.2 Å²	86.2	75%	0.752	46%	0.462	S	S	*	.	H	α-helix	trans	-67.3	-44.2	172	-73.8	-175.7	178.8	178.7	0	112.7	T170 N175 V176	T170-K172 PolarHBondContact O-N 3.37Å; K172-N175 PolarHBondContact O-N 3.35Å; K172-V176 WeakPolarHBondContact O-CG2 3.29Å; K172-V176 PolarHBondContact O-N 3.37Å
173	E	61.3	Low	58.8	Low	96 Å²	96	87.1 Å²	87.1	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-68.9	-38.3	179.9	-62.8	172.8	140.6	0	0	111.3	L169 T170 N175 V176 L177	L169-E173 HydrophobicContact CD2-CB 3.68Å; T170-E173 PolarHBondContact N-OE2 3.13Å; T170-E173 WeakPolarHBondContact O-CB 3.37Å; T170-E173 PolarHBondContact O-N 3.49Å; E173-N175 PolarHBondContact O-N 3.34Å; E173-V176 PolarHBondContact O-N 2.91Å; E173-L177 WeakPolarHBondContact O-CG 3.48Å; E173-L177 PolarHBondContact O-N 3.38Å
174	F	61.7	Low	60	Low	31 Å²	31	90.9 Å²	90.9	14%	0.136	49%	0.487	C	S	.	.	H	α-helix	trans	-59.2	-45.8	173.4	177.5	-97.6	0	0	0	111.9	T170 V176 L177 N178 V193 H196	T170-F174 PolarHBondContact O-N 2.7Å; F174-V176 VanDerWaalsContact C-N 3.32Å; F174-V176 PolarHBondContact O-N 3.2Å; F174-L177 PolarHBondContact O-N 2.92Å; F174-N178 HydrophobicContact CE1-CB 4.25Å; F174-N178 HydrophobicContact CZ-CB 4.31Å; F174-N178 VanDerWaalsContact O-CB 3.22Å; F174-N178 WeakPolarHBondContact O-CB 3.33Å; F174-N178 PolarHBondContact O-N 3.21Å; F174-V193 HydrophobicContact CE2-CG1 4.04Å; F174-H196 HydrophobicContact CD2-CB 3.81Å; F174-H196 AromaticContact CD2-CG 3.64Å; F174-H196 AromaticContact CD2-ND1 3.86Å; F174-H196 HydrophobicContact CE2-CB 4.12Å
175	N	61.2	Low	60.9	Low	94 Å²	94	86.4 Å²	86.4	50%	0.503	46%	0.456	S	S	.	.	H	α-helix	trans	-62.5	-38.1	178	-78	-16.3	0	0	0	112.6	S171 K172 E173 N179	S171-N175 PolarHBondContact O-N 2.86Å; K172-N175 PolarHBondContact O-N 3.35Å; E173-N175 PolarHBondContact O-N 3.34Å; N175-N179 WeakPolarHBondContact O-CB 3.42Å; N175-N179 PolarHBondContact O-N 3.15Å; N175-N179 PolarHBondContact O-ND2 2.79Å
176	V	67.6	Low	62	Low	94 Å²	94	83 Å²	83	57%	0.57	44%	0.441	S	S	*	.	H	α-helix	trans	-65.7	-43.4	175.9	174	0	0	0	0	111.2	K172 E173 F174	K172-V176 WeakPolarHBondContact O-CG2 3.29Å; K172-V176 PolarHBondContact O-N 3.37Å; E173-V176 PolarHBondContact O-N 2.91Å; F174-V176 VanDerWaalsContact C-N 3.32Å; F174-V176 PolarHBondContact O-N 3.2Å
177	L	61.1	Low	62.9	Low	17 Å²	17	77.3 Å²	77.3	9%	0.089	42%	0.422	C	S	.	.	H	α-helix	trans	-71.2	-39.8	-180	-73.9	169.9	0	0	0	112.6	L169 E173 F174 N179 K180 L185 E189 V193	L169-L177 HydrophobicContact CD1-CD1 4.06Å; L169-L177 HydrophobicContact CD2-CD1 3.64Å; E173-L177 WeakPolarHBondContact O-CG 3.48Å; E173-L177 PolarHBondContact O-N 3.38Å; F174-L177 PolarHBondContact O-N 2.92Å; L177-N179 VanDerWaalsContact C-N 3.26Å; L177-N179 PolarHBondContact O-N 3.4Å; L177-K180 PolarHBondContact O-N 2.9Å; L177-K180 VanDerWaalsContact O-N 3.17Å; L177-L185 HydrophobicContact CD2-CD2 4.45Å; L177-E189 HydrophobicContact CD2-CB 4.12Å; L177-E189 HydrophobicContact CD2-CG 3.92Å; L177-V193 HydrophobicContact CB-CG2 3.65Å; L177-V193 HydrophobicContact CD1-CG2 4.14Å; L177-V193 HydrophobicContact CG-CG2 4.46Å
178	N	67.8	Low	63.9	Low	67 Å²	67	81.7 Å²	81.7	36%	0.358	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-25.5	179.8	-167.9	58.9	0	0	0	112.6	F174 K180	F174-N178 HydrophobicContact CE1-CB 4.25Å; F174-N178 HydrophobicContact CZ-CB 4.31Å; F174-N178 VanDerWaalsContact O-CB 3.22Å; F174-N178 WeakPolarHBondContact O-CB 3.33Å; F174-N178 PolarHBondContact O-N 3.21Å; N178-K180 VanDerWaalsContact C-N 3.34Å
179	N	66.7	Low	64.8	Low	137 Å²	137	77 Å²	77	73%	0.733	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.7	174.2	-72.9	-9.9	0	0	0	113.3	N175 L177	N175-N179 WeakPolarHBondContact O-CB 3.42Å; N175-N179 PolarHBondContact O-N 3.15Å; N175-N179 PolarHBondContact O-ND2 2.79Å; L177-N179 VanDerWaalsContact C-N 3.26Å; L177-N179 PolarHBondContact O-N 3.4Å
180	K	68.7	Low	65.7	Low	104 Å²	104	76.2 Å²	76.2	45%	0.452	41%	0.413	S	S	.	.	S	Bend	trans	-78.5	142.8	171	-73.2	-177.8	-179.8	178.6	0	109.5	L177 N178 M182 L185	L177-K180 PolarHBondContact O-N 2.9Å; L177-K180 VanDerWaalsContact O-N 3.17Å; N178-K180 VanDerWaalsContact C-N 3.34Å; K180-M182 PolarHBondContact O-N 2.81Å; K180-L185 HydrophobicContact CB-CD1 3.7Å
181	A	60.3	Low	66.3	Low	58 Å²	58	74.4 Å²	74.4	48%	0.479	40%	0.401	S	S	.	.			trans	-57.4	130.5	173.3	0	0	0	0	0	110.2	N183 N184 L185	A181-N183 PolarHBondContact O-N 3.47Å; A181-N184 PolarHBondContact O-N 3.39Å; A181-L185 WeakPolarHBondContact O-CD1 3.03Å
182	M	62.5	Low	66.9	Low	56 Å²	56	74.1 Å²	74.1	28%	0.276	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-47.9	-32.5	-179.2	-84	-89.8	167.2	0	0	113.4	K180 N184 L190 V193	K180-M182 PolarHBondContact O-N 2.81Å; M182-N184 VanDerWaalsContact C-N 3.32Å; M182-N184 PolarHBondContact O-N 3.43Å; M182-L190 HydrophobicContact SD-CD1 3.39Å; M182-L190 WeakPolarHBondContact SD-CD1 3.44Å; M182-V193 HydrophobicContact CE-CG1 4.03Å
183	N	66.1	Low	67.5	Low	117 Å²	117	66 Å²	66	63%	0.626	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-72.4	-22.6	-179.8	-60	-5.9	0	0	0	113.4	R142 A181	R142-N183 PolarHBondContact NH2-O 3.41Å; A181-N183 PolarHBondContact O-N 3.47Å
184	N	71.5	Confident	67.9	Low	130 Å²	130	63.1 Å²	63.1	70%	0.695	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-93.5	-2	-178.2	-67.1	-7.7	0	0	0	113.3	A181 M182	A181-N184 PolarHBondContact O-N 3.39Å; M182-N184 VanDerWaalsContact C-N 3.32Å; M182-N184 PolarHBondContact O-N 3.43Å
185	L	68.8	Low	68.1	Low	5 Å²	5	65.5 Å²	65.5	3%	0.026	35%	0.353	C	S	.	.	S	Bend	trans	-81.1	142.4	176.3	-80.7	75.8	0	0	0	110.3	R142 L177 K180 A181 E189 V193	R142-L185 PolarHBondContact NH2-O 3Å; R142-L185 VanDerWaalsContact NH2-O 3.11Å; L177-L185 HydrophobicContact CD2-CD2 4.45Å; K180-L185 HydrophobicContact CB-CD1 3.7Å; A181-L185 WeakPolarHBondContact O-CD1 3.03Å; L185-E189 HydrophobicContact CB-CB 4.05Å; L185-E189 HydrophobicContact CD2-CB 3.96Å; L185-E189 HydrophobicContact CG-CB 4.12Å; L185-V193 HydrophobicContact CD2-CG2 3.82Å
186	S	74.8	Confident	68.4	Low	55 Å²	55	61.8 Å²	61.8	39%	0.385	33%	0.332	S	S	.	.			trans	-62.3	154.5	163.7	62.7	0	0	0	0	110.4	L188 E189 L190	S186-L188 PolarHBondContact O-N 2.92Å; S186-E189 WeakPolarHBondContact CB-OE2 3.47Å; S186-E189 PolarHBondContact N-OE2 2.92Å; S186-E189 PolarHBondContact O-N 3.39Å; S186-E189 WeakPolarHBondContact OG-CB 3.26Å; S186-E189 VanDerWaalsContact OG-CD 3.24Å; S186-E189 WeakPolarHBondContact OG-CG 3.37Å; S186-E189 PolarHBondContact OG-N 3.19Å; S186-E189 PolarHBondContact OG-OE2 3.03Å; S186-L190 PolarHBondContact O-N 3.29Å
187	T	67	Low	68.4	Low	25 Å²	25	63.1 Å²	63.1	15%	0.153	33%	0.327	C	S	.	.	H	α-helix	trans	-56	-35.7	178.2	-42.4	0	0	0	0	111.6	L138 I141 R142 L190 V191	L138-T187 HydrophobicContact CD2-CG2 3.94Å; I141-T187 HydrophobicContact CG2-CG2 4.21Å; R142-T187 HydrophobicContact CB-CG2 4.24Å; T187-L190 WeakPolarHBondContact O-CB 3.45Å; T187-L190 PolarHBondContact O-N 3.13Å; T187-V191 VanDerWaalsContact O-CG2 3.31Å; T187-V191 WeakPolarHBondContact O-CG2 3.5Å; T187-V191 PolarHBondContact O-N 3.26Å
188	L	72.6	Confident	68.6	Low	114 Å²	114	64.8 Å²	64.8	60%	0.597	33%	0.334	S	S	*	.	H	α-helix	trans	-66.5	-44.8	175.3	-176.9	65.2	0	0	0	112.5	S186 L190 V191 K192	S186-L188 PolarHBondContact O-N 2.92Å; L188-L190 VanDerWaalsContact C-N 3.31Å; L188-V191 PolarHBondContact O-N 3.08Å; L188-K192 WeakPolarHBondContact O-CG 3.15Å; L188-K192 PolarHBondContact O-N 2.91Å
189	E	73.1	Confident	68.5	Low	55 Å²	55	62.3 Å²	62.3	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-39.3	175.4	-73.2	165.8	136.7	0	0	111.2	L177 L185 S186 V191 K192 V193	L177-E189 HydrophobicContact CD2-CB 4.12Å; L177-E189 HydrophobicContact CD2-CG 3.92Å; L185-E189 HydrophobicContact CB-CB 4.05Å; L185-E189 HydrophobicContact CD2-CB 3.96Å; L185-E189 HydrophobicContact CG-CB 4.12Å; S186-E189 WeakPolarHBondContact CB-OE2 3.47Å; S186-E189 PolarHBondContact N-OE2 2.92Å; S186-E189 PolarHBondContact O-N 3.39Å; S186-E189 WeakPolarHBondContact OG-CB 3.26Å; S186-E189 VanDerWaalsContact OG-CD 3.24Å; S186-E189 WeakPolarHBondContact OG-CG 3.37Å; S186-E189 PolarHBondContact OG-N 3.19Å; S186-E189 PolarHBondContact OG-OE2 3.03Å; E189-V191 PolarHBondContact O-N 3.42Å; E189-K192 PolarHBondContact O-N 3.3Å; E189-V193 WeakPolarHBondContact O-CG2 3.27Å; E189-V193 PolarHBondContact O-N 3.16Å
190	L	71.4	Confident	68.3	Low	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-45.8	176.8	-164.3	73.4	0	0	0	111.3	R142 L145 L146 M182 S186 T187 L188 V193 W194	R142-L190 HydrophobicContact CG-CD2 4.27Å; L145-L190 HydrophobicContact CB-CD2 3.79Å; L145-L190 HydrophobicContact CD1-CD2 4.07Å; L146-L190 HydrophobicContact CD2-CD1 4.45Å; L146-L190 HydrophobicContact CD2-CD2 4.25Å; L146-L190 HydrophobicContact CG-CD2 4.26Å; M182-L190 HydrophobicContact SD-CD1 3.39Å; M182-L190 WeakPolarHBondContact SD-CD1 3.44Å; S186-L190 PolarHBondContact O-N 3.29Å; T187-L190 WeakPolarHBondContact O-CB 3.45Å; T187-L190 PolarHBondContact O-N 3.13Å; L188-L190 VanDerWaalsContact C-N 3.31Å; L190-V193 PolarHBondContact O-N 2.97Å; L190-W194 PolarHBondContact O-N 3.23Å
191	V	70.6	Confident	68.1	Low	50 Å²	50	58.1 Å²	58.1	30%	0.303	30%	0.301	S	S	.	.	H	α-helix	trans	-61	-45.1	174.9	170.4	0	0	0	0	111.3	L145 T187 L188 E189 V193 W194 L195	L145-V191 HydrophobicContact CD1-CG2 3.49Å; L145-V191 VanDerWaalsContact CD1-CG2 3.49Å; T187-V191 VanDerWaalsContact O-CG2 3.31Å; T187-V191 WeakPolarHBondContact O-CG2 3.5Å; T187-V191 PolarHBondContact O-N 3.26Å; L188-V191 PolarHBondContact O-N 3.08Å; E189-V191 PolarHBondContact O-N 3.42Å; V191-V193 PolarHBondContact O-N 3.47Å; V191-W194 PolarHBondContact O-N 3.39Å; V191-L195 HydrophobicContact CG1-CD1 3.82Å; V191-L195 HydrophobicContact CG1-CG 4.4Å; V191-L195 WeakPolarHBondContact O-CG 3.44Å; V191-L195 PolarHBondContact O-N 3.31Å
192	K	71	Confident	68.2	Low	79 Å²	79	56.1 Å²	56.1	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-43.8	179.3	-73.3	-179.9	178.1	-175.6	0	112.3	L169 L188 E189 W194 L195 H196	L169-K192 HydrophobicContact CD1-CB 3.8Å; L169-K192 HydrophobicContact CG-CB 4.27Å; L188-K192 WeakPolarHBondContact O-CG 3.15Å; L188-K192 PolarHBondContact O-N 2.91Å; E189-K192 PolarHBondContact O-N 3.3Å; K192-W194 VanDerWaalsContact C-N 3.34Å; K192-L195 PolarHBondContact O-N 3Å; K192-H196 PolarHBondContact O-N 3.18Å
193	V	71.1	Confident	68.2	Low	1 Å²	1	54.6 Å²	54.6	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-44.3	176.8	170.9	0	0	0	0	110.6	F174 L177 M182 L185 E189 L190 V191 H196 R197	F174-V193 HydrophobicContact CE2-CG1 4.04Å; L177-V193 HydrophobicContact CB-CG2 3.65Å; L177-V193 HydrophobicContact CD1-CG2 4.14Å; L177-V193 HydrophobicContact CG-CG2 4.46Å; M182-V193 HydrophobicContact CE-CG1 4.03Å; L185-V193 HydrophobicContact CD2-CG2 3.82Å; E189-V193 WeakPolarHBondContact O-CG2 3.27Å; E189-V193 PolarHBondContact O-N 3.16Å; L190-V193 PolarHBondContact O-N 2.97Å; V191-V193 PolarHBondContact O-N 3.47Å; V193-H196 PolarHBondContact O-N 2.96Å; V193-R197 WeakPolarHBondContact O-CB 3.36Å; V193-R197 PolarHBondContact O-N 3.29Å
194	W	69.9	Low	67.9	Low	37 Å²	37	55 Å²	55	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-67.6	-41.5	179.1	-88.7	112.1	0	0	0	113.5	L149 L190 V191 K192 H196 R197 F198	L149-W194 HydrophobicContact CB-CH2 4.39Å; L149-W194 HydrophobicContact CB-CZ2 4.45Å; L149-W194 HydrophobicContact CD2-CB 4.45Å; L149-W194 HydrophobicContact CD2-CD2 3.83Å; L149-W194 HydrophobicContact CD2-CE3 3.63Å; L149-W194 HydrophobicContact CD2-CG 4.22Å; L149-W194 HydrophobicContact CD2-CZ3 4.08Å; L190-W194 PolarHBondContact O-N 3.23Å; V191-W194 PolarHBondContact O-N 3.39Å; K192-W194 VanDerWaalsContact C-N 3.34Å; W194-H196 VanDerWaalsContact C-N 3.34Å; W194-H196 PolarHBondContact O-N 3.03Å; W194-R197 PolarHBondContact O-N 2.99Å; W194-F198 WeakPolarHBondContact O-CB 3.47Å; W194-F198 PolarHBondContact O-N 3.44Å
195	L	67	Low	67.4	Low	80 Å²	80	51.6 Å²	51.6	42%	0.419	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-48.3	172.9	-77.5	166.2	0	0	0	110.4	V191 K192 R197 F198 F199	V191-L195 HydrophobicContact CG1-CD1 3.82Å; V191-L195 HydrophobicContact CG1-CG 4.4Å; V191-L195 WeakPolarHBondContact O-CG 3.44Å; V191-L195 PolarHBondContact O-N 3.31Å; K192-L195 PolarHBondContact O-N 3Å; L195-R197 VanDerWaalsContact C-N 3.31Å; L195-R197 PolarHBondContact O-N 2.98Å; L195-F198 PolarHBondContact O-N 3.47Å; L195-F199 HydrophobicContact CB-CD2 4.37Å; L195-F199 HydrophobicContact CB-CE2 4.35Å; L195-F199 HydrophobicContact CD2-CE2 3.89Å; L195-F199 WeakPolarHBondContact O-CB 3.49Å; L195-F199 WeakPolarHBondContact O-CD2 3.5Å; L195-F199 PolarHBondContact O-N 3.47Å
196	H	66.6	Low	66.9	Low	16 Å²	16	54.3 Å²	54.3	7%	0.074	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-37.8	177.7	-167.3	-50.7	0	0	0	111.9	S167 L169 F174 K192 V193 W194 S200	S167-H196 PolarHBondContact OG-CD2 2.95Å; L169-H196 HydrophobicContact CD1-CB 4.21Å; F174-H196 HydrophobicContact CD2-CB 3.81Å; F174-H196 AromaticContact CD2-CG 3.64Å; F174-H196 AromaticContact CD2-ND1 3.86Å; F174-H196 HydrophobicContact CE2-CB 4.12Å; K192-H196 PolarHBondContact O-N 3.18Å; V193-H196 PolarHBondContact O-N 2.96Å; W194-H196 VanDerWaalsContact C-N 3.34Å; W194-H196 PolarHBondContact O-N 3.03Å; H196-S200 PolarHBondContact CE1-OG 2.93Å; H196-S200 PolarHBondContact ND1-OG 3.5Å; H196-S200 VanDerWaalsContact O-CB 3.3Å; H196-S200 WeakPolarHBondContact O-CB 3.37Å; H196-S200 PolarHBondContact O-N 2.96Å; H196-S200 PolarHBondContact O-OG 3.41Å; H196-S200 VanDerWaalsContact O-OG 3.12Å
197	R	68	Low	66	Low	123 Å²	123	58 Å²	58	46%	0.464	29%	0.288	S	S	.	.	H	α-helix	trans	-67.9	-42	178.2	-152	174.4	-172.9	177.2	2.2	112	V193 W194 L195 F201	V193-R197 WeakPolarHBondContact O-CB 3.36Å; V193-R197 PolarHBondContact O-N 3.29Å; W194-R197 PolarHBondContact O-N 2.99Å; L195-R197 VanDerWaalsContact C-N 3.31Å; L195-R197 PolarHBondContact O-N 2.98Å; R197-F201 WeakPolarHBondContact O-CB 3.34Å; R197-F201 PolarHBondContact O-N 3.02Å
198	F	66	Low	65.3	Low	51 Å²	51	62.9 Å²	62.9	22%	0.224	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-46.9	175	177.2	-108.1	0	0	0	111.6	L153 I156 M158 W194 L195 F201 I202	L153-F198 HydrophobicContact CD1-CD2 4.3Å; L153-F198 HydrophobicContact CD2-CD2 3.58Å; L153-F198 HydrophobicContact CD2-CE2 3.29Å; I156-F198 HydrophobicContact CD1-CE2 4.18Å; I156-F198 HydrophobicContact CD1-CZ 4.18Å; M158-F198 HydrophobicContact CE-CE1 4.47Å; M158-F198 HydrophobicContact CE-CZ 4.05Å; W194-F198 WeakPolarHBondContact O-CB 3.47Å; W194-F198 PolarHBondContact O-N 3.44Å; L195-F198 PolarHBondContact O-N 3.47Å; F198-F201 PolarHBondContact O-N 3.42Å; F198-I202 HydrophobicContact CD1-CD1 3.71Å; F198-I202 HydrophobicContact CD2-CD1 4.25Å; F198-I202 HydrophobicContact CE1-CD1 3.3Å; F198-I202 HydrophobicContact CE2-CD1 3.85Å; F198-I202 HydrophobicContact CE2-CG1 4.49Å; F198-I202 HydrophobicContact CG-CD1 4.19Å; F198-I202 HydrophobicContact CZ-CD1 3.4Å; F198-I202 VanDerWaalsContact CZ-CD1 3.4Å; F198-I202 HydrophobicContact CZ-CG1 4.46Å; F198-I202 WeakPolarHBondContact O-CG1 3.41Å; F198-I202 PolarHBondContact O-N 3.36Å
199	F	64.3	Low	64.5	Low	15 Å²	15	61.6 Å²	61.6	7%	0.066	31%	0.305	C	S	.	.	H	α-helix	trans	-68.5	-37	177.7	-74.2	-62.4	0	0	0	113.2	I161 I163 Y166 L195 I202 S203	I161-F199 HydrophobicContact CD1-CE1 4.31Å; I161-F199 HydrophobicContact CG2-CD1 3.32Å; I161-F199 HydrophobicContact CG2-CE1 3.33Å; I163-F199 HydrophobicContact CG2-CB 4.38Å; Y166-F199 AromaticContact CD1-CZ 3.96Å; Y166-F199 HydrophobicContact CD1-CZ 3.96Å; Y166-F199 HydrophobicContact CD2-CE1 4.16Å; Y166-F199 HydrophobicContact CD2-CZ 4.32Å; Y166-F199 AromaticContact CG-CE1 3.92Å; Y166-F199 HydrophobicContact CG-CE1 3.92Å; Y166-F199 HydrophobicContact CG-CE2 4.17Å; Y166-F199 AromaticContact CG-CZ 3.62Å; Y166-F199 HydrophobicContact CG-CZ 3.62Å; L195-F199 HydrophobicContact CB-CD2 4.37Å; L195-F199 HydrophobicContact CB-CE2 4.35Å; L195-F199 HydrophobicContact CD2-CE2 3.89Å; L195-F199 WeakPolarHBondContact O-CB 3.49Å; L195-F199 WeakPolarHBondContact O-CD2 3.5Å; L195-F199 PolarHBondContact O-N 3.47Å; F199-I202 PolarHBondContact O-N 3.18Å; F199-S203 PolarHBondContact O-N 2.85Å
200	S	63.3	Low	63.5	Low	47 Å²	47	65.7 Å²	65.7	33%	0.329	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-44.7	171.6	-75.5	0	0	0	0	111.6	H196 S203 E204	H196-S200 PolarHBondContact CE1-OG 2.93Å; H196-S200 PolarHBondContact ND1-OG 3.5Å; H196-S200 VanDerWaalsContact O-CB 3.3Å; H196-S200 WeakPolarHBondContact O-CB 3.37Å; H196-S200 PolarHBondContact O-N 2.96Å; H196-S200 PolarHBondContact O-OG 3.41Å; H196-S200 VanDerWaalsContact O-OG 3.12Å; S200-S203 VanDerWaalsContact O-CB 3.3Å; S200-S203 WeakPolarHBondContact O-CB 3.36Å; S200-S203 PolarHBondContact O-N 3.23Å; S200-E204 PolarHBondContact O-N 2.93Å
201	F	63.8	Low	62.4	Low	106 Å²	106	72 Å²	72	47%	0.465	35%	0.35	S	S	.	.	H	α-helix	trans	-60.9	-45.8	176.7	-179.1	-101.1	0	0	0	111.5	R197 F198 S203 E204 V205	R197-F201 WeakPolarHBondContact O-CB 3.34Å; R197-F201 PolarHBondContact O-N 3.02Å; F198-F201 PolarHBondContact O-N 3.42Å; F201-S203 VanDerWaalsContact C-N 3.29Å; F201-S203 PolarHBondContact O-N 3.41Å; F201-E204 PolarHBondContact O-N 3.33Å; F201-E204 VanDerWaalsContact O-N 3.09Å; F201-V205 HydrophobicContact CD1-CG2 4.26Å; F201-V205 HydrophobicContact CE1-CG2 3.88Å; F201-V205 HydrophobicContact CE2-CG2 4.28Å; F201-V205 HydrophobicContact CZ-CG2 3.9Å; F201-V205 WeakPolarHBondContact O-CG2 3.4Å; F201-V205 PolarHBondContact O-N 3.22Å
202	I	63.6	Low	61.3	Low	17 Å²	17	72.2 Å²	72.2	9%	0.087	35%	0.353	C	S	.	.	H	α-helix	trans	-58.4	-41.9	174.6	-72.1	168.5	0	0	0	111.4	M158 I161 F198 F199 E204 S206	M158-I202 HydrophobicContact CB-CG2 4.4Å; M158-I202 HydrophobicContact CE-CD1 3.79Å; I161-I202 HydrophobicContact CB-CG2 4.21Å; I161-I202 HydrophobicContact CD1-CD1 4Å; I161-I202 HydrophobicContact CG2-CG2 4.42Å; F198-I202 HydrophobicContact CD1-CD1 3.71Å; F198-I202 HydrophobicContact CD2-CD1 4.25Å; F198-I202 HydrophobicContact CE1-CD1 3.3Å; F198-I202 HydrophobicContact CE2-CD1 3.85Å; F198-I202 HydrophobicContact CE2-CG1 4.49Å; F198-I202 HydrophobicContact CG-CD1 4.19Å; F198-I202 HydrophobicContact CZ-CD1 3.4Å; F198-I202 VanDerWaalsContact CZ-CD1 3.4Å; F198-I202 HydrophobicContact CZ-CG1 4.46Å; F198-I202 WeakPolarHBondContact O-CG1 3.41Å; F198-I202 PolarHBondContact O-N 3.36Å; F199-I202 PolarHBondContact O-N 3.18Å; I202-E204 VanDerWaalsContact C-N 3.28Å; I202-E204 PolarHBondContact O-N 2.85Å; I202-S206 VanDerWaalsContact O-CB 3.26Å; I202-S206 WeakPolarHBondContact O-CB 3.5Å; I202-S206 PolarHBondContact O-N 3.16Å
203	S	62	Low	60	Low	23 Å²	23	76.1 Å²	76.1	16%	0.161	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-40.2	175.7	-175.1	0	0	0	0	112.8	I163 F199 S200 F201 K207	I163-S203 WeakPolarHBondContact CD1-OG 3.39Å; F199-S203 PolarHBondContact O-N 2.85Å; S200-S203 VanDerWaalsContact O-CB 3.3Å; S200-S203 WeakPolarHBondContact O-CB 3.36Å; S200-S203 PolarHBondContact O-N 3.23Å; F201-S203 VanDerWaalsContact C-N 3.29Å; F201-S203 PolarHBondContact O-N 3.41Å; S203-K207 WeakPolarHBondContact O-CG 3.22Å; S203-K207 PolarHBondContact O-N 2.84Å
204	E	60.3	Low	58.9	Low	127 Å²	127	83.3 Å²	83.3	59%	0.593	40%	0.402	S	S	*	.	H	α-helix	trans	-72.7	-41.6	-174.5	-146.2	157.5	-154.4	0	0	110.4	S200 F201 I202 K207 L208	S200-E204 PolarHBondContact O-N 2.93Å; F201-E204 PolarHBondContact O-N 3.33Å; F201-E204 VanDerWaalsContact O-N 3.09Å; I202-E204 VanDerWaalsContact C-N 3.28Å; I202-E204 PolarHBondContact O-N 2.85Å; E204-K207 PolarHBondContact O-N 3.05Å; E204-L208 PolarHBondContact O-N 3.09Å
205	V	60.6	Low	57.6	Low	58 Å²	58	88.4 Å²	88.4	35%	0.352	42%	0.422	S	S	.	.	H	α-helix	trans	-64.1	-43.4	171.9	177.2	0	0	0	0	111.2	F201 K207 L208 I209	F201-V205 HydrophobicContact CD1-CG2 4.26Å; F201-V205 HydrophobicContact CE1-CG2 3.88Å; F201-V205 HydrophobicContact CE2-CG2 4.28Å; F201-V205 HydrophobicContact CZ-CG2 3.9Å; F201-V205 WeakPolarHBondContact O-CG2 3.4Å; F201-V205 PolarHBondContact O-N 3.22Å; V205-K207 VanDerWaalsContact C-N 3.33Å; V205-K207 PolarHBondContact O-N 3.08Å; V205-L208 WeakPolarHBondContact O-CB 3.48Å; V205-L208 PolarHBondContact O-N 3.39Å; V205-L208 VanDerWaalsContact O-N 3.13Å; V205-I209 HydrophobicContact CG1-CD1 3.85Å; V205-I209 HydrophobicContact CG1-CG1 4.45Å; V205-I209 WeakPolarHBondContact O-CG1 3.4Å; V205-I209 PolarHBondContact O-N 2.71Å
206	S	57.5	Low	56.2	Low	62 Å²	62	90.8 Å²	90.8	43%	0.434	43%	0.429	S	S	.	.	H	α-helix	trans	-58.6	-43.1	174.8	176.3	0	0	0	0	111.8	I202 I209 F210	I202-S206 VanDerWaalsContact O-CB 3.26Å; I202-S206 WeakPolarHBondContact O-CB 3.5Å; I202-S206 PolarHBondContact O-N 3.16Å; S206-I209 PolarHBondContact O-N 2.76Å; S206-F210 VanDerWaalsContact O-CB 3.32Å; S206-F210 WeakPolarHBondContact O-CB 3.43Å; S206-F210 PolarHBondContact O-N 3.19Å
207	K	56.1	Low	54.8	Low	133 Å²	133	95.2 Å²	95.2	58%	0.578	46%	0.459	S	S	*	.	H	α-helix	trans	-63.5	-41.7	173.8	-76.6	174.9	-176.5	172.7	0	112	S203 E204 V205 F210 F211	S203-K207 WeakPolarHBondContact O-CG 3.22Å; S203-K207 PolarHBondContact O-N 2.84Å; E204-K207 PolarHBondContact O-N 3.05Å; V205-K207 VanDerWaalsContact C-N 3.33Å; V205-K207 PolarHBondContact O-N 3.08Å; K207-F210 PolarHBondContact O-N 3.09Å; K207-F211 WeakPolarHBondContact O-CB 3.34Å; K207-F211 WeakPolarHBondContact O-CD2 3.36Å; K207-F211 PolarHBondContact O-N 3.29Å
208	L	53.9	Low	53.5	Low	126 Å²	126	95.8 Å²	95.8	66%	0.66	47%	0.47	S	S	*	.	H	α-helix	trans	-63.4	-42.2	178.4	-112.9	125.6	0	0	0	112.2	E204 V205 F211 S212	E204-L208 PolarHBondContact O-N 3.09Å; V205-L208 WeakPolarHBondContact O-CB 3.48Å; V205-L208 PolarHBondContact O-N 3.39Å; V205-L208 VanDerWaalsContact O-N 3.13Å; L208-F211 PolarHBondContact O-N 3.35Å; L208-S212 WeakPolarHBondContact O-CB 3.43Å; L208-S212 PolarHBondContact O-N 3.49Å
209	I	55.2	Low	51.9	Low	88 Å²	88	98 Å²	98	45%	0.451	49%	0.491	S	S	.	.	H	α-helix	trans	-70.6	-37.3	176.5	-66.9	169.8	0	0	0	111.1	V205 S206 S212 K213	V205-I209 HydrophobicContact CG1-CD1 3.85Å; V205-I209 HydrophobicContact CG1-CG1 4.45Å; V205-I209 WeakPolarHBondContact O-CG1 3.4Å; V205-I209 PolarHBondContact O-N 2.71Å; S206-I209 PolarHBondContact O-N 2.76Å; I209-S212 WeakPolarHBondContact CA-OG 3.43Å; I209-S212 PolarHBondContact O-N 3.27Å; I209-S212 PolarHBondContact O-OG 3.24Å; I209-K213 PolarHBondContact O-N 3.45Å
210	F	52.1	Low	50.5	Low	140 Å²	140	102.9 Å²	102.9	61%	0.614	52%	0.517	S	S	*	.	H	α-helix	trans	-67.2	-39.4	175.2	-160.4	-91.1	0	0	0	111.8	S206 K207 K214	S206-F210 VanDerWaalsContact O-CB 3.32Å; S206-F210 WeakPolarHBondContact O-CB 3.43Å; S206-F210 PolarHBondContact O-N 3.19Å; K207-F210 PolarHBondContact O-N 3.09Å; F210-K214 HydrophobicContact CE1-CD 4.21Å; F210-K214 WeakPolarHBondContact O-CB 3.4Å; F210-K214 PolarHBondContact O-N 2.98Å
211	F	48.7	Very low	49.1	Very low	133 Å²	133	108 Å²	108	58%	0.583	54%	0.539	S	S	*	.	H	α-helix	trans	-65.1	-42.5	171.9	-101.3	-84.8	0	0	0	111.7	K207 L208 K214 Y215	K207-F211 WeakPolarHBondContact O-CB 3.34Å; K207-F211 WeakPolarHBondContact O-CD2 3.36Å; K207-F211 PolarHBondContact O-N 3.29Å; L208-F211 PolarHBondContact O-N 3.35Å; F211-K214 PolarHBondContact O-N 3.5Å; F211-Y215 AromaticContact CD1-CD2 3.63Å; F211-Y215 HydrophobicContact CD1-CD2 3.63Å; F211-Y215 AromaticContact CD1-CE2 3.71Å; F211-Y215 HydrophobicContact CD1-CE2 3.71Å; F211-Y215 HydrophobicContact CE1-CD2 4.05Å; F211-Y215 AromaticContact CE1-CE2 3.62Å; F211-Y215 HydrophobicContact CE1-CE2 3.62Å; F211-Y215 PolarHBondContact O-N 2.86Å
212	S	47.1	Very low	47.7	Very low	54 Å²	54	110.7 Å²	110.7	38%	0.378	55%	0.553	S	S	.	*	H	α-helix	trans	-61.6	-47.1	178.3	79.4	0	0	0	0	110	L208 I209 K214 F216	L208-S212 WeakPolarHBondContact O-CB 3.43Å; L208-S212 PolarHBondContact O-N 3.49Å; I209-S212 WeakPolarHBondContact CA-OG 3.43Å; I209-S212 PolarHBondContact O-N 3.27Å; I209-S212 PolarHBondContact O-OG 3.24Å; S212-K214 PolarHBondContact O-N 2.98Å; S212-F216 VanDerWaalsContact O-CA 3.28Å; S212-F216 WeakPolarHBondContact O-CA 3.34Å; S212-F216 WeakPolarHBondContact O-CB 3.29Å; S212-F216 PolarHBondContact O-N 3.36Å
213	K	43.9	Very low	46.2	Very low	162 Å²	162	117 Å²	117	70%	0.704	59%	0.587	S	S	*	*	H	α-helix	trans	-64.5	-38.7	176.8	-91	-177.6	176.1	171.2	0	113.9	I209	I209-K213 PolarHBondContact O-N 3.45Å
214	K	46.9	Very low	44.8	Very low	152 Å²	152	124.7 Å²	124.7	66%	0.661	61%	0.613	S	S	*	*	H	α-helix	trans	-78.9	-28.3	-175.6	-152.2	173.3	-176.8	179.3	0	113.3	F210 F211 S212	F210-K214 HydrophobicContact CE1-CD 4.21Å; F210-K214 WeakPolarHBondContact O-CB 3.4Å; F210-K214 PolarHBondContact O-N 2.98Å; F211-K214 PolarHBondContact O-N 3.5Å; S212-K214 PolarHBondContact O-N 2.98Å
215	Y	42.7	Very low	43.6	Very low	144 Å²	144	124.5 Å²	124.5	57%	0.565	62%	0.623	S	S	*	*	H	α-helix	trans	-104.9	-3.5	176.5	-72.3	-85.5	0	0	0	114.1	F211 P217 I218	F211-Y215 AromaticContact CD1-CD2 3.63Å; F211-Y215 HydrophobicContact CD1-CD2 3.63Å; F211-Y215 AromaticContact CD1-CE2 3.71Å; F211-Y215 HydrophobicContact CD1-CE2 3.71Å; F211-Y215 HydrophobicContact CE1-CD2 4.05Å; F211-Y215 AromaticContact CE1-CE2 3.62Å; F211-Y215 HydrophobicContact CE1-CE2 3.62Å; F211-Y215 PolarHBondContact O-N 2.86Å; Y215-P217 VanDerWaalsContact C-N 3.3Å; Y215-I218 PolarHBondContact O-N 3.42Å
216	F	38.9	Very low	42.7	Very low	129 Å²	129	125.2 Å²	125.2	57%	0.566	63%	0.63	S	S	*	*	H	α-helix	trans	-55.9	-33.4	177.5	-135.5	-118.2	0	0	0	114.9	S212 I218 I220	S212-F216 VanDerWaalsContact O-CA 3.28Å; S212-F216 WeakPolarHBondContact O-CA 3.34Å; S212-F216 WeakPolarHBondContact O-CB 3.29Å; S212-F216 PolarHBondContact O-N 3.36Å; F216-I218 PolarHBondContact O-N 2.92Å; F216-I220 HydrophobicContact CD1-CD1 3.74Å; F216-I220 HydrophobicContact CD2-CD1 4.17Å; F216-I220 HydrophobicContact CE1-CD1 3.24Å; F216-I220 HydrophobicContact CE2-CD1 3.7Å; F216-I220 HydrophobicContact CG-CD1 4.19Å; F216-I220 HydrophobicContact CZ-CD1 3.23Å
217	P	37.1	Very low	41.7	Very low	110 Å²	110	128.6 Å²	128.6	71%	0.714	64%	0.643	S	S	*	*	H	α-helix	trans	-72.4	-9.3	-176.7	-17.5	30.7	0	0	0	114.4	Y215	Y215-P217 VanDerWaalsContact C-N 3.3Å
218	I	39.9	Very low	40.8	Very low	134 Å²	134	130.8 Å²	130.8	69%	0.687	65%	0.653	S	S	*	*	H	α-helix	trans	-109.4	-25.6	-168	-62.4	176.3	0	0	0	114.3	Y215 F216	Y215-I218 PolarHBondContact O-N 3.42Å; F216-I218 PolarHBondContact O-N 2.92Å
219	C	32.3	Very low	40.2	Very low	99 Å²	99	128.3 Å²	128.3	67%	0.669	65%	0.646	S	S	*	*	H	α-helix	trans	-105.5	-4.3	-171.8	-67.3	0	0	0	0	116.7	L221	C219-L221 PolarHBondContact O-N 2.87Å
220	I	35.5	Very low	39.4	Very low	117 Å²	117	129.5 Å²	129.5	60%	0.6	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-11.4	-176.4	-69.1	178.2	0	0	0	114	F216 H222	F216-I220 HydrophobicContact CD1-CD1 3.74Å; F216-I220 HydrophobicContact CD2-CD1 4.17Å; F216-I220 HydrophobicContact CE1-CD1 3.24Å; F216-I220 HydrophobicContact CE2-CD1 3.7Å; F216-I220 HydrophobicContact CG-CD1 4.19Å; F216-I220 HydrophobicContact CZ-CD1 3.23Å; I220-H222 VanDerWaalsContact C-N 3.34Å; I220-H222 PolarHBondContact O-N 3.04Å
221	L	33.5	Very low	38.7	Very low	154 Å²	154	129.8 Å²	129.8	81%	0.806	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-14.6	177.2	-100	155.1	0	0	0	114.7	C219	C219-L221 PolarHBondContact O-N 2.87Å
222	H	33.2	Very low	38.2	Very low	162 Å²	162	126.6 Å²	126.6	75%	0.75	65%	0.649	S	S	*	*	S	Bend	trans	-152.1	84.5	179.7	-78.8	-73.6	0	0	0	112.2	I220	I220-H222 VanDerWaalsContact C-N 3.34Å; I220-H222 PolarHBondContact O-N 3.04Å
223	L	32.4	Very low	37.9	Very low	151 Å²	151	126.6 Å²	126.6	79%	0.791	65%	0.652	S	S	*	*	S	Bend	trans	177	109.7	132.6	-112.2	64.8	0	0	0	111
224	Y	32.2	Very low	37.8	Very low	183 Å²	183	126.5 Å²	126.5	72%	0.718	65%	0.649	S	S	*	*			trans	50.4	110.1	154.8	-68	-79.5	0	0	0	121.8	S226	Y224-S226 PolarHBondContact O-N 3.43Å
225	P	36.9	Very low	37.2	Very low	124 Å²	124	124.8 Å²	124.8	81%	0.805	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	1.4	167.1	-17.8	31.7	0	0	0	116.4	L227	P225-L227 PolarHBondContact O-N 2.95Å
226	S	39.9	Very low	37.1	Very low	72 Å²	72	123.4 Å²	123.4	50%	0.503	64%	0.642	S	S	.	*	H	α-helix	trans	-81.5	-6.6	-171.4	51	0	0	0	0	115.3	Y224	Y224-S226 PolarHBondContact O-N 3.43Å
227	L	37.1	Very low	37.2	Very low	134 Å²	134	124.5 Å²	124.5	70%	0.702	65%	0.649	S	S	*	*	H	α-helix	trans	-86.9	-19.2	175.6	-80.3	161.5	0	0	0	113.5	P225 F231	P225-L227 PolarHBondContact O-N 2.95Å; L227-F231 PolarHBondContact O-N 3.06Å
228	F	38.3	Very low	37.2	Very low	178 Å²	178	123.2 Å²	123.2	78%	0.781	64%	0.637	S	S	*	*	H	α-helix	trans	-77.5	-30.5	-176.9	-145.6	-96.5	0	0	0	113	S232	F228-S232 PolarHBondContact O-N 3.29Å
229	S	39.7	Very low	37	Very low	74 Å²	74	124.4 Å²	124.4	52%	0.517	64%	0.637	S	S	.	*	H	α-helix	trans	-74.7	-33.2	178.6	68.1	0	0	0	0	113.1	F231 A233	S229-F231 VanDerWaalsContact C-N 3.31Å; S229-A233 PolarHBondContact O-N 2.98Å
230	N	38.2	Very low	37.2	Very low	113 Å²	113	125.7 Å²	125.7	60%	0.604	64%	0.637	S	S	*	*	H	α-helix	trans	-73.3	-26.3	177	-77.5	-14.2	0	0	0	112.2	Y234	N230-Y234 PolarHBondContact O-N 3.03Å
231	F	39.3	Very low	37.2	Very low	146 Å²	146	128.3 Å²	128.3	64%	0.64	65%	0.647	S	S	*	*	H	α-helix	trans	-72.9	-37.4	177.1	-129.3	-93	0	0	0	112.4	L227 S229 F235	L227-F231 PolarHBondContact O-N 3.06Å; S229-F231 VanDerWaalsContact C-N 3.31Å; F231-F235 HydrophobicContact CD1-CD2 4.48Å; F231-F235 HydrophobicContact CE1-CE2 4.45Å; F231-F235 PolarHBondContact O-N 2.99Å
232	S	38	Very low	37.3	Very low	66 Å²	66	127.7 Å²	127.7	46%	0.462	64%	0.644	S	S	.	*	H	α-helix	trans	-73.2	-33.6	177.2	90.2	0	0	0	0	112.6	F228 F235 I236	F228-S232 PolarHBondContact O-N 3.29Å; S232-F235 PolarHBondContact O-N 3.5Å; S232-I236 WeakPolarHBondContact O-CG1 3.49Å; S232-I236 PolarHBondContact O-N 3.19Å; S232-I236 VanDerWaalsContact O-N 3.11Å
233	A	41	Very low	37.3	Very low	55 Å²	55	125.9 Å²	125.9	46%	0.455	64%	0.64	S	S	.	*	H	α-helix	trans	-68.1	-40.5	178	0	0	0	0	0	112.1	S229 F235 Q237	S229-A233 PolarHBondContact O-N 2.98Å; A233-F235 VanDerWaalsContact C-N 3.34Å; A233-F235 PolarHBondContact O-N 3.42Å; A233-Q237 PolarHBondContact O-N 3.28Å
234	Y	40	Very low	37.5	Very low	160 Å²	160	124.8 Å²	124.8	63%	0.627	63%	0.634	S	S	*	*	H	α-helix	trans	-68.1	-33.7	177.3	-165.9	-100.9	0	0	0	112.4	N230 N238	N230-Y234 PolarHBondContact O-N 3.03Å; Y234-N238 WeakPolarHBondContact CE1-ND2 3.42Å; Y234-N238 PolarHBondContact O-N 3.34Å
235	F	35.2	Very low	37.7	Very low	116 Å²	116	123.4 Å²	123.4	51%	0.509	64%	0.639	S	S	.	*	H	α-helix	trans	-73.5	-37	177.5	-115.7	-88.3	0	0	0	113.4	F231 S232 A233 F239	F231-F235 HydrophobicContact CD1-CD2 4.48Å; F231-F235 HydrophobicContact CE1-CE2 4.45Å; F231-F235 PolarHBondContact O-N 2.99Å; S232-F235 PolarHBondContact O-N 3.5Å; A233-F235 VanDerWaalsContact C-N 3.34Å; A233-F235 PolarHBondContact O-N 3.42Å; F235-F239 PolarHBondContact O-N 3.45Å
236	I	40.7	Very low	37.6	Very low	114 Å²	114	124 Å²	124	59%	0.585	64%	0.635	S	S	*	*	H	α-helix	trans	-73.3	-33.4	180	-66.5	173.1	0	0	0	111.2	S232 F239	S232-I236 WeakPolarHBondContact O-CG1 3.49Å; S232-I236 PolarHBondContact O-N 3.19Å; S232-I236 VanDerWaalsContact O-N 3.11Å; I236-F239 PolarHBondContact O-N 2.9Å
237	Q	39.9	Very low	37.4	Very low	152 Å²	152	128.6 Å²	128.6	71%	0.71	65%	0.649	S	S	*	*	H	α-helix	trans	-70.5	-32.7	179	-161.4	168.2	11.4	0	0	112.7	A233	A233-Q237 PolarHBondContact O-N 3.28Å
238	N	37.8	Very low	37.2	Very low	84 Å²	84	129 Å²	129	45%	0.449	65%	0.652	S	S	.	*	H	α-helix	trans	-81.3	-17.3	177.9	-78.9	-26.8	0	0	0	114.4	Y234	Y234-N238 WeakPolarHBondContact CE1-ND2 3.42Å; Y234-N238 PolarHBondContact O-N 3.34Å
239	F	35.3	Very low	37	Very low	158 Å²	158	125.6 Å²	125.6	69%	0.693	65%	0.65	S	S	*	*	H	α-helix	trans	-80.2	-25.7	174.3	-112.3	-86.2	0	0	0	113.5	F235 I236	F235-F239 PolarHBondContact O-N 3.45Å; I236-F239 PolarHBondContact O-N 2.9Å
240	N	37.6	Very low	36.7	Very low	127 Å²	127	128.8 Å²	128.8	68%	0.679	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-2.4	-179.8	-95.3	-14.3	0	0	0	115
241	H	35.2	Very low	36.6	Very low	172 Å²	172	131 Å²	131	80%	0.796	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	1.2	177.1	-112.3	45.3	0	0	0	115.3
242	N	34.5	Very low	36.3	Very low	141 Å²	141	132 Å²	132	75%	0.754	68%	0.678	S	S	*	*			trans	-109.1	13.3	-179.9	-75.9	-29.5	0	0	0	114.7	I244	N242-I244 PolarHBondContact O-N 2.94Å
243	N	33.2	Very low	36.3	Very low	123 Å²	123	134.6 Å²	134.6	66%	0.658	69%	0.691	S	S	*	*	S	Bend	trans	-86.5	99.2	170.5	-93.1	-18.2	0	0	0	111.5
244	I	38.1	Very low	35.8	Very low	129 Å²	129	140.9 Å²	140.9	66%	0.662	71%	0.711	S	S	*	*			trans	60.5	70.9	137.3	-44.7	170.4	0	0	0	114.8	N242 N246	N242-I244 PolarHBondContact O-N 2.94Å; I244-N246 VanDerWaalsContact C-N 3.3Å; I244-N246 HydrophobicContact CG2-CB 3.79Å; I244-N246 PolarHBondContact O-N 3.44Å
245	N	36.5	Very low	35.5	Very low	153 Å²	153	144.5 Å²	144.5	82%	0.818	72%	0.723	S	S	*	*			trans	-90.4	81.9	141.7	-79	-7.9	0	0	0	107.3	E247	N245-E247 PolarHBondContact O-N 3.22Å
246	N	33.1	Very low	35.6	Very low	138 Å²	138	148.2 Å²	148.2	74%	0.738	74%	0.739	S	S	*	*			trans	-75.5	65.4	166.5	-167.9	23.7	0	0	0	108	I244 N248	I244-N246 VanDerWaalsContact C-N 3.3Å; I244-N246 HydrophobicContact CG2-CB 3.79Å; I244-N246 PolarHBondContact O-N 3.44Å; N246-N248 PolarHBondContact O-N 3.11Å
247	E	35.7	Very low	35.1	Very low	167 Å²	167	151.4 Å²	151.4	78%	0.78	75%	0.751	S	S	*	*			trans	-89.2	101.6	168.8	-78.3	-167.9	164.9	0	0	108.5	N245 S249	N245-E247 PolarHBondContact O-N 3.22Å; E247-S249 PolarHBondContact O-N 2.87Å
248	N	33.6	Very low	34.6	Very low	144 Å²	144	148.8 Å²	148.8	77%	0.77	75%	0.745	S	S	*	*			trans	3.5	76.6	145.9	-65.9	-25.3	0	0	0	115.4	N246 N250	N246-N248 PolarHBondContact O-N 3.11Å; N248-N250 PolarHBondContact O-N 3.31Å
249	S	33.8	Very low	34.3	Very low	106 Å²	106	153.1 Å²	153.1	74%	0.741	76%	0.763	S	S	*	*			trans	-78.1	86.3	161.7	62.6	0	0	0	0	107.3	E247 I251	E247-S249 PolarHBondContact O-N 2.87Å; S249-I251 PolarHBondContact O-N 3.49Å; S249-I251 VanDerWaalsContact O-N 3.1Å
250	N	33.7	Very low	34.1	Very low	141 Å²	141	154.2 Å²	154.2	75%	0.754	77%	0.768	S	S	*	*			trans	-48.8	117	156.8	-79.1	-34.7	0	0	0	107.1	N248 E252	N248-N250 PolarHBondContact O-N 3.31Å; N250-E252 PolarHBondContact O-N 2.87Å
251	I	36	Very low	33.7	Very low	159 Å²	159	154.1 Å²	154.1	82%	0.815	77%	0.772	S	S	*	*			trans	-70.3	79.5	169.4	-62.4	171.3	0	0	0	105.6	S249 T253	S249-I251 PolarHBondContact O-N 3.49Å; S249-I251 VanDerWaalsContact O-N 3.1Å; I251-T253 PolarHBondContact O-N 2.87Å
252	E	33	Very low	33.4	Very low	166 Å²	166	153 Å²	153	78%	0.776	77%	0.772	S	S	*	*			trans	-70.9	109.6	163.1	-109.3	175.1	169.2	0	0	107	N250 H254	N250-E252 PolarHBondContact O-N 2.87Å; E252-H254 PolarHBondContact O-N 2.89Å
253	T	38.1	Very low	33.3	Very low	122 Å²	122	151.9 Å²	151.9	75%	0.748	77%	0.77	S	S	*	*			trans	-51.4	113.5	175.6	47.4	0	0	0	0	110.4	I251 R255	I251-T253 PolarHBondContact O-N 2.87Å; T253-R255 VanDerWaalsContact C-N 3.27Å; T253-R255 PolarHBondContact O-N 3.42Å
254	H	31.5	Very low	33.2	Very low	187 Å²	187	151.9 Å²	151.9	87%	0.866	78%	0.775	S	S	*	*			trans	-60.2	82.8	169.7	-70.1	-73	0	0	0	111.4	E252 K256	E252-H254 PolarHBondContact O-N 2.89Å; H254-K256 PolarHBondContact O-N 2.92Å
255	R	32.3	Very low	33	Very low	235 Å²	235	153.3 Å²	153.3	89%	0.887	78%	0.783	S	S	*	*			trans	-77.6	108	153.9	-93	-174.5	-171.7	151.9	4.3	107.5	T253 H257	T253-R255 VanDerWaalsContact C-N 3.27Å; T253-R255 PolarHBondContact O-N 3.42Å; R255-H257 PolarHBondContact O-N 2.95Å
256	K	37.1	Very low	32.7	Very low	195 Å²	195	153.7 Å²	153.7	85%	0.848	78%	0.784	S	S	*	*			trans	-59.5	100.1	170.4	-69	178.4	177.1	177.9	0	109.1	H254 V258	H254-K256 PolarHBondContact O-N 2.92Å; K256-V258 PolarHBondContact O-N 2.93Å
257	H	30.6	Very low	32.7	Very low	180 Å²	180	155.5 Å²	155.5	83%	0.833	79%	0.793	S	S	*	*			trans	-84	92.6	168.4	-142.8	-17.6	0	0	0	107	R255 Q259	R255-H257 PolarHBondContact O-N 2.95Å; H257-Q259 PolarHBondContact O-N 3.39Å
258	V	30.8	Very low	32.3	Very low	97 Å²	97	152.9 Å²	152.9	59%	0.588	79%	0.793	S	S	*	*			trans	-76.2	103.2	171.2	178.5	0	0	0	0	106.9	K256 F260	K256-V258 PolarHBondContact O-N 2.93Å; V258-F260 HydrophobicContact CB-CE2 4.36Å; V258-F260 HydrophobicContact CG1-CD2 4.1Å; V258-F260 HydrophobicContact CG1-CE2 3.65Å; V258-F260 HydrophobicContact CG1-CZ 3.96Å; V258-F260 PolarHBondContact O-N 3.19Å
259	Q	30.6	Very low	32.2	Very low	175 Å²	175	151.2 Å²	151.2	82%	0.818	79%	0.79	S	S	*	*			trans	-67.2	115.4	166.9	-81.5	176.2	-32.1	0	0	108.5	H257	H257-Q259 PolarHBondContact O-N 3.39Å
260	F	31.5	Very low	32	Very low	181 Å²	181	154 Å²	154	79%	0.794	80%	0.796	S	S	*	*			trans	-89.3	117.8	160.6	-74.5	-84	0	0	0	107.3	V258 D262	V258-F260 HydrophobicContact CB-CE2 4.36Å; V258-F260 HydrophobicContact CG1-CD2 4.1Å; V258-F260 HydrophobicContact CG1-CE2 3.65Å; V258-F260 HydrophobicContact CG1-CZ 3.96Å; V258-F260 PolarHBondContact O-N 3.19Å; F260-D262 PolarHBondContact O-N 3.24Å
261	V	29.9	Very low	32	Very low	125 Å²	125	153 Å²	153	76%	0.758	80%	0.801	S	S	*	*			trans	-72.1	117.3	177.2	171.8	0	0	0	0	108.4	T263	V261-T263 PolarHBondContact O-N 3.39Å; V261-T263 VanDerWaalsContact O-N 3.14Å
262	D	28.1	Very low	31.7	Very low	149 Å²	149	150.5 Å²	150.5	80%	0.797	80%	0.797	S	S	*	*			trans	-59.7	107.7	173.2	-68.8	-46.8	0	0	0	110.6	F260	F260-D262 PolarHBondContact O-N 3.24Å
263	T	32.8	Very low	31.5	Very low	117 Å²	117	150.6 Å²	150.6	72%	0.718	80%	0.802	S	S	*	*			trans	-105.5	88.6	163	-49	0	0	0	0	108.1	V261 L265	V261-T263 PolarHBondContact O-N 3.39Å; V261-T263 VanDerWaalsContact O-N 3.14Å; T263-L265 PolarHBondContact O-N 3.14Å
264	T	30.5	Very low	31.2	Very low	124 Å²	124	148.9 Å²	148.9	76%	0.761	80%	0.795	S	S	*	*			trans	-66.6	99.1	167.3	28.4	0	0	0	0	109.7
265	L	34	Very low	31	Very low	158 Å²	158	146 Å²	146	83%	0.827	79%	0.791	S	S	*	*			trans	-112.3	101.6	158.4	-84.5	171.9	0	0	0	109.7	T263 L267	T263-L265 PolarHBondContact O-N 3.14Å; L265-L267 PolarHBondContact O-N 2.81Å
266	L	30.1	Very low	30.9	Very low	162 Å²	162	140.4 Å²	140.4	85%	0.848	78%	0.783	S	S	*	*			trans	-56.9	113.4	166.7	-69	154.5	0	0	0	110.4
267	L	32.5	Very low	30.4	Very low	175 Å²	175	139.5 Å²	139.5	92%	0.916	78%	0.781	S	S	*	*			trans	-132.4	108.9	154.5	-87.9	157.1	0	0	0	107.8	L265	L265-L267 PolarHBondContact O-N 2.81Å
268	S	28.3	Very low	30.4	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	78%	0.781	S	S	*	*			trans	-59.9	157.4	-178	-82.4	0	0	0	0	114.3
269	P	30.2	Very low	30.3	Very low	109 Å²	109	142.5 Å²	142.5	71%	0.708	80%	0.796	S	S	*	*			trans	-84.7	139.3	-179.1	35	-31.8	0	0	0	111.1
270	N	31.1	Very low	30.2	Very low	165 Å²	165	143.9 Å²	143.9	88%	0.882	80%	0.799	S	S	*	*			trans	-171.3	95.9	159	-92.7	-23.2	0	0	0	110.8
271	S	32.8	Very low	30.1	Very low	121 Å²	121	141 Å²	141	85%	0.846	80%	0.8	S	S	*	*			trans	-164.3	83.1	146.9	60.7	0	0	0	0	109.6
272	S	29.3	Very low	29.9	Very low	105 Å²	105	142 Å²	142	73%	0.734	80%	0.801	S	S	*	*			trans	-80.9	116.7	160.7	35.3	0	0	0	0	108.9
273	L	29.4	Very low	30.1	Very low	168 Å²	168	143.4 Å²	143.4	88%	0.88	80%	0.803	S	S	*	*			trans	-176.3	133.6	163.1	-114.3	112.3	0	0	0	105.5
274	S	31.8	Very low	29.8	Very low	87 Å²	87	143.4 Å²	143.4	61%	0.608	81%	0.805	S	S	*	*			cis	-171.5	134.6	-0.8	36.3	0	0	0	0	106	V276	S274-V276 PolarHBondContact O-N 3.43Å
275	T	26.5	Very low	29.4	Very low	126 Å²	126	143.4 Å²	143.4	77%	0.773	80%	0.804	S	S	*	*			trans	-50.7	117	168.4	-56.9	0	0	0	0	111.3	Q277	T275-Q277 HydrophobicContact CG2-CG 3.96Å
276	V	31.1	Very low	29.3	Very low	118 Å²	118	144.9 Å²	144.9	72%	0.715	80%	0.804	S	S	*	*			trans	-107.9	92.6	164.1	-179.4	0	0	0	0	107.5	S274 L278	S274-V276 PolarHBondContact O-N 3.43Å; V276-L278 HydrophobicContact CG1-CB 4.5Å; V276-L278 HydrophobicContact CG1-CD1 3.9Å
277	Q	26.3	Very low	29	Very low	176 Å²	176	146.3 Å²	146.3	82%	0.822	81%	0.806	S	S	*	*			trans	-83	117	159.5	-77.4	175.3	-17.7	0	0	107.1	T275	T275-Q277 HydrophobicContact CG2-CG 3.96Å
278	L	30.8	Very low	28.8	Very low	159 Å²	159	143.6 Å²	143.6	83%	0.832	80%	0.802	S	S	*	*			trans	-133.9	129.2	168.3	-111.4	141.8	0	0	0	110.1	V276	V276-L278 HydrophobicContact CG1-CB 4.5Å; V276-L278 HydrophobicContact CG1-CD1 3.9Å
279	M	28.9	Very low	28.7	Very low	181 Å²	181	145 Å²	145	89%	0.892	80%	0.801	S	S	*	*			trans	-58.8	146.4	-166.1	-79.8	158.8	138.5	0	0	114.8	C281	M279-C281 PolarHBondContact O-N 2.72Å
280	K	28.5	Very low	28.5	Very low	204 Å²	204	148.5 Å²	148.5	89%	0.887	81%	0.807	S	S	*	*			trans	-53.5	116.8	158.5	-71.6	176.8	173.7	179.5	0	110
281	C	29.2	Very low	28.5	Very low	119 Å²	119	146.4 Å²	146.4	80%	0.804	81%	0.806	S	S	*	*			trans	-112.4	100.6	163.8	-162.1	0	0	0	0	108.1	M279	M279-C281 PolarHBondContact O-N 2.72Å
282	N	26.4	Very low	28.2	Very low	147 Å²	147	149.6 Å²	149.6	79%	0.786	81%	0.807	S	S	*	*			trans	-90.9	101.5	168.4	-79.6	-11.8	0	0	0	108
283	Q	31.2	Very low	28.1	Very low	179 Å²	179	149.7 Å²	149.7	84%	0.836	81%	0.808	S	S	*	*			trans	-142.7	114.6	152.6	-77.7	-161.2	-11.2	0	0	109.8
284	P	26.3	Very low	27.9	Very low	116 Å²	116	148.7 Å²	148.7	75%	0.753	80%	0.804	S	S	*	*			trans	-82.4	153.9	160.6	33.5	-28.2	0	0	0	109.2
285	V	23.8	Very low	27.9	Very low	124 Å²	124	151.5 Å²	151.5	75%	0.752	81%	0.81	S	S	*	*			trans	141	133.8	147.3	169.4	0	0	0	0	112.3
286	K	29.8	Very low	27.8	Very low	189 Å²	189	151.6 Å²	151.6	82%	0.822	81%	0.811	S	S	*	*			trans	91.6	93.9	161.7	-78.4	157.6	-166.4	-173.4	0	118.9	S288	K286-S288 PolarHBondContact O-N 3.47Å
287	Q	24.7	Very low	27.8	Very low	193 Å²	193	152.5 Å²	152.5	90%	0.902	81%	0.812	S	S	*	*			trans	-16.7	114.3	136.5	-70.1	165.4	-17.3	0	0	113.6
288	S	28.3	Very low	27.9	Very low	117 Å²	117	150 Å²	150	82%	0.818	80%	0.804	S	S	*	*			trans	-115.8	134	158.3	59.5	0	0	0	0	109	K286	K286-S288 PolarHBondContact O-N 3.47Å
289	N	27.1	Very low	27.9	Very low	142 Å²	142	152.8 Å²	152.8	76%	0.759	81%	0.805	S	S	*	*			trans	-77.4	153.6	-175	-69.4	-45.3	0	0	0	111.9
290	Q	25.1	Very low	28	Very low	182 Å²	182	150.8 Å²	150.8	85%	0.85	80%	0.798	S	S	*	*			trans	59.9	100.4	147	-71.6	172	-7.7	0	0	117.7
291	S	30.3	Very low	28.3	Very low	122 Å²	122	148.6 Å²	148.6	85%	0.853	80%	0.795	S	S	*	*			trans	-155.3	86.9	139.9	-75.9	0	0	0	0	108	S293	S291-S293 PolarHBondContact O-N 3.41Å
292	Q	26.4	Very low	28.8	Very low	187 Å²	187	149.3 Å²	149.3	87%	0.874	79%	0.791	S	S	*	*			trans	-78.6	92.7	176.8	-159.2	138.5	-23.2	0	0	107.8
293	S	29.1	Very low	29.5	Very low	108 Å²	108	151.2 Å²	151.2	76%	0.755	79%	0.792	S	S	*	*			trans	-85.5	114	169.8	48	0	0	0	0	109.4	S291 I295	S291-S293 PolarHBondContact O-N 3.41Å; S293-I295 PolarHBondContact O-N 2.85Å
294	N	24.9	Very low	30.2	Very low	146 Å²	146	147.8 Å²	147.8	78%	0.781	78%	0.779	S	S	*	*			trans	-64.7	108.5	171.6	-65.7	-36.1	0	0	0	110.1
295	I	30.4	Very low	31.2	Very low	146 Å²	146	148.4 Å²	148.4	75%	0.749	78%	0.776	S	S	*	*			trans	-132.3	97.4	154.3	-60	-177.7	0	0	0	108.1	S293 N297	S293-I295 PolarHBondContact O-N 2.85Å; I295-N297 PolarHBondContact O-N 3.38Å
296	T	25.3	Very low	32.3	Very low	128 Å²	128	148.9 Å²	148.9	79%	0.785	78%	0.775	S	S	*	*			trans	-58.5	112.7	166.5	38.8	0	0	0	0	111.5
297	N	31.6	Very low	33.4	Very low	138 Å²	138	145.5 Å²	145.5	74%	0.738	77%	0.766	S	S	*	*			trans	-131	71.9	161.2	-88.2	-16.1	0	0	0	109.9	I295 Y299	I295-N297 PolarHBondContact O-N 3.38Å; N297-Y299 PolarHBondContact O-N 3.31Å
298	N	27.2	Very low	34.5	Very low	122 Å²	122	142.2 Å²	142.2	65%	0.652	75%	0.75	S	S	*	*				27.6	75.5	119.4	-137.9	14.8	0	0	0	117	N300	N298-N300 PolarHBondContact OD1-ND2 2.82Å
299	Y	30.9	Very low	35.2	Very low	219 Å²	219	141.7 Å²	141.7	86%	0.859	74%	0.737	S	S	*	*			trans	-127.7	89.5	146.6	-80	-77.4	0	0	0	107.9	N297 L301	N297-Y299 PolarHBondContact O-N 3.31Å; Y299-L301 PolarHBondContact O-N 2.95Å; Y299-L301 VanDerWaalsContact O-N 3.17Å
300	N	32.3	Very low	36.4	Very low	139 Å²	139	141.3 Å²	141.3	74%	0.743	73%	0.731	S	S	*	*			trans	-63.1	101.6	167.7	-63.6	-52.3	0	0	0	108.3	N298	N298-N300 PolarHBondContact OD1-ND2 2.82Å
301	L	34.8	Very low	37.7	Very low	158 Å²	158	139.8 Å²	139.8	83%	0.827	72%	0.721	S	S	*	*			trans	-113.6	118.9	151.1	-107.1	88.5	0	0	0	107.3	Y299 K303	Y299-L301 PolarHBondContact O-N 2.95Å; Y299-L301 VanDerWaalsContact O-N 3.17Å; L301-K303 PolarHBondContact O-N 3.21Å
302	D	39.4	Very low	38.8	Very low	133 Å²	133	139.2 Å²	139.2	71%	0.711	71%	0.708	S	S	*	*			trans	-35.6	110.1	-179.6	-83.3	-58.6	0	0	0	114.1	N304	D302-N304 VanDerWaalsContact C-N 3.31Å; D302-N304 PolarHBondContact OD1-ND2 3.34Å
303	K	41	Very low	39.7	Very low	188 Å²	188	135 Å²	135	82%	0.817	69%	0.691	S	S	*	*			trans	-98.7	28.7	158.7	-72.6	-171.9	176.1	-178.7	0	111.3	L301	L301-K303 PolarHBondContact O-N 3.21Å
304	N	46.5	Very low	40.7	Very low	106 Å²	106	132.4 Å²	132.4	57%	0.567	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-4.7	-176.2	-74.2	-41.8	0	0	0	114.3	D302 H308	D302-N304 VanDerWaalsContact C-N 3.31Å; D302-N304 PolarHBondContact OD1-ND2 3.34Å; N304-H308 PolarHBondContact O-CD2 3.12Å
305	D	46.3	Very low	41.8	Very low	129 Å²	129	133.3 Å²	133.3	69%	0.69	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-16.3	-179.4	-73.5	-22.2	0	0	0	114.7
306	D	48	Very low	42.7	Very low	134 Å²	134	130.9 Å²	130.9	72%	0.717	66%	0.659	S	S	*	*	H	α-helix	trans	-79.7	-33.4	178	-103.4	-16.2	0	0	0	112.6	H308 I309	D306-H308 VanDerWaalsContact C-N 3.32Å; D306-H308 PolarHBondContact O-N 2.92Å; D306-I309 PolarHBondContact O-N 3.33Å
307	D	51	Low	43.4	Very low	118 Å²	118	130.4 Å²	130.4	63%	0.631	65%	0.652	S	S	*	*	H	α-helix	trans	-72.9	-22.8	179.9	-94.9	6.5	0	0	0	113.3	K311	D307-K311 PolarHBondContact O-N 3.46Å
308	H	49.5	Very low	43.8	Very low	124 Å²	124	132.2 Å²	132.2	57%	0.574	65%	0.649	S	S	*	*	H	α-helix	trans	-77.9	-27.1	177.4	-84.3	-61.2	0	0	0	113	N304 D306 I312	N304-H308 PolarHBondContact O-CD2 3.12Å; D306-H308 VanDerWaalsContact C-N 3.32Å; D306-H308 PolarHBondContact O-N 2.92Å; H308-I312 WeakPolarHBondContact O-CG1 3.48Å; H308-I312 PolarHBondContact O-N 2.97Å
309	I	43.3	Very low	44.5	Very low	106 Å²	106	133.2 Å²	133.2	54%	0.544	65%	0.654	S	S	.	*	H	α-helix	trans	-77.1	-35	177.1	-62.3	-175	0	0	0	110.9	D306 I312 N313	D306-I309 PolarHBondContact O-N 3.33Å; I309-I312 PolarHBondContact O-N 3.46Å; I309-N313 PolarHBondContact O-N 3.26Å; I309-N313 VanDerWaalsContact O-N 3.14Å
310	E	50.5	Low	44.8	Very low	134 Å²	134	129.9 Å²	129.9	63%	0.626	65%	0.65	S	S	*	*	H	α-helix	trans	-72.3	-32.6	176.7	-164.6	168.1	-172.5	0	0	112.6	N313 T314	E310-N313 PolarHBondContact O-N 3Å; E310-T314 WeakPolarHBondContact O-CG2 3.29Å; E310-T314 PolarHBondContact O-N 3.36Å; E310-T314 PolarHBondContact O-OG1 3.47Å; E310-T314 VanDerWaalsContact O-OG1 3.05Å
311	K	53.5	Low	45	Very low	150 Å²	150	128.7 Å²	128.7	65%	0.652	64%	0.642	S	S	*	*	H	α-helix	trans	-70.5	-29.9	173.4	-96.9	174.4	-179.3	164.1	0	114.1	D307 T314 K315	D307-K311 PolarHBondContact O-N 3.46Å; K311-T314 PolarHBondContact O-OG1 2.84Å; K311-K315 PolarHBondContact O-N 3Å
312	I	52.4	Low	45	Very low	111 Å²	111	127.7 Å²	127.7	57%	0.569	64%	0.637	S	S	*	*	H	α-helix	trans	-73.9	-40.9	173.7	-66.7	171.1	0	0	0	110.1	H308 I309 T314 K315 V316	H308-I312 WeakPolarHBondContact O-CG1 3.48Å; H308-I312 PolarHBondContact O-N 2.97Å; I309-I312 PolarHBondContact O-N 3.46Å; I312-T314 PolarHBondContact O-N 3.35Å; I312-K315 PolarHBondContact O-N 3.04Å; I312-V316 PolarHBondContact O-N 3.24Å
313	N	45.4	Very low	44.6	Very low	98 Å²	98	125.5 Å²	125.5	52%	0.524	65%	0.646	S	S	.	*	H	α-helix	trans	-68.4	-32.4	179.1	-85.2	-24.5	0	0	0	113.6	I309 E310 K315 N317	I309-N313 PolarHBondContact O-N 3.26Å; I309-N313 VanDerWaalsContact O-N 3.14Å; E310-N313 PolarHBondContact O-N 3Å; N313-K315 VanDerWaalsContact C-N 3.34Å; N313-N317 WeakPolarHBondContact O-CB 3.29Å; N313-N317 PolarHBondContact O-N 3.41Å; N313-N317 VanDerWaalsContact O-N 3.08Å
314	T	50.8	Low	44.4	Very low	54 Å²	54	122.9 Å²	122.9	33%	0.331	64%	0.641	S	S	.	*	H	α-helix	trans	-74.7	-21.8	173.6	52.2	0	0	0	0	113.6	E310 K311 I312 R318	E310-T314 WeakPolarHBondContact O-CG2 3.29Å; E310-T314 PolarHBondContact O-N 3.36Å; E310-T314 PolarHBondContact O-OG1 3.47Å; E310-T314 VanDerWaalsContact O-OG1 3.05Å; K311-T314 PolarHBondContact O-OG1 2.84Å; I312-T314 PolarHBondContact O-N 3.35Å; T314-R318 WeakPolarHBondContact O-CG 3.36Å; T314-R318 PolarHBondContact O-N 3.41Å
315	K	48	Very low	43.8	Very low	165 Å²	165	127.5 Å²	127.5	72%	0.717	66%	0.656	S	S	*	*	H	α-helix	trans	-84.5	-30.7	175.8	-133.5	165.4	-173.8	177.7	0	113	K311 I312 N313	K311-K315 PolarHBondContact O-N 3Å; I312-K315 PolarHBondContact O-N 3.04Å; N313-K315 VanDerWaalsContact C-N 3.34Å
316	V	48.2	Very low	43.2	Very low	94 Å²	94	128.1 Å²	128.1	57%	0.57	66%	0.659	S	S	*	*	H	α-helix	trans	-76	-36.4	172.3	177.7	0	0	0	0	111.3	I312	I312-V316 PolarHBondContact O-N 3.24Å
317	N	41.2	Very low	42.6	Very low	119 Å²	119	129.9 Å²	129.9	64%	0.636	67%	0.668	S	S	*	*	H	α-helix	trans	-82	-11.1	179.9	-84.6	-9.8	0	0	0	115.7	N313	N313-N317 WeakPolarHBondContact O-CB 3.29Å; N313-N317 PolarHBondContact O-N 3.41Å; N313-N317 VanDerWaalsContact O-N 3.08Å
318	R	39.8	Very low	41.9	Very low	176 Å²	176	130.2 Å²	130.2	66%	0.664	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-87	-8.7	171.7	-78.9	-167.9	-160.9	119.4	3.9	114.8	T314 I320	T314-R318 WeakPolarHBondContact O-CG 3.36Å; T314-R318 PolarHBondContact O-N 3.41Å; R318-I320 PolarHBondContact O-N 2.99Å
319	N	41.6	Very low	41.2	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-82.8	6	172.2	-72.3	-1.2	0	0	0	113.1
320	I	37.5	Very low	40.9	Very low	149 Å²	149	131.4 Å²	131.4	76%	0.764	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-133.6	55.6	171.7	-43.2	178.3	0	0	0	108.7	R318	R318-I320 PolarHBondContact O-N 2.99Å
321	I	36.5	Very low	40.6	Very low	113 Å²	113	131.7 Å²	131.7	58%	0.579	69%	0.693	S	S	*	*	S	Bend	trans	-119.1	128.5	155.6	-70	177.9	0	0	0	105.4
322	D	34.8	Very low	40.2	Very low	137 Å²	137	133.7 Å²	133.7	73%	0.733	71%	0.705	S	S	*	*			trans	67.3	63.6	162.7	-57.1	-21	0	0	0	117.6
323	G	30.8	Very low	39.9	Very low	87 Å²	87	133.1 Å²	133.1	90%	0.897	70%	0.703	S	S	*	*			trans	-85.3	94.6	148.3	0	0	0	0	0	109
324	D	36.1	Very low	40.5	Very low	133 Å²	133	131 Å²	131	71%	0.711	70%	0.696	S	S	*	*			trans	-46.8	153.5	-177.7	-78.4	-54	0	0	0	116.5	L326	D324-L326 PolarHBondContact O-N 3.2Å
325	K	34.1	Very low	41.2	Very low	203 Å²	203	133.9 Å²	133.9	88%	0.883	71%	0.713	S	S	*	*			trans	-26.3	95.5	153.3	-69.9	169.4	174.5	172.8	0	112.8
326	L	35.1	Very low	42.6	Very low	142 Å²	142	133.1 Å²	133.1	74%	0.743	71%	0.712	S	S	*	*			trans	-113.3	96.9	158.5	-132.1	75.2	0	0	0	108	D324 I328	D324-L326 PolarHBondContact O-N 3.2Å; L326-I328 VanDerWaalsContact C-N 3.31Å; L326-I328 HydrophobicContact CD2-CD1 3.53Å; L326-I328 HydrophobicContact CD2-CG1 4.17Å; L326-I328 HydrophobicContact CG-CD1 4.12Å; L326-I328 HydrophobicContact CG-CG1 4.24Å; L326-I328 PolarHBondContact O-N 3.03Å
327	N	33.8	Very low	43.4	Very low	171 Å²	171	132.2 Å²	132.2	91%	0.914	70%	0.704	S	S	*	*			trans	-62.4	93.1	161.5	-79.8	-27.3	0	0	0	108.2
328	I	37.6	Very low	45.1	Very low	126 Å²	126	132.1 Å²	132.1	65%	0.646	70%	0.699	S	S	*	*			trans	-134.3	89.2	162.1	-56.6	-178.3	0	0	0	104.4	L326	L326-I328 VanDerWaalsContact C-N 3.31Å; L326-I328 HydrophobicContact CD2-CD1 3.53Å; L326-I328 HydrophobicContact CD2-CG1 4.17Å; L326-I328 HydrophobicContact CG-CD1 4.12Å; L326-I328 HydrophobicContact CG-CG1 4.24Å; L326-I328 PolarHBondContact O-N 3.03Å
329	S	34.7	Very low	47	Very low	89 Å²	89	127.5 Å²	127.5	62%	0.622	69%	0.691	S	S	*	*				59.6	85.9	102.3	-178.5	0	0	0	0	112.5	N331	S329-N331 VanDerWaalsContact C-N 3.33Å; S329-N331 PolarHBondContact O-N 2.99Å
330	D	37.5	Very low	49	Very low	166 Å²	166	125.1 Å²	125.1	89%	0.888	68%	0.678	S	S	*	*	S	Bend	trans	-0.9	64	145.7	-62.7	-33.4	0	0	0	118.6
331	N	43	Very low	51.1	Low	139 Å²	139	125.1 Å²	125.1	74%	0.743	67%	0.668	S	S	*	*	S	Bend	trans	-141.1	100.2	165.7	-84	-31.9	0	0	0	109.8	S329 D333	S329-N331 VanDerWaalsContact C-N 3.33Å; S329-N331 PolarHBondContact O-N 2.99Å; N331-D333 PolarHBondContact O-N 3.16Å
332	E	44.6	Very low	53.5	Low	192 Å²	192	126.9 Å²	126.9	90%	0.897	67%	0.671	S	S	*	*			trans	52	59.2	159.7	-60.7	-166.4	157.5	0	0	117.8	S334	E332-S334 PolarHBondContact O-N 3.44Å
333	D	47.6	Very low	56	Low	99 Å²	99	125.4 Å²	125.4	53%	0.529	66%	0.66	S	S	.	*			trans	-63.5	95.7	150	-91.5	2.9	0	0	0	107.2	N331 L337 R341	N331-D333 PolarHBondContact O-N 3.16Å; D333-L337 HydrophobicContact CB-CB 4.43Å; D333-L337 HydrophobicContact CB-CD1 4.06Å; D333-R341 IonicContact OD2-NH2 3.57Å; D333-R341 PolarHBondContact OD2-NH2 2.98Å
334	S	57.8	Low	58.8	Low	55 Å²	55	125.3 Å²	125.3	39%	0.385	64%	0.638	S	S	.	*			trans	-30.9	139.7	176.2	169.3	0	0	0	0	111.7	E332 E336 L337	E332-S334 PolarHBondContact O-N 3.44Å; S334-E336 CarbonylContact O-C 3.58Å; S334-E336 PolarHBondContact O-N 2.75Å; S334-E336 WeakPolarHBondContact OG-CB 3.44Å; S334-E336 PolarHBondContact OG-N 3.24Å; S334-E336 PolarHBondContact OG-OE2 3.35Å; S334-L337 WeakPolarHBondContact O-CB 3.38Å; S334-L337 PolarHBondContact O-N 3.44Å
335	V	65.8	Low	61.3	Low	114 Å²	114	124.7 Å²	124.7	69%	0.691	63%	0.631	S	S	*	*	H	α-helix	trans	-44.1	-31	172.3	173.7	0	0	0	0	111.6	L337 Q338 V339	V335-L337 PolarHBondContact O-N 3.44Å; V335-Q338 PolarHBondContact O-N 3.28Å; V335-V339 HydrophobicContact CG1-CG2 4.21Å; V335-V339 VanDerWaalsContact O-CG2 3.3Å; V335-V339 WeakPolarHBondContact O-CG2 3.41Å; V335-V339 PolarHBondContact O-N 2.94Å
336	E	75.7	Confident	63.7	Low	148 Å²	148	119.8 Å²	119.8	69%	0.692	61%	0.614	S	S	*	*	H	α-helix	trans	-58	-42.6	173	-73.8	168.9	139.1	0	0	114	S334 Q338 V339 L340	S334-E336 CarbonylContact O-C 3.58Å; S334-E336 PolarHBondContact O-N 2.75Å; S334-E336 WeakPolarHBondContact OG-CB 3.44Å; S334-E336 PolarHBondContact OG-N 3.24Å; S334-E336 PolarHBondContact OG-OE2 3.35Å; E336-Q338 VanDerWaalsContact C-N 3.32Å; E336-Q338 PolarHBondContact O-N 3.37Å; E336-V339 PolarHBondContact O-N 2.83Å; E336-L340 WeakPolarHBondContact O-CB 3.28Å; E336-L340 PolarHBondContact O-N 3.42Å
337	L	66.1	Low	66.4	Low	76 Å²	76	118.7 Å²	118.7	40%	0.398	61%	0.606	S	S	.	*	H	α-helix	trans	-66.2	-34.2	177.8	-91.3	164.8	0	0	0	112.2	D333 S334 V335 R341	D333-L337 HydrophobicContact CB-CB 4.43Å; D333-L337 HydrophobicContact CB-CD1 4.06Å; S334-L337 WeakPolarHBondContact O-CB 3.38Å; S334-L337 PolarHBondContact O-N 3.44Å; V335-L337 PolarHBondContact O-N 3.44Å; L337-R341 WeakPolarHBondContact O-CB 3.35Å; L337-R341 PolarHBondContact O-N 3.01Å
338	Q	76.7	Confident	69.1	Low	116 Å²	116	116.7 Å²	116.7	54%	0.542	59%	0.589	S	S	.	*	H	α-helix	trans	-71.1	-41.6	173.1	-71.3	-166.2	13.5	0	0	111.8	V335 E336 L340 R341 K342	V335-Q338 PolarHBondContact O-N 3.28Å; E336-Q338 VanDerWaalsContact C-N 3.32Å; E336-Q338 PolarHBondContact O-N 3.37Å; Q338-L340 VanDerWaalsContact C-N 3.35Å; Q338-R341 PolarHBondContact O-N 3.37Å; Q338-K342 WeakPolarHBondContact O-CG 3.48Å; Q338-K342 PolarHBondContact O-N 3.2Å
339	V	79.7	Confident	71.6	Confident	79 Å²	79	114.7 Å²	114.7	48%	0.479	58%	0.579	S	S	.	*	H	α-helix	trans	-61.7	-44.6	174.8	171.6	0	0	0	0	110.2	V335 E336 R341 K342 Q343	V335-V339 HydrophobicContact CG1-CG2 4.21Å; V335-V339 VanDerWaalsContact O-CG2 3.3Å; V335-V339 WeakPolarHBondContact O-CG2 3.41Å; V335-V339 PolarHBondContact O-N 2.94Å; E336-V339 PolarHBondContact O-N 2.83Å; V339-R341 VanDerWaalsContact C-N 3.35Å; V339-R341 PolarHBondContact O-N 3.45Å; V339-K342 PolarHBondContact O-N 3.47Å; V339-Q343 WeakPolarHBondContact O-CB 3.35Å; V339-Q343 PolarHBondContact O-N 2.68Å
340	L	82.6	Confident	74.3	Confident	94 Å²	94	113.9 Å²	113.9	49%	0.492	57%	0.568	S	S	.	*	H	α-helix	trans	-61.2	-42.7	176.6	-132.7	77.7	0	0	0	111.4	E336 Q338 K342 Q343 I344	E336-L340 WeakPolarHBondContact O-CB 3.28Å; E336-L340 PolarHBondContact O-N 3.42Å; Q338-L340 VanDerWaalsContact C-N 3.35Å; L340-K342 PolarHBondContact O-N 3.26Å; L340-Q343 PolarHBondContact O-N 3.14Å; L340-I344 WeakPolarHBondContact O-CB 3.44Å; L340-I344 VanDerWaalsContact O-CG1 3.22Å; L340-I344 WeakPolarHBondContact O-CG1 3.35Å; L340-I344 PolarHBondContact O-N 2.86Å
341	R	83.6	Confident	76.9	Confident	148 Å²	148	112.7 Å²	112.7	56%	0.558	56%	0.555	S	S	*	*	H	α-helix	trans	-60.9	-43.2	174.8	-97.8	-176.9	-97.7	-138.6	-0.7	112.3	D333 L337 Q338 V339 I344 H345	D333-R341 IonicContact OD2-NH2 3.57Å; D333-R341 PolarHBondContact OD2-NH2 2.98Å; L337-R341 WeakPolarHBondContact O-CB 3.35Å; L337-R341 PolarHBondContact O-N 3.01Å; Q338-R341 PolarHBondContact O-N 3.37Å; V339-R341 VanDerWaalsContact C-N 3.35Å; V339-R341 PolarHBondContact O-N 3.45Å; R341-I344 PolarHBondContact O-N 2.91Å; R341-H345 WeakPolarHBondContact O-CB 3.47Å; R341-H345 PolarHBondContact O-N 3.17Å
342	K	85.7	Confident	79.3	Confident	150 Å²	150	112.7 Å²	112.7	65%	0.652	55%	0.55	S	S	*	*	H	α-helix	trans	-64.8	-42.4	175.9	-73	178.6	-179.9	178.9	0	111.8	Q338 V339 L340 H345 L346	Q338-K342 WeakPolarHBondContact O-CG 3.48Å; Q338-K342 PolarHBondContact O-N 3.2Å; V339-K342 PolarHBondContact O-N 3.47Å; L340-K342 PolarHBondContact O-N 3.26Å; K342-H345 PolarHBondContact O-N 3.23Å; K342-L346 PolarHBondContact O-N 3.3Å
343	Q	88.4	Confident	81.6	Confident	107 Å²	107	110 Å²	110	50%	0.5	53%	0.533	S	S	.	.	H	α-helix	trans	-64	-44.1	177.1	-172.3	173	6.3	0	0	111.6	V339 L340 H345 L346 M347	V339-Q343 WeakPolarHBondContact O-CB 3.35Å; V339-Q343 PolarHBondContact O-N 2.68Å; L340-Q343 PolarHBondContact O-N 3.14Å; Q343-H345 VanDerWaalsContact C-N 3.28Å; Q343-H345 PolarHBondContact O-N 2.94Å; Q343-L346 PolarHBondContact O-N 3.45Å; Q343-M347 HydrophobicContact CG-SD 4.45Å; Q343-M347 WeakPolarHBondContact O-CB 3.43Å; Q343-M347 VanDerWaalsContact O-CG 3.32Å; Q343-M347 WeakPolarHBondContact O-CG 3.42Å; Q343-M347 PolarHBondContact O-N 2.76Å
344	I	89.1	Confident	83.7	Confident	85 Å²	85	111.1 Å²	111.1	44%	0.436	53%	0.533	S	S	.	.	H	α-helix	trans	-60.8	-39.6	174	-71.8	166.4	0	0	0	110.8	L340 R341 M347 K348	L340-I344 WeakPolarHBondContact O-CB 3.44Å; L340-I344 VanDerWaalsContact O-CG1 3.22Å; L340-I344 WeakPolarHBondContact O-CG1 3.35Å; L340-I344 PolarHBondContact O-N 2.86Å; R341-I344 PolarHBondContact O-N 2.91Å; I344-M347 PolarHBondContact O-N 3.05Å; I344-K348 WeakPolarHBondContact O-CG 3.45Å; I344-K348 PolarHBondContact O-N 3.02Å
345	H	88	Confident	85.3	Confident	119 Å²	119	113.1 Å²	113.1	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-66.3	-44.5	177.8	-169.5	60.3	0	0	0	112	R341 K342 Q343 M347 K348 I349	R341-H345 WeakPolarHBondContact O-CB 3.47Å; R341-H345 PolarHBondContact O-N 3.17Å; K342-H345 PolarHBondContact O-N 3.23Å; Q343-H345 VanDerWaalsContact C-N 3.28Å; Q343-H345 PolarHBondContact O-N 2.94Å; H345-M347 PolarHBondContact O-N 2.87Å; H345-K348 WeakPolarHBondContact O-CB 3.27Å; H345-K348 PolarHBondContact O-N 3.32Å; H345-K348 VanDerWaalsContact O-N 3.16Å; H345-I349 WeakPolarHBondContact O-CG1 3.34Å; H345-I349 PolarHBondContact O-N 3.46Å; H345-I349 VanDerWaalsContact O-N 3.12Å
346	L	85.4	Confident	86.6	Confident	101 Å²	101	115 Å²	115	53%	0.529	54%	0.538	S	S	.	.	H	α-helix	trans	-60.9	-45.3	174.7	-172.9	65.3	0	0	0	111.5	K342 Q343 K348 I349 D350	K342-L346 PolarHBondContact O-N 3.3Å; Q343-L346 PolarHBondContact O-N 3.45Å; L346-K348 VanDerWaalsContact C-N 3.25Å; L346-K348 PolarHBondContact O-N 3.46Å; L346-I349 WeakPolarHBondContact O-CB 3.41Å; L346-I349 PolarHBondContact O-N 3.5Å; L346-I349 VanDerWaalsContact O-N 3.08Å; L346-D350 PolarHBondContact O-N 2.95Å
347	M	90.2	Very high	87.4	Confident	118 Å²	118	112.2 Å²	112.2	58%	0.581	53%	0.525	S	S	*	.	H	α-helix	trans	-61.3	-31.5	175.4	-73.5	-179.5	68.6	0	0	113.1	Q343 I344 H345 K351	Q343-M347 HydrophobicContact CG-SD 4.45Å; Q343-M347 WeakPolarHBondContact O-CB 3.43Å; Q343-M347 VanDerWaalsContact O-CG 3.32Å; Q343-M347 WeakPolarHBondContact O-CG 3.42Å; Q343-M347 PolarHBondContact O-N 2.76Å; I344-M347 PolarHBondContact O-N 3.05Å; H345-M347 PolarHBondContact O-N 2.87Å; M347-K351 VanDerWaalsContact O-CB 3.26Å; M347-K351 WeakPolarHBondContact O-CB 3.44Å; M347-K351 PolarHBondContact O-N 2.85Å
348	K	91.3	Very high	88.4	Confident	130 Å²	130	113.9 Å²	113.9	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-67.2	-43	173.2	-78.8	177.8	178.1	-176	0	111.4	I344 H345 L346 K351 E352	I344-K348 WeakPolarHBondContact O-CG 3.45Å; I344-K348 PolarHBondContact O-N 3.02Å; H345-K348 WeakPolarHBondContact O-CB 3.27Å; H345-K348 PolarHBondContact O-N 3.32Å; H345-K348 VanDerWaalsContact O-N 3.16Å; L346-K348 VanDerWaalsContact C-N 3.25Å; L346-K348 PolarHBondContact O-N 3.46Å; K348-K351 PolarHBondContact O-N 2.77Å; K348-E352 WeakPolarHBondContact O-CB 3.3Å; K348-E352 PolarHBondContact O-N 3.44Å
349	I	91.1	Very high	89.1	Confident	83 Å²	83	111 Å²	111	43%	0.426	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-46.5	176.5	-64.8	167.2	0	0	0	110.2	H345 L346 K351 E352 Y353	H345-I349 WeakPolarHBondContact O-CG1 3.34Å; H345-I349 PolarHBondContact O-N 3.46Å; H345-I349 VanDerWaalsContact O-N 3.12Å; L346-I349 WeakPolarHBondContact O-CB 3.41Å; L346-I349 PolarHBondContact O-N 3.5Å; L346-I349 VanDerWaalsContact O-N 3.08Å; I349-K351 PolarHBondContact O-N 3.44Å; I349-E352 PolarHBondContact O-N 2.92Å; I349-Y353 WeakPolarHBondContact O-CB 3.41Å; I349-Y353 PolarHBondContact O-N 3.29Å
350	D	90.8	Very high	89.7	Confident	73 Å²	73	111.7 Å²	111.7	39%	0.39	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-44.3	177.8	-71.5	-18.1	0	0	0	111.4	L346 E352 Y353 F354	L346-D350 PolarHBondContact O-N 2.95Å; D350-E352 VanDerWaalsContact C-N 3.28Å; D350-E352 PolarHBondContact O-N 3.32Å; D350-Y353 WeakPolarHBondContact O-CB 3.26Å; D350-Y353 PolarHBondContact O-N 3.16Å; D350-F354 HydrophobicContact CB-CD2 4.42Å; D350-F354 HydrophobicContact CB-CE2 4.27Å; D350-F354 WeakPolarHBondContact O-CD2 3.48Å; D350-F354 PolarHBondContact O-N 3.11Å
351	K	92	Very high	90	Very high	140 Å²	140	111.8 Å²	111.8	61%	0.609	53%	0.528	S	S	*	.	H	α-helix	trans	-55.6	-45.2	174	176.6	-173.5	173.4	-176.6	0	111.3	M347 K348 I349 F354 L355	M347-K351 VanDerWaalsContact O-CB 3.26Å; M347-K351 WeakPolarHBondContact O-CB 3.44Å; M347-K351 PolarHBondContact O-N 2.85Å; K348-K351 PolarHBondContact O-N 2.77Å; I349-K351 PolarHBondContact O-N 3.44Å; K351-F354 PolarHBondContact O-N 3.43Å; K351-L355 HydrophobicContact CG-CD1 4Å; K351-L355 HydrophobicContact CG-CG 4.47Å; K351-L355 WeakPolarHBondContact O-CB 3.49Å; K351-L355 VanDerWaalsContact O-CG 3.26Å; K351-L355 WeakPolarHBondContact O-CG 3.43Å; K351-L355 PolarHBondContact O-N 3.06Å
352	E	92.9	Very high	90.5	Very high	139 Å²	139	114.6 Å²	114.6	65%	0.65	54%	0.539	S	S	*	.	H	α-helix	trans	-68.1	-37.9	-178.3	-155.3	154.6	-152.3	0	0	111.6	K348 I349 D350 K356	K348-E352 WeakPolarHBondContact O-CB 3.3Å; K348-E352 PolarHBondContact O-N 3.44Å; I349-E352 PolarHBondContact O-N 2.92Å; D350-E352 VanDerWaalsContact C-N 3.28Å; D350-E352 PolarHBondContact O-N 3.32Å; E352-K356 WeakPolarHBondContact O-CB 3.37Å; E352-K356 PolarHBondContact O-N 3.3Å
353	Y	92.6	Very high	90.8	Very high	135 Å²	135	112.4 Å²	112.4	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-62	-48.6	171.6	177.4	-98.3	0	0	0	112.6	I349 D350 K356 Q357	I349-Y353 WeakPolarHBondContact O-CB 3.41Å; I349-Y353 PolarHBondContact O-N 3.29Å; D350-Y353 WeakPolarHBondContact O-CB 3.26Å; D350-Y353 PolarHBondContact O-N 3.16Å; Y353-K356 PolarHBondContact O-N 3.33Å; Y353-Q357 HydrophobicContact CE1-CG 4.33Å; Y353-Q357 PolarHBondContact O-N 3.5Å; Y353-Q357 PolarHBondContact OH-NE2 2.98Å
354	F	92.2	Very high	91.1	Very high	124 Å²	124	113 Å²	113	54%	0.544	54%	0.535	S	S	.	.	H	α-helix	trans	-66.8	-36.7	178.3	-73.5	-60.7	0	0	0	112.5	D350 K351 K356 Q357 L358	D350-F354 HydrophobicContact CB-CD2 4.42Å; D350-F354 HydrophobicContact CB-CE2 4.27Å; D350-F354 WeakPolarHBondContact O-CD2 3.48Å; D350-F354 PolarHBondContact O-N 3.11Å; K351-F354 PolarHBondContact O-N 3.43Å; F354-K356 VanDerWaalsContact C-N 3.33Å; F354-K356 PolarHBondContact O-N 2.88Å; F354-Q357 PolarHBondContact O-N 2.99Å; F354-L358 WeakPolarHBondContact O-CB 3.31Å; F354-L358 PolarHBondContact O-N 2.87Å
355	L	91.3	Very high	91.1	Very high	97 Å²	97	113.8 Å²	113.8	51%	0.508	54%	0.54	S	S	.	.	H	α-helix	trans	-62.4	-40.8	172.9	-78.1	171.9	0	0	0	111.6	K351 L358 S359	K351-L355 HydrophobicContact CG-CD1 4Å; K351-L355 HydrophobicContact CG-CG 4.47Å; K351-L355 WeakPolarHBondContact O-CB 3.49Å; K351-L355 VanDerWaalsContact O-CG 3.26Å; K351-L355 WeakPolarHBondContact O-CG 3.43Å; K351-L355 PolarHBondContact O-N 3.06Å; L355-L358 PolarHBondContact O-N 2.89Å; L355-S359 WeakPolarHBondContact O-CB 3.21Å; L355-S359 PolarHBondContact O-N 2.95Å
356	K	92.8	Very high	91.3	Very high	153 Å²	153	111.4 Å²	111.4	67%	0.665	54%	0.537	S	S	*	.	H	α-helix	trans	-64.6	-43.4	176.3	-165.9	171.1	-176.4	176.3	0	111.5	E352 Y353 F354 S359 N360	E352-K356 WeakPolarHBondContact O-CB 3.37Å; E352-K356 PolarHBondContact O-N 3.3Å; Y353-K356 PolarHBondContact O-N 3.33Å; F354-K356 VanDerWaalsContact C-N 3.33Å; F354-K356 PolarHBondContact O-N 2.88Å; K356-S359 PolarHBondContact O-N 3.29Å; K356-S359 PolarHBondContact O-OG 3.06Å; K356-N360 PolarHBondContact O-N 3.33Å; K356-N360 VanDerWaalsContact O-N 3.13Å
357	Q	92	Very high	91.6	Very high	89 Å²	89	109.6 Å²	109.6	42%	0.416	53%	0.53	S	S	.	.	H	α-helix	trans	-61.6	-45.5	173.5	-79	-148.5	43	0	0	112.5	Y353 F354 S359 N360 L361	Y353-Q357 HydrophobicContact CE1-CG 4.33Å; Y353-Q357 PolarHBondContact O-N 3.5Å; Y353-Q357 PolarHBondContact OH-NE2 2.98Å; F354-Q357 PolarHBondContact O-N 2.99Å; Q357-S359 VanDerWaalsContact C-N 3.29Å; Q357-S359 PolarHBondContact O-N 3.43Å; Q357-N360 WeakPolarHBondContact O-CB 3.16Å; Q357-N360 PolarHBondContact O-N 3.48Å; Q357-L361 PolarHBondContact O-N 2.93Å
358	L	88.6	Confident	91.5	Very high	111 Å²	111	106.2 Å²	106.2	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-59.7	-40	176.4	-87.8	165.7	0	0	0	112.1	F354 L355 N360 L361 R362	F354-L358 WeakPolarHBondContact O-CB 3.31Å; F354-L358 PolarHBondContact O-N 2.87Å; L355-L358 PolarHBondContact O-N 2.89Å; L358-N360 PolarHBondContact O-N 3.05Å; L358-L361 PolarHBondContact O-N 3.49Å; L358-R362 WeakPolarHBondContact O-CB 3.47Å; L358-R362 PolarHBondContact O-N 3.42Å
359	S	91.7	Very high	91.6	Very high	57 Å²	57	105.5 Å²	105.5	40%	0.399	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-40	176.9	74.4	0	0	0	0	112.1	L355 K356 Q357 R362 I363	L355-S359 WeakPolarHBondContact O-CB 3.21Å; L355-S359 PolarHBondContact O-N 2.95Å; K356-S359 PolarHBondContact O-N 3.29Å; K356-S359 PolarHBondContact O-OG 3.06Å; Q357-S359 VanDerWaalsContact C-N 3.29Å; Q357-S359 PolarHBondContact O-N 3.43Å; S359-R362 PolarHBondContact O-N 3.26Å; S359-I363 VanDerWaalsContact O-CG1 3.29Å; S359-I363 WeakPolarHBondContact O-CG1 3.44Å; S359-I363 PolarHBondContact O-N 3.43Å
360	N	91.3	Very high	91.6	Very high	92 Å²	92	107.9 Å²	107.9	49%	0.492	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-45.8	175.3	-108.7	-27.2	0	0	0	112.1	K356 Q357 L358 R362 I363 Q364	K356-N360 PolarHBondContact O-N 3.33Å; K356-N360 VanDerWaalsContact O-N 3.13Å; Q357-N360 WeakPolarHBondContact O-CB 3.16Å; Q357-N360 PolarHBondContact O-N 3.48Å; L358-N360 PolarHBondContact O-N 3.05Å; N360-R362 VanDerWaalsContact C-N 3.29Å; N360-R362 PolarHBondContact O-N 3.02Å; N360-I363 PolarHBondContact O-N 3.5Å; N360-Q364 WeakPolarHBondContact O-CG 3.39Å; N360-Q364 PolarHBondContact O-N 3.28Å
361	L	89.9	Confident	91.7	Very high	97 Å²	97	111 Å²	111	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-61.8	-38.7	176.4	-75	168.4	0	0	0	111.5	Q357 L358 Q364 L365	Q357-L361 PolarHBondContact O-N 2.93Å; L358-L361 PolarHBondContact O-N 3.49Å; L361-Q364 PolarHBondContact O-N 2.97Å; L361-L365 WeakPolarHBondContact O-CB 3.47Å; L361-L365 PolarHBondContact O-N 2.94Å
362	R	93.4	Very high	91.6	Very high	207 Å²	207	108.6 Å²	108.6	78%	0.781	53%	0.532	S	S	*	.	H	α-helix	trans	-64.9	-41.5	176.7	-166.7	175.2	-167.7	124.8	-0.4	112.4	L358 S359 N360 L365 S366	L358-R362 WeakPolarHBondContact O-CB 3.47Å; L358-R362 PolarHBondContact O-N 3.42Å; S359-R362 PolarHBondContact O-N 3.26Å; N360-R362 VanDerWaalsContact C-N 3.29Å; N360-R362 PolarHBondContact O-N 3.02Å; R362-L365 PolarHBondContact O-N 3.4Å; R362-S366 WeakPolarHBondContact O-CB 3.48Å; R362-S366 PolarHBondContact O-N 2.88Å
363	I	92.6	Very high	91.5	Very high	103 Å²	103	104.6 Å²	104.6	53%	0.528	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-46.6	174.3	-67.8	163.5	0	0	0	110.1	S359 N360 L365 S366 T367	S359-I363 VanDerWaalsContact O-CG1 3.29Å; S359-I363 WeakPolarHBondContact O-CG1 3.44Å; S359-I363 PolarHBondContact O-N 3.43Å; N360-I363 PolarHBondContact O-N 3.5Å; I363-L365 VanDerWaalsContact C-N 3.34Å; I363-L365 PolarHBondContact O-N 2.78Å; I363-S366 PolarHBondContact O-N 3.42Å; I363-T367 WeakPolarHBondContact O-CG2 3.36Å; I363-T367 PolarHBondContact O-N 2.75Å; I363-T367 PolarHBondContact O-OG1 3.31Å
364	Q	93.4	Very high	91.4	Very high	119 Å²	119	101.7 Å²	101.7	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-59.5	-44.4	177.6	-74.5	-178.9	-3.8	0	0	112	N360 L361 S366 T367 A368	N360-Q364 WeakPolarHBondContact O-CG 3.39Å; N360-Q364 PolarHBondContact O-N 3.28Å; L361-Q364 PolarHBondContact O-N 2.97Å; Q364-S366 PolarHBondContact O-N 3.35Å; Q364-T367 PolarHBondContact O-N 3.48Å; Q364-T367 PolarHBondContact O-OG1 3.4Å; Q364-A368 PolarHBondContact O-N 2.97Å
365	L	89.8	Confident	91.2	Very high	103 Å²	103	101.7 Å²	101.7	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-62.6	-44.3	178.5	-154.3	151.8	0	0	0	110.9	L361 R362 I363 T367 A368 E369	L361-L365 WeakPolarHBondContact O-CB 3.47Å; L361-L365 PolarHBondContact O-N 2.94Å; R362-L365 PolarHBondContact O-N 3.4Å; I363-L365 VanDerWaalsContact C-N 3.34Å; I363-L365 PolarHBondContact O-N 2.78Å; L365-T367 PolarHBondContact O-N 2.92Å; L365-A368 PolarHBondContact O-N 3.4Å; L365-A368 VanDerWaalsContact O-N 3.16Å; L365-E369 HydrophobicContact CD2-CG 4.08Å; L365-E369 WeakPolarHBondContact CD2-OE1 3.33Å; L365-E369 WeakPolarHBondContact O-CG 3.39Å; L365-E369 PolarHBondContact O-N 3.06Å
366	S	92.2	Very high	91.3	Very high	68 Å²	68	102.6 Å²	102.6	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-61.4	-41.7	175	-174.7	0	0	0	0	112.9	R362 I363 Q364 A368 E369 E370	R362-S366 WeakPolarHBondContact O-CB 3.48Å; R362-S366 PolarHBondContact O-N 2.88Å; I363-S366 PolarHBondContact O-N 3.42Å; Q364-S366 PolarHBondContact O-N 3.35Å; S366-A368 VanDerWaalsContact C-N 3.32Å; S366-A368 PolarHBondContact O-N 3.05Å; S366-E369 PolarHBondContact O-N 3.43Å; S366-E370 PolarHBondContact O-N 3.34Å
367	T	91.7	Very high	91.2	Very high	63 Å²	63	102.7 Å²	102.7	39%	0.387	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-30.8	175.6	60.6	0	0	0	0	113.2	I363 Q364 L365 K371	I363-T367 WeakPolarHBondContact O-CG2 3.36Å; I363-T367 PolarHBondContact O-N 2.75Å; I363-T367 PolarHBondContact O-OG1 3.31Å; Q364-T367 PolarHBondContact O-N 3.48Å; Q364-T367 PolarHBondContact O-OG1 3.4Å; L365-T367 PolarHBondContact O-N 2.92Å; T367-K371 WeakPolarHBondContact O-CG 3.4Å; T367-K371 PolarHBondContact O-N 3.17Å
368	A	87.9	Confident	91.2	Very high	48 Å²	48	103.3 Å²	103.3	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-72	-41.8	175.4	0	0	0	0	0	111.2	Q364 L365 S366 E370 K371 I372	Q364-A368 PolarHBondContact O-N 2.97Å; L365-A368 PolarHBondContact O-N 3.4Å; L365-A368 VanDerWaalsContact O-N 3.16Å; S366-A368 VanDerWaalsContact C-N 3.32Å; S366-A368 PolarHBondContact O-N 3.05Å; A368-E370 PolarHBondContact O-N 3.18Å; A368-K371 PolarHBondContact O-N 2.92Å; A368-I372 WeakPolarHBondContact O-CG1 3.39Å; A368-I372 PolarHBondContact O-N 3.24Å
369	E	92.9	Very high	91.1	Very high	114 Å²	114	102.3 Å²	102.3	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-60.5	-42.6	174.1	-72.4	173.9	158	0	0	112	L365 S366 K371 I372 A373	L365-E369 HydrophobicContact CD2-CG 4.08Å; L365-E369 WeakPolarHBondContact CD2-OE1 3.33Å; L365-E369 WeakPolarHBondContact O-CG 3.39Å; L365-E369 PolarHBondContact O-N 3.06Å; S366-E369 PolarHBondContact O-N 3.43Å; E369-K371 VanDerWaalsContact C-N 3.34Å; E369-K371 PolarHBondContact O-N 2.85Å; E369-I372 PolarHBondContact O-N 2.81Å; E369-A373 PolarHBondContact O-N 2.76Å
370	E	91	Very high	91	Very high	133 Å²	133	104.1 Å²	104.1	62%	0.621	53%	0.53	S	S	*	.	H	α-helix	trans	-63.1	-38.4	176.8	-169.2	178.8	-172.2	0	0	112.4	S366 A368 A373 S374	S366-E370 PolarHBondContact O-N 3.34Å; A368-E370 PolarHBondContact O-N 3.18Å; E370-A373 PolarHBondContact O-N 3.44Å; E370-S374 WeakPolarHBondContact O-CB 3.35Å; E370-S374 PolarHBondContact O-N 3.1Å; E370-S374 PolarHBondContact O-OG 3.45Å
371	K	92.6	Very high	90.8	Very high	140 Å²	140	105 Å²	105	61%	0.609	53%	0.531	S	S	*	.	H	α-helix	trans	-66	-42.5	174.4	-74.9	175	-178.6	178.4	0	112.1	T367 A368 E369 S374 Q375	T367-K371 WeakPolarHBondContact O-CG 3.4Å; T367-K371 PolarHBondContact O-N 3.17Å; A368-K371 PolarHBondContact O-N 2.92Å; E369-K371 VanDerWaalsContact C-N 3.34Å; E369-K371 PolarHBondContact O-N 2.85Å; K371-S374 WeakPolarHBondContact O-CB 3.47Å; K371-S374 PolarHBondContact O-N 3.48Å; K371-Q375 WeakPolarHBondContact O-CG 3.22Å; K371-Q375 PolarHBondContact O-N 3.01Å
372	I	91.1	Very high	90.4	Very high	89 Å²	89	105.4 Å²	105.4	46%	0.456	53%	0.533	S	S	.	.	H	α-helix	trans	-63	-45.3	176.8	-69.4	168.1	0	0	0	110.3	A368 E369 S374 Q375 Q376	A368-I372 WeakPolarHBondContact O-CG1 3.39Å; A368-I372 PolarHBondContact O-N 3.24Å; E369-I372 PolarHBondContact O-N 2.81Å; I372-S374 VanDerWaalsContact C-N 3.3Å; I372-S374 PolarHBondContact O-N 2.88Å; I372-Q375 PolarHBondContact O-N 3.42Å; I372-Q376 HydrophobicContact CG2-CG 4.4Å; I372-Q376 WeakPolarHBondContact O-CG 3.33Å; I372-Q376 PolarHBondContact O-N 3.46Å
373	A	89.8	Confident	89.9	Confident	55 Å²	55	100.8 Å²	100.8	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-40.3	176.5	0	0	0	0	0	112	E369 E370 Q376 K377	E369-A373 PolarHBondContact O-N 2.76Å; E370-A373 PolarHBondContact O-N 3.44Å; A373-Q376 PolarHBondContact O-N 3.04Å; A373-K377 PolarHBondContact O-N 3.04Å
374	S	90	Very high	89.3	Confident	73 Å²	73	100.3 Å²	100.3	51%	0.51	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-42.4	175.9	-58.3	0	0	0	0	112.2	E370 K371 I372 K377 L378	E370-S374 WeakPolarHBondContact O-CB 3.35Å; E370-S374 PolarHBondContact O-N 3.1Å; E370-S374 PolarHBondContact O-OG 3.45Å; K371-S374 WeakPolarHBondContact O-CB 3.47Å; K371-S374 PolarHBondContact O-N 3.48Å; I372-S374 VanDerWaalsContact C-N 3.3Å; I372-S374 PolarHBondContact O-N 2.88Å; S374-K377 PolarHBondContact O-N 3.35Å; S374-L378 PolarHBondContact O-N 3.23Å; S374-L378 VanDerWaalsContact O-N 3.17Å
375	Q	89	Confident	88.6	Confident	125 Å²	125	98.5 Å²	98.5	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-67.9	-40.9	177.1	-74.7	178.2	-24.3	0	0	112.3	K371 I372 K377 L378 I379	K371-Q375 WeakPolarHBondContact O-CG 3.22Å; K371-Q375 PolarHBondContact O-N 3.01Å; I372-Q375 PolarHBondContact O-N 3.42Å; Q375-K377 VanDerWaalsContact C-N 3.31Å; Q375-K377 PolarHBondContact O-N 3.36Å; Q375-L378 WeakPolarHBondContact O-CB 3.19Å; Q375-L378 PolarHBondContact O-N 3.34Å; Q375-I379 WeakPolarHBondContact O-CG1 3.32Å; Q375-I379 PolarHBondContact O-N 3.46Å
376	Q	92.5	Very high	87.8	Confident	116 Å²	116	99.1 Å²	99.1	54%	0.542	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-40.4	175.1	-74.4	174.7	-15.7	0	0	111.8	I372 A373 L378 I379 I380	I372-Q376 HydrophobicContact CG2-CG 4.4Å; I372-Q376 WeakPolarHBondContact O-CG 3.33Å; I372-Q376 PolarHBondContact O-N 3.46Å; A373-Q376 PolarHBondContact O-N 3.04Å; Q376-L378 VanDerWaalsContact C-N 3.34Å; Q376-L378 PolarHBondContact O-N 3.39Å; Q376-I379 PolarHBondContact O-N 2.95Å; Q376-I380 WeakPolarHBondContact O-CG1 3.25Å; Q376-I380 PolarHBondContact O-N 3.44Å; Q376-I380 VanDerWaalsContact O-N 3.13Å
377	K	91.4	Very high	86.7	Confident	155 Å²	155	100.5 Å²	100.5	67%	0.674	52%	0.519	S	S	*	.	H	α-helix	trans	-61.2	-42.2	174.7	-171.4	-177.7	177.4	-173.9	0	112.2	A373 S374 Q375 I380 E381	A373-K377 PolarHBondContact O-N 3.04Å; S374-K377 PolarHBondContact O-N 3.35Å; Q375-K377 VanDerWaalsContact C-N 3.31Å; Q375-K377 PolarHBondContact O-N 3.36Å; K377-I380 PolarHBondContact O-N 2.91Å; K377-E381 PolarHBondContact O-N 2.99Å; K377-E381 VanDerWaalsContact O-N 3.1Å
378	L	92.2	Very high	85.4	Confident	101 Å²	101	103.5 Å²	103.5	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-40.7	177.3	-170.7	76.3	0	0	0	111.9	S374 Q375 Q376 E381 L382	S374-L378 PolarHBondContact O-N 3.23Å; S374-L378 VanDerWaalsContact O-N 3.17Å; Q375-L378 WeakPolarHBondContact O-CB 3.19Å; Q375-L378 PolarHBondContact O-N 3.34Å; Q376-L378 VanDerWaalsContact C-N 3.34Å; Q376-L378 PolarHBondContact O-N 3.39Å; L378-E381 PolarHBondContact O-N 3.31Å; L378-L382 HydrophobicContact CG-CD1 4.34Å; L378-L382 WeakPolarHBondContact O-CG 3.41Å; L378-L382 PolarHBondContact O-N 3.32Å
379	I	87.2	Confident	84.2	Confident	91 Å²	91	106.7 Å²	106.7	47%	0.467	54%	0.537	S	S	.	.	H	α-helix	trans	-61.3	-46.7	177.3	-68.8	166.8	0	0	0	110.5	Q375 Q376 E381 L382 E383	Q375-I379 WeakPolarHBondContact O-CG1 3.32Å; Q375-I379 PolarHBondContact O-N 3.46Å; Q376-I379 PolarHBondContact O-N 2.95Å; I379-E381 VanDerWaalsContact C-N 3.3Å; I379-E381 PolarHBondContact O-N 3.28Å; I379-L382 PolarHBondContact O-N 2.9Å; I379-E383 HydrophobicContact CG2-CG 4.43Å; I379-E383 WeakPolarHBondContact O-CG 3.45Å; I379-E383 PolarHBondContact O-N 2.88Å
380	I	88.1	Confident	82.7	Confident	95 Å²	95	107 Å²	107	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-61.3	-39	178.1	-66.1	165.8	0	0	0	111.4	Q376 K377 N384	Q376-I380 WeakPolarHBondContact O-CG1 3.25Å; Q376-I380 PolarHBondContact O-N 3.44Å; Q376-I380 VanDerWaalsContact O-N 3.13Å; K377-I380 PolarHBondContact O-N 2.91Å; I380-N384 WeakPolarHBondContact O-CB 3.37Å; I380-N384 PolarHBondContact O-N 2.89Å; I380-N384 PolarHBondContact O-ND2 3.22Å
381	E	87.5	Confident	80.8	Confident	110 Å²	110	108.9 Å²	108.9	51%	0.514	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-41.7	176.5	-172.4	171.9	178	0	0	112.1	K377 L378 I379 N384 N385	K377-E381 PolarHBondContact O-N 2.99Å; K377-E381 VanDerWaalsContact O-N 3.1Å; L378-E381 PolarHBondContact O-N 3.31Å; I379-E381 VanDerWaalsContact C-N 3.3Å; I379-E381 PolarHBondContact O-N 3.28Å; E381-N384 PolarHBondContact O-N 3.46Å; E381-N385 PolarHBondContact O-N 3.09Å; E381-N385 PolarHBondContact O-ND2 2.99Å
382	L	81.2	Confident	79.1	Confident	106 Å²	106	107.8 Å²	107.8	56%	0.555	55%	0.549	S	S	*	.	H	α-helix	trans	-66.3	-41.3	175.7	-71.2	172.1	0	0	0	112.4	L378 I379 N384 N385 L386	L378-L382 HydrophobicContact CG-CD1 4.34Å; L378-L382 WeakPolarHBondContact O-CG 3.41Å; L378-L382 PolarHBondContact O-N 3.32Å; I379-L382 PolarHBondContact O-N 2.9Å; L382-N384 VanDerWaalsContact C-N 3.33Å; L382-N384 PolarHBondContact O-N 2.78Å; L382-N385 PolarHBondContact O-N 3.03Å; L382-L386 WeakPolarHBondContact O-CB 3.4Å; L382-L386 PolarHBondContact O-N 2.92Å
383	E	82.7	Confident	77	Confident	109 Å²	109	107.7 Å²	107.7	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-62.9	-39.3	175.5	-73.7	177.6	162.6	0	0	112	I379 L386 N387	I379-E383 HydrophobicContact CG2-CG 4.43Å; I379-E383 WeakPolarHBondContact O-CG 3.45Å; I379-E383 PolarHBondContact O-N 2.88Å; E383-L386 PolarHBondContact O-N 3.08Å; E383-N387 WeakPolarHBondContact O-CB 3.23Å; E383-N387 PolarHBondContact O-N 3.36Å; E383-N387 PolarHBondContact O-ND2 3.44Å
384	N	80.3	Confident	74.8	Confident	94 Å²	94	109.7 Å²	109.7	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-65.4	-40.5	174.6	-78.5	-32.7	0	0	0	112.4	I380 E381 L382 N387 Q388	I380-N384 WeakPolarHBondContact O-CB 3.37Å; I380-N384 PolarHBondContact O-N 2.89Å; I380-N384 PolarHBondContact O-ND2 3.22Å; E381-N384 PolarHBondContact O-N 3.46Å; L382-N384 VanDerWaalsContact C-N 3.33Å; L382-N384 PolarHBondContact O-N 2.78Å; N384-N387 PolarHBondContact O-N 2.81Å; N384-Q388 PolarHBondContact O-N 3.17Å; N384-Q388 VanDerWaalsContact O-N 3.08Å
385	N	78.5	Confident	72.2	Confident	80 Å²	80	115.5 Å²	115.5	43%	0.428	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-41.5	174.9	-77.8	-32.5	0	0	0	111.8	E381 L382 N387 Q388 I389	E381-N385 PolarHBondContact O-N 3.09Å; E381-N385 PolarHBondContact O-ND2 2.99Å; L382-N385 PolarHBondContact O-N 3.03Å; N385-N387 PolarHBondContact O-N 2.99Å; N385-Q388 PolarHBondContact O-N 3.27Å; N385-I389 WeakPolarHBondContact O-CG1 3.48Å; N385-I389 PolarHBondContact O-N 2.92Å
386	L	73.5	Confident	69.9	Low	117 Å²	117	113.1 Å²	113.1	61%	0.613	58%	0.576	S	S	*	*	H	α-helix	trans	-61.9	-43.5	176.3	-169.6	73.9	0	0	0	111.5	L382 E383 Q388 I389 N390	L382-L386 WeakPolarHBondContact O-CB 3.4Å; L382-L386 PolarHBondContact O-N 2.92Å; E383-L386 PolarHBondContact O-N 3.08Å; L386-Q388 VanDerWaalsContact C-N 3.32Å; L386-Q388 PolarHBondContact O-N 2.86Å; L386-I389 PolarHBondContact O-N 3.31Å; L386-N390 WeakPolarHBondContact O-CB 3.45Å; L386-N390 PolarHBondContact O-N 3.41Å
387	N	70	Confident	67.4	Low	97 Å²	97	111.1 Å²	111.1	52%	0.519	58%	0.575	S	S	.	*	H	α-helix	trans	-64.8	-32.7	177.2	-79.8	-35	0	0	0	113.2	E383 N384 N385 K391	E383-N387 WeakPolarHBondContact O-CB 3.23Å; E383-N387 PolarHBondContact O-N 3.36Å; E383-N387 PolarHBondContact O-ND2 3.44Å; N384-N387 PolarHBondContact O-N 2.81Å; N385-N387 PolarHBondContact O-N 2.99Å; N387-K391 PolarHBondContact O-N 3.05Å
388	Q	64.1	Low	65.1	Low	126 Å²	126	111.9 Å²	111.9	59%	0.589	58%	0.581	S	S	*	*	H	α-helix	trans	-68.9	-44.6	172.5	-85.4	-159.7	56.6	0	0	112.4	N384 N385 L386 N390 K391 N392	N384-Q388 PolarHBondContact O-N 3.17Å; N384-Q388 VanDerWaalsContact O-N 3.08Å; N385-Q388 PolarHBondContact O-N 3.27Å; L386-Q388 VanDerWaalsContact C-N 3.32Å; L386-Q388 PolarHBondContact O-N 2.86Å; Q388-N390 VanDerWaalsContact C-N 3.29Å; Q388-N390 PolarHBondContact O-N 2.77Å; Q388-K391 PolarHBondContact O-N 3.46Å; Q388-N392 PolarHBondContact O-N 3.46Å
389	I	63.5	Low	63	Low	114 Å²	114	113.4 Å²	113.4	59%	0.585	60%	0.595	S	S	*	*	H	α-helix	trans	-60.7	-43.1	179.8	-68.3	166.8	0	0	0	110.3	N385 L386 K391 N392 T393	N385-I389 WeakPolarHBondContact O-CG1 3.48Å; N385-I389 PolarHBondContact O-N 2.92Å; L386-I389 PolarHBondContact O-N 3.31Å; I389-K391 PolarHBondContact O-N 3.39Å; I389-N392 PolarHBondContact O-N 2.75Å; I389-T393 PolarHBondContact O-N 3.49Å; I389-T393 PolarHBondContact O-OG1 2.74Å
390	N	60.2	Low	61.1	Low	121 Å²	121	114.9 Å²	114.9	65%	0.647	60%	0.599	S	S	*	*	H	α-helix	trans	-69.8	-30.4	-176.7	-149.9	11.9	0	0	0	113.1	L386 Q388	L386-N390 WeakPolarHBondContact O-CB 3.45Å; L386-N390 PolarHBondContact O-N 3.41Å; Q388-N390 VanDerWaalsContact C-N 3.29Å; Q388-N390 PolarHBondContact O-N 2.77Å
391	K	51.3	Low	59.2	Low	172 Å²	172	116.1 Å²	116.1	75%	0.748	61%	0.607	S	S	*	*	H	α-helix	trans	-71.6	-33	174.9	-82.8	-180	177.6	175.4	0	113.1	N387 Q388 I389	N387-K391 PolarHBondContact O-N 3.05Å; Q388-K391 PolarHBondContact O-N 3.46Å; I389-K391 PolarHBondContact O-N 3.39Å
392	N	56	Low	57.6	Low	117 Å²	117	115.2 Å²	115.2	63%	0.626	61%	0.61	S	S	*	*	H	α-helix	trans	-85.5	-16.2	-173.4	-68	-10	0	0	0	113.7	Q388 I389	Q388-N392 PolarHBondContact O-N 3.46Å; I389-N392 PolarHBondContact O-N 2.75Å
393	T	47.2	Very low	56.3	Low	88 Å²	88	117.3 Å²	117.3	54%	0.54	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-13.3	-177.5	5.4	0	0	0	0	114.1	I389 F395	I389-T393 PolarHBondContact O-N 3.49Å; I389-T393 PolarHBondContact O-OG1 2.74Å; T393-F395 PolarHBondContact O-N 2.94Å
394	C	43.9	Very low	55.1	Low	96 Å²	96	115.9 Å²	115.9	65%	0.649	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-11.8	-169.7	-163.8	0	0	0	0	115.3
395	F	35.4	Very low	54.4	Low	196 Å²	196	116.4 Å²	116.4	86%	0.86	62%	0.617	S	S	*	*	S	Bend	trans	-121.6	6.5	-166.9	-90.9	-75.3	0	0	0	118.4	T393	T393-F395 PolarHBondContact O-N 2.94Å
396	S	41	Very low	54.3	Low	74 Å²	74	117.3 Å²	117.3	52%	0.517	62%	0.622	S	S	.	*			trans	-138.5	18.5	-172.8	28.5	0	0	0	0	116.1	Q398	S396-Q398 PolarHBondContact O-N 2.84Å
397	S	39.2	Very low	54.3	Low	74 Å²	74	113.5 Å²	113.5	52%	0.517	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	-5.2	-166.3	-41.9	0	0	0	0	117.4
398	Q	43.9	Very low	54.8	Low	172 Å²	172	111.9 Å²	111.9	80%	0.804	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-5.8	-165.2	-149.8	57.6	35	0	0	118.1	S396	S396-Q398 PolarHBondContact O-N 2.84Å
399	T	48.1	Very low	55.4	Low	133 Å²	133	109.6 Å²	109.6	82%	0.816	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.8	-3.5	174.2	-4.1	0	0	0	0	118.3
400	Q	46.7	Very low	56.2	Low	121 Å²	121	113 Å²	113	57%	0.565	60%	0.597	S	S	*	*	S	Bend	trans	-109.4	-7.9	177.1	-79.6	167.9	-29.8	0	0	114.6	P402 M403 D404	Q400-P402 VanDerWaalsContact C-CD 3.47Å; Q400-P402 VanDerWaalsContact O-N 3.16Å; Q400-M403 PolarHBondContact O-N 3.38Å; Q400-D404 WeakPolarHBondContact CB-OD2 3.17Å; Q400-D404 WeakPolarHBondContact O-CB 3.43Å; Q400-D404 PolarHBondContact O-N 3.21Å
401	L	49.2	Very low	57.3	Low	122 Å²	122	112.4 Å²	112.4	64%	0.639	59%	0.594	S	S	*	*	H	α-helix	trans	-50.4	-43.5	-176.6	-156.6	81.3	0	0	0	114.9	L405	L401-L405 WeakPolarHBondContact O-CB 3.3Å; L401-L405 PolarHBondContact O-N 2.64Å
402	P	52.9	Low	58.9	Low	91 Å²	91	109.4 Å²	109.4	59%	0.591	58%	0.583	S	S	*	*	H	α-helix	trans	-74.5	-30.7	-179	-13.4	28.9	0	0	0	113	Q400 N406	Q400-P402 VanDerWaalsContact C-CD 3.47Å; Q400-P402 VanDerWaalsContact O-N 3.16Å; P402-N406 PolarHBondContact O-N 2.82Å; P402-N406 PolarHBondContact O-ND2 2.74Å
403	M	55.4	Low	60.1	Low	149 Å²	149	107.6 Å²	107.6	73%	0.734	58%	0.576	S	S	*	*	H	α-helix	trans	-81	-40.3	-178.9	-156.6	169.9	-71.4	0	0	110.3	Q400 N406 A407	Q400-M403 PolarHBondContact O-N 3.38Å; M403-N406 PolarHBondContact O-N 3.37Å; M403-A407 WeakPolarHBondContact O-CB 3.5Å; M403-A407 PolarHBondContact O-N 3.39Å
404	D	56.5	Low	62	Low	79 Å²	79	104.8 Å²	104.8	42%	0.422	57%	0.565	S	S	.	*	H	α-helix	trans	-69.5	-38.5	174.5	-70.2	-14.3	0	0	0	111.5	Q400 A407 T408	Q400-D404 WeakPolarHBondContact CB-OD2 3.17Å; Q400-D404 WeakPolarHBondContact O-CB 3.43Å; Q400-D404 PolarHBondContact O-N 3.21Å; D404-A407 CarbonylContact O-C 3.42Å; D404-A407 PolarHBondContact O-N 2.96Å; D404-T408 WeakPolarHBondContact O-CA 3.46Å; D404-T408 WeakPolarHBondContact O-CB 3.23Å; D404-T408 PolarHBondContact O-N 2.89Å; D404-T408 PolarHBondContact O-OG1 2.88Å
405	L	66.1	Low	64.1	Low	106 Å²	106	106.7 Å²	106.7	56%	0.555	56%	0.564	S	S	*	*	H	α-helix	trans	-63.9	-45.9	175.7	-173.8	70.6	0	0	0	110.7	L401 T408 I409	L401-L405 WeakPolarHBondContact O-CB 3.3Å; L401-L405 PolarHBondContact O-N 2.64Å; L405-T408 PolarHBondContact O-N 2.74Å; L405-I409 HydrophobicContact CD1-CD1 4.42Å; L405-I409 HydrophobicContact CG-CD1 3.97Å; L405-I409 WeakPolarHBondContact O-CB 3.38Å; L405-I409 VanDerWaalsContact O-CG1 3.26Å; L405-I409 WeakPolarHBondContact O-CG1 3.45Å; L405-I409 PolarHBondContact O-N 2.97Å
406	N	76.6	Confident	66.5	Low	98 Å²	98	102.2 Å²	102.2	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-65.6	-38.5	175.4	-90.2	-51.1	0	0	0	112.5	P402 M403 T408 R410	P402-N406 PolarHBondContact O-N 2.82Å; P402-N406 PolarHBondContact O-ND2 2.74Å; M403-N406 PolarHBondContact O-N 3.37Å; N406-T408 VanDerWaalsContact C-N 3.34Å; N406-R410 WeakPolarHBondContact O-CB 3.48Å; N406-R410 PolarHBondContact O-N 2.66Å
407	A	72.4	Confident	68.9	Low	37 Å²	37	102.2 Å²	102.2	31%	0.306	55%	0.549	S	S	.	.	H	α-helix	trans	-65.6	-38.6	174.3	0	0	0	0	0	111.5	M403 D404 R410 N411	M403-A407 WeakPolarHBondContact O-CB 3.5Å; M403-A407 PolarHBondContact O-N 3.39Å; D404-A407 CarbonylContact O-C 3.42Å; D404-A407 PolarHBondContact O-N 2.96Å; A407-R410 PolarHBondContact O-N 3.12Å; A407-N411 WeakPolarHBondContact O-CB 3.41Å; A407-N411 PolarHBondContact O-N 3.35Å; A407-N411 PolarHBondContact O-ND2 3.42Å
408	T	80.8	Confident	71.3	Confident	64 Å²	64	106.3 Å²	106.3	39%	0.393	56%	0.558	S	S	.	*	H	α-helix	trans	-69.6	-45.7	178.5	-56.2	0	0	0	0	110.3	D404 L405 N406 R410 N411 Q412	D404-T408 WeakPolarHBondContact O-CA 3.46Å; D404-T408 WeakPolarHBondContact O-CB 3.23Å; D404-T408 PolarHBondContact O-N 2.89Å; D404-T408 PolarHBondContact O-OG1 2.88Å; L405-T408 PolarHBondContact O-N 2.74Å; N406-T408 VanDerWaalsContact C-N 3.34Å; T408-R410 VanDerWaalsContact C-N 3.33Å; T408-R410 PolarHBondContact O-N 3.47Å; T408-N411 PolarHBondContact O-N 3.44Å; T408-Q412 HydrophobicContact CG2-CG 4.2Å; T408-Q412 VanDerWaalsContact O-CB 3.29Å; T408-Q412 WeakPolarHBondContact O-CB 3.38Å; T408-Q412 VanDerWaalsContact O-CG 3.27Å; T408-Q412 WeakPolarHBondContact O-CG 3.3Å; T408-Q412 PolarHBondContact O-N 3.2Å
409	I	77.6	Confident	73.6	Confident	78 Å²	78	102.7 Å²	102.7	40%	0.4	54%	0.543	S	S	.	.	H	α-helix	trans	-60.6	-45.4	174.3	-68.7	167.4	0	0	0	109.7	L405 N411 Q412 T413	L405-I409 HydrophobicContact CD1-CD1 4.42Å; L405-I409 HydrophobicContact CG-CD1 3.97Å; L405-I409 WeakPolarHBondContact O-CB 3.38Å; L405-I409 VanDerWaalsContact O-CG1 3.26Å; L405-I409 WeakPolarHBondContact O-CG1 3.45Å; L405-I409 PolarHBondContact O-N 2.97Å; I409-N411 VanDerWaalsContact C-N 3.34Å; I409-N411 PolarHBondContact O-N 3.44Å; I409-Q412 PolarHBondContact O-N 2.97Å; I409-T413 VanDerWaalsContact O-CB 3.23Å; I409-T413 WeakPolarHBondContact O-CB 3.49Å; I409-T413 PolarHBondContact O-N 2.94Å; I409-T413 PolarHBondContact O-OG1 3.49Å
410	R	80.2	Confident	75.6	Confident	184 Å²	184	101.6 Å²	101.6	69%	0.694	53%	0.531	S	S	*	.	H	α-helix	trans	-65.5	-38	179	-164	-176.5	-67.9	144.5	-2.8	111.8	N406 A407 T408 G414	N406-R410 WeakPolarHBondContact O-CB 3.48Å; N406-R410 PolarHBondContact O-N 2.66Å; A407-R410 PolarHBondContact O-N 3.12Å; T408-R410 VanDerWaalsContact C-N 3.33Å; T408-R410 PolarHBondContact O-N 3.47Å; R410-G414 PolarHBondContact O-N 3.34Å
411	N	82.7	Confident	77.8	Confident	109 Å²	109	100.9 Å²	100.9	58%	0.583	53%	0.528	S	S	*	.	H	α-helix	trans	-68.9	-48.2	175.1	-76.3	-15.7	0	0	0	111.4	A407 T408 I409 T413 G414 E415	A407-N411 WeakPolarHBondContact O-CB 3.41Å; A407-N411 PolarHBondContact O-N 3.35Å; A407-N411 PolarHBondContact O-ND2 3.42Å; T408-N411 PolarHBondContact O-N 3.44Å; I409-N411 VanDerWaalsContact C-N 3.34Å; I409-N411 PolarHBondContact O-N 3.44Å; N411-T413 VanDerWaalsContact C-N 3.35Å; N411-T413 PolarHBondContact O-N 2.83Å; N411-G414 CarbonylContact O-C 3.5Å; N411-G414 WeakPolarHBondContact O-CA 3.4Å; N411-G414 PolarHBondContact O-N 3.01Å; N411-G414 VanDerWaalsContact O-N 3.1Å; N411-E415 WeakPolarHBondContact O-CB 3.4Å; N411-E415 WeakPolarHBondContact O-CG 3.38Å; N411-E415 PolarHBondContact O-N 3.28Å
412	Q	84.1	Confident	79.9	Confident	110 Å²	110	97.9 Å²	97.9	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-61.8	-41.6	176.8	-74.8	178.9	-33.4	0	0	111.6	T408 I409 G414 E415 L416	T408-Q412 HydrophobicContact CG2-CG 4.2Å; T408-Q412 VanDerWaalsContact O-CB 3.29Å; T408-Q412 WeakPolarHBondContact O-CB 3.38Å; T408-Q412 VanDerWaalsContact O-CG 3.27Å; T408-Q412 WeakPolarHBondContact O-CG 3.3Å; T408-Q412 PolarHBondContact O-N 3.2Å; I409-Q412 PolarHBondContact O-N 2.97Å; Q412-G414 VanDerWaalsContact C-N 3.29Å; Q412-G414 PolarHBondContact O-N 2.93Å; Q412-E415 PolarHBondContact O-N 3.14Å; Q412-L416 VanDerWaalsContact O-CB 3.28Å; Q412-L416 WeakPolarHBondContact O-CB 3.46Å; Q412-L416 VanDerWaalsContact O-CG 3.31Å; Q412-L416 WeakPolarHBondContact O-CG 3.49Å; Q412-L416 PolarHBondContact O-N 3.26Å
413	T	81.3	Confident	81.7	Confident	78 Å²	78	97 Å²	97	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-66.4	-35.6	174.8	-50.9	0	0	0	0	111	I409 N411 S417	I409-T413 VanDerWaalsContact O-CB 3.23Å; I409-T413 WeakPolarHBondContact O-CB 3.49Å; I409-T413 PolarHBondContact O-N 2.94Å; I409-T413 PolarHBondContact O-OG1 3.49Å; N411-T413 VanDerWaalsContact C-N 3.35Å; N411-T413 PolarHBondContact O-N 2.83Å; T413-S417 WeakPolarHBondContact O-CB 3.32Å; T413-S417 PolarHBondContact O-N 2.92Å; T413-S417 PolarHBondContact O-OG 3.03Å
414	G	88	Confident	83.5	Confident	30 Å²	30	96.4 Å²	96.4	31%	0.309	50%	0.499	S	S	.	.	H	α-helix	trans	-69.2	-39.9	173.4	0	0	0	0	0	113.4	R410 N411 Q412 S417 K418	R410-G414 PolarHBondContact O-N 3.34Å; N411-G414 CarbonylContact O-C 3.5Å; N411-G414 WeakPolarHBondContact O-CA 3.4Å; N411-G414 PolarHBondContact O-N 3.01Å; N411-G414 VanDerWaalsContact O-N 3.1Å; Q412-G414 VanDerWaalsContact C-N 3.29Å; Q412-G414 PolarHBondContact O-N 2.93Å; G414-S417 PolarHBondContact O-N 3.4Å; G414-K418 WeakPolarHBondContact O-CB 3.49Å; G414-K418 WeakPolarHBondContact O-CG 3.2Å; G414-K418 PolarHBondContact O-N 2.94Å
415	E	87.9	Confident	85.2	Confident	135 Å²	135	97.1 Å²	97.1	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-69.1	-42	174.8	-75.1	-167.2	156	0	0	111.3	N411 Q412 K418 L419	N411-E415 WeakPolarHBondContact O-CB 3.4Å; N411-E415 WeakPolarHBondContact O-CG 3.38Å; N411-E415 PolarHBondContact O-N 3.28Å; Q412-E415 PolarHBondContact O-N 3.14Å; E415-K418 CarbonylContact O-C 3.44Å; E415-K418 PolarHBondContact O-N 3.48Å; E415-L419 VanDerWaalsContact O-CB 3.23Å; E415-L419 WeakPolarHBondContact O-CB 3.44Å; E415-L419 PolarHBondContact O-N 2.99Å
416	L	84.7	Confident	86.5	Confident	102 Å²	102	97.8 Å²	97.8	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-45.5	171.7	-78.3	168.9	0	0	0	111	Q412 K418 L419 I420	Q412-L416 VanDerWaalsContact O-CB 3.28Å; Q412-L416 WeakPolarHBondContact O-CB 3.46Å; Q412-L416 VanDerWaalsContact O-CG 3.31Å; Q412-L416 WeakPolarHBondContact O-CG 3.49Å; Q412-L416 PolarHBondContact O-N 3.26Å; L416-K418 VanDerWaalsContact C-N 3.33Å; L416-K418 PolarHBondContact O-N 3.41Å; L416-L419 PolarHBondContact O-N 3.33Å; L416-I420 VanDerWaalsContact O-CB 3.28Å; L416-I420 WeakPolarHBondContact O-CB 3.11Å; L416-I420 WeakPolarHBondContact O-CD1 3.39Å; L416-I420 WeakPolarHBondContact O-CG1 3.41Å; L416-I420 PolarHBondContact O-N 3.44Å
417	S	92.1	Very high	87.2	Confident	75 Å²	75	97.2 Å²	97.2	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-59	-42.9	173.2	-81.8	0	0	0	0	112.1	T413 G414 Q421	T413-S417 WeakPolarHBondContact O-CB 3.32Å; T413-S417 PolarHBondContact O-N 2.92Å; T413-S417 PolarHBondContact O-OG 3.03Å; G414-S417 PolarHBondContact O-N 3.4Å; S417-Q421 VanDerWaalsContact O-CB 3.28Å; S417-Q421 WeakPolarHBondContact O-CB 3.38Å; S417-Q421 PolarHBondContact O-N 2.69Å
418	K	90.8	Very high	88.3	Confident	159 Å²	159	101.2 Å²	101.2	69%	0.691	50%	0.502	S	S	*	.	H	α-helix	trans	-66.8	-40	176.5	-78.8	176.1	-177.7	175.7	0	112.4	G414 E415 L416 Q421 S422	G414-K418 WeakPolarHBondContact O-CB 3.49Å; G414-K418 WeakPolarHBondContact O-CG 3.2Å; G414-K418 PolarHBondContact O-N 2.94Å; E415-K418 CarbonylContact O-C 3.44Å; E415-K418 PolarHBondContact O-N 3.48Å; L416-K418 VanDerWaalsContact C-N 3.33Å; L416-K418 PolarHBondContact O-N 3.41Å; K418-Q421 PolarHBondContact O-N 2.91Å; K418-S422 WeakPolarHBondContact O-CB 3.43Å; K418-S422 PolarHBondContact O-N 2.84Å; K418-S422 PolarHBondContact O-OG 3.48Å
419	L	92	Very high	88.8	Confident	97 Å²	97	101.8 Å²	101.8	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-48.1	178.6	-176.4	66.4	0	0	0	109.8	E415 L416 Q421 S422 E423	E415-L419 VanDerWaalsContact O-CB 3.23Å; E415-L419 WeakPolarHBondContact O-CB 3.44Å; E415-L419 PolarHBondContact O-N 2.99Å; L416-L419 PolarHBondContact O-N 3.33Å; L419-Q421 VanDerWaalsContact C-N 3.32Å; L419-Q421 PolarHBondContact O-N 2.95Å; L419-S422 WeakPolarHBondContact CA-OG 3.42Å; L419-S422 PolarHBondContact O-N 3.17Å; L419-S422 VanDerWaalsContact O-N 3.14Å; L419-S422 PolarHBondContact O-OG 2.81Å; L419-E423 WeakPolarHBondContact O-CB 3.44Å; L419-E423 WeakPolarHBondContact O-CG 3.38Å; L419-E423 PolarHBondContact O-N 3.33Å
420	I	90.4	Very high	89.6	Confident	110 Å²	110	100.7 Å²	100.7	56%	0.564	50%	0.503	S	S	*	.	H	α-helix	trans	-57.4	-46.1	173.7	-69.4	165.6	0	0	0	110	L416 S422 E423 F424	L416-I420 VanDerWaalsContact O-CB 3.28Å; L416-I420 WeakPolarHBondContact O-CB 3.11Å; L416-I420 WeakPolarHBondContact O-CD1 3.39Å; L416-I420 WeakPolarHBondContact O-CG1 3.41Å; L416-I420 PolarHBondContact O-N 3.44Å; I420-S422 PolarHBondContact O-N 3.02Å; I420-E423 PolarHBondContact O-N 3.22Å; I420-F424 VanDerWaalsContact O-CB 3.31Å; I420-F424 WeakPolarHBondContact O-CB 3.4Å; I420-F424 PolarHBondContact O-N 3.41Å
421	Q	92.8	Very high	90.2	Very high	105 Å²	105	96.8 Å²	96.8	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-42	176.3	-172.3	64.5	31.1	0	0	111.8	S417 K418 L419 F424 E425	S417-Q421 VanDerWaalsContact O-CB 3.28Å; S417-Q421 WeakPolarHBondContact O-CB 3.38Å; S417-Q421 PolarHBondContact O-N 2.69Å; K418-Q421 PolarHBondContact O-N 2.91Å; L419-Q421 VanDerWaalsContact C-N 3.32Å; L419-Q421 PolarHBondContact O-N 2.95Å; Q421-F424 PolarHBondContact O-N 3.32Å; Q421-E425 PolarHBondContact NE2-OE1 3.3Å; Q421-E425 WeakPolarHBondContact O-CG 3.32Å; Q421-E425 PolarHBondContact O-N 3.47Å
422	S	91.6	Very high	90.7	Very high	60 Å²	60	96.7 Å²	96.7	42%	0.42	49%	0.491	S	S	.	.	H	α-helix	trans	-67.3	-37.3	178.4	73.2	0	0	0	0	112.5	K418 L419 I420 E425 R426	K418-S422 WeakPolarHBondContact O-CB 3.43Å; K418-S422 PolarHBondContact O-N 2.84Å; K418-S422 PolarHBondContact O-OG 3.48Å; L419-S422 WeakPolarHBondContact CA-OG 3.42Å; L419-S422 PolarHBondContact O-N 3.17Å; L419-S422 VanDerWaalsContact O-N 3.14Å; L419-S422 PolarHBondContact O-OG 2.81Å; I420-S422 PolarHBondContact O-N 3.02Å; S422-E425 PolarHBondContact O-N 2.9Å; S422-R426 VanDerWaalsContact O-CB 3.32Å; S422-R426 WeakPolarHBondContact O-CB 3.29Å; S422-R426 PolarHBondContact O-N 3.44Å
423	E	90.9	Very high	91.2	Very high	73 Å²	73	95.9 Å²	95.9	34%	0.341	49%	0.488	S	S	.	.	H	α-helix	trans	-70.3	-36	175	-78	-60	125.1	0	0	111.2	L419 I420 R426 L427	L419-E423 WeakPolarHBondContact O-CB 3.44Å; L419-E423 WeakPolarHBondContact O-CG 3.38Å; L419-E423 PolarHBondContact O-N 3.33Å; I420-E423 PolarHBondContact O-N 3.22Å; E423-R426 PolarHBondContact O-N 3.13Å; E423-R426 IonicContact OE1-NE 3.03Å; E423-R426 PolarHBondContact OE1-NE 3.37Å; E423-R426 VanDerWaalsContact OE1-NE 3.17Å; E423-R426 IonicContact OE2-CZ 3.74Å; E423-R426 IonicContact OE2-NE 3.54Å; E423-R426 PolarHBondContact OE2-NE 2.98Å; E423-R426 IonicContact OE2-NH2 3.16Å; E423-R426 PolarHBondContact OE2-NH2 2.86Å; E423-L427 WeakPolarHBondContact O-CB 3.46Å; E423-L427 PolarHBondContact O-N 3.47Å
424	F	93.5	Very high	91.7	Very high	136 Å²	136	96.5 Å²	96.5	60%	0.596	49%	0.487	S	S	*	.	H	α-helix	trans	-65.4	-42.9	173.9	-156.1	-88.1	0	0	0	111.6	I420 Q421 L427 K428	I420-F424 VanDerWaalsContact O-CB 3.31Å; I420-F424 WeakPolarHBondContact O-CB 3.4Å; I420-F424 PolarHBondContact O-N 3.41Å; Q421-F424 PolarHBondContact O-N 3.32Å; F424-L427 PolarHBondContact O-N 2.94Å; F424-K428 VanDerWaalsContact O-CB 3.27Å; F424-K428 WeakPolarHBondContact O-CB 3.35Å; F424-K428 PolarHBondContact O-N 3.46Å
425	E	91.9	Very high	91.9	Very high	93 Å²	93	101.6 Å²	101.6	44%	0.435	50%	0.498	S	S	.	.	H	α-helix	trans	-67	-37	173	-68.6	-59	157.7	0	0	112.2	Q421 S422 K428 S429	Q421-E425 PolarHBondContact NE2-OE1 3.3Å; Q421-E425 WeakPolarHBondContact O-CG 3.32Å; Q421-E425 PolarHBondContact O-N 3.47Å; S422-E425 PolarHBondContact O-N 2.9Å; E425-K428 PolarHBondContact O-N 3.46Å; E425-S429 WeakPolarHBondContact O-CB 3.29Å; E425-S429 PolarHBondContact O-N 2.76Å
426	R	93.3	Very high	92.2	Very high	121 Å²	121	98.8 Å²	98.8	46%	0.457	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-46.7	174.3	-171.5	-173.7	69.3	75.1	5.3	111.3	S422 E423 S429 I430	S422-R426 VanDerWaalsContact O-CB 3.32Å; S422-R426 WeakPolarHBondContact O-CB 3.29Å; S422-R426 PolarHBondContact O-N 3.44Å; E423-R426 PolarHBondContact O-N 3.13Å; E423-R426 IonicContact OE1-NE 3.03Å; E423-R426 PolarHBondContact OE1-NE 3.37Å; E423-R426 VanDerWaalsContact OE1-NE 3.17Å; E423-R426 IonicContact OE2-CZ 3.74Å; E423-R426 IonicContact OE2-NE 3.54Å; E423-R426 PolarHBondContact OE2-NE 2.98Å; E423-R426 IonicContact OE2-NH2 3.16Å; E423-R426 PolarHBondContact OE2-NH2 2.86Å; R426-S429 WeakPolarHBondContact O-CB 3.5Å; R426-S429 PolarHBondContact O-N 3.1Å; R426-I430 HydrophobicContact CG-CD1 4.14Å; R426-I430 WeakPolarHBondContact O-CG1 3.27Å; R426-I430 PolarHBondContact O-N 3.43Å
427	L	92.6	Very high	92.6	Very high	85 Å²	85	99.7 Å²	99.7	45%	0.445	49%	0.487	S	S	.	.	H	α-helix	trans	-59.9	-46.9	174.8	-92.3	152.3	0	0	0	111.1	E423 F424 S429 I430 D431	E423-L427 WeakPolarHBondContact O-CB 3.46Å; E423-L427 PolarHBondContact O-N 3.47Å; F424-L427 PolarHBondContact O-N 2.94Å; L427-S429 VanDerWaalsContact C-N 3.3Å; L427-S429 PolarHBondContact O-N 3.29Å; L427-I430 PolarHBondContact O-N 2.86Å; L427-I430 VanDerWaalsContact O-N 3.09Å; L427-D431 PolarHBondContact O-N 2.83Å
428	K	93.9	Very high	92.7	Very high	122 Å²	122	101.5 Å²	101.5	53%	0.53	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-39	176	-171.1	178.9	179	-174.5	0	112.4	F424 E425 Q432	F424-K428 VanDerWaalsContact O-CB 3.27Å; F424-K428 WeakPolarHBondContact O-CB 3.35Å; F424-K428 PolarHBondContact O-N 3.46Å; E425-K428 PolarHBondContact O-N 3.46Å; K428-Q432 VanDerWaalsContact O-CB 3.29Å; K428-Q432 WeakPolarHBondContact O-CB 3.37Å; K428-Q432 PolarHBondContact O-N 3.2Å
429	S	93.2	Very high	92.7	Very high	75 Å²	75	96.6 Å²	96.6	52%	0.524	47%	0.468	S	S	.	.	H	α-helix	trans	-65.4	-40.1	173.7	-174	0	0	0	0	112	E425 R426 L427 E433	E425-S429 WeakPolarHBondContact O-CB 3.29Å; E425-S429 PolarHBondContact O-N 2.76Å; R426-S429 WeakPolarHBondContact O-CB 3.5Å; R426-S429 PolarHBondContact O-N 3.1Å; L427-S429 VanDerWaalsContact C-N 3.3Å; L427-S429 PolarHBondContact O-N 3.29Å; S429-E433 WeakPolarHBondContact O-CB 3.34Å; S429-E433 PolarHBondContact O-N 2.93Å
430	I	93	Very high	92.8	Very high	56 Å²	56	95.8 Å²	95.8	29%	0.287	47%	0.468	S	S	.	.	H	α-helix	trans	-68.9	-45.5	177.9	-72.1	166.8	0	0	0	110.8	R426 L427 Q432 E433 I434	R426-I430 HydrophobicContact CG-CD1 4.14Å; R426-I430 WeakPolarHBondContact O-CG1 3.27Å; R426-I430 PolarHBondContact O-N 3.43Å; L427-I430 PolarHBondContact O-N 2.86Å; L427-I430 VanDerWaalsContact O-N 3.09Å; I430-Q432 VanDerWaalsContact C-N 3.29Å; I430-Q432 PolarHBondContact O-N 3.37Å; I430-E433 CarbonylContact O-C 3.53Å; I430-E433 WeakPolarHBondContact O-CA 3.11Å; I430-E433 WeakPolarHBondContact O-CB 3.18Å; I430-E433 PolarHBondContact O-N 2.81Å; I430-I434 HydrophobicContact CG2-CD1 3.68Å; I430-I434 HydrophobicContact CG2-CG1 4.25Å; I430-I434 VanDerWaalsContact O-CG1 3.3Å; I430-I434 WeakPolarHBondContact O-CG1 3.39Å; I430-I434 PolarHBondContact O-N 3.26Å
431	D	93	Very high	92.9	Very high	102 Å²	102	96 Å²	96	55%	0.545	46%	0.464	S	S	.	.	H	α-helix	trans	-59.7	-42.1	175.7	-78.2	-13.2	0	0	0	110.9	L427 E433 I434 Y435	L427-D431 PolarHBondContact O-N 2.83Å; D431-E433 VanDerWaalsContact C-N 3.33Å; D431-E433 PolarHBondContact O-N 3.38Å; D431-I434 PolarHBondContact O-N 3.44Å; D431-Y435 VanDerWaalsContact O-CB 3.32Å; D431-Y435 WeakPolarHBondContact O-CB 3.42Å; D431-Y435 PolarHBondContact O-N 2.92Å
432	Q	94.1	Very high	92.9	Very high	106 Å²	106	95.7 Å²	95.7	50%	0.495	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-38.5	173.6	-172.7	65.6	45.8	0	0	112	K428 I430 N436	K428-Q432 VanDerWaalsContact O-CB 3.29Å; K428-Q432 WeakPolarHBondContact O-CB 3.37Å; K428-Q432 PolarHBondContact O-N 3.2Å; I430-Q432 VanDerWaalsContact C-N 3.29Å; I430-Q432 PolarHBondContact O-N 3.37Å; Q432-N436 PolarHBondContact NE2-OD1 3.33Å; Q432-N436 WeakPolarHBondContact O-CB 3.42Å; Q432-N436 PolarHBondContact O-N 2.91Å; Q432-N436 PolarHBondContact O-ND2 3.34Å
433	E	93.2	Very high	92.9	Very high	93 Å²	93	100.9 Å²	100.9	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-69.2	-41.3	177.3	-163.7	-173.4	159.4	0	0	111.9	S429 I430 D431 N436 K437	S429-E433 WeakPolarHBondContact O-CB 3.34Å; S429-E433 PolarHBondContact O-N 2.93Å; I430-E433 CarbonylContact O-C 3.53Å; I430-E433 WeakPolarHBondContact O-CA 3.11Å; I430-E433 WeakPolarHBondContact O-CB 3.18Å; I430-E433 PolarHBondContact O-N 2.81Å; D431-E433 VanDerWaalsContact C-N 3.33Å; D431-E433 PolarHBondContact O-N 3.38Å; E433-N436 PolarHBondContact O-N 3.46Å; E433-K437 HydrophobicContact CG-CD 4.48Å; E433-K437 WeakPolarHBondContact O-CB 3.33Å; E433-K437 WeakPolarHBondContact O-CG 3.43Å; E433-K437 PolarHBondContact O-N 2.85Å; E433-K437 WeakPolarHBondContact OE1-CE 3.39Å; E433-K437 IonicContact OE1-NZ 2.77Å; E433-K437 PolarHBondContact OE1-NZ 3.37Å
434	I	93.1	Very high	93	Very high	92 Å²	92	103 Å²	103	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-48.3	174.6	-68.7	168.2	0	0	0	109.6	I430 D431 N436 K437 E438	I430-I434 HydrophobicContact CG2-CD1 3.68Å; I430-I434 HydrophobicContact CG2-CG1 4.25Å; I430-I434 VanDerWaalsContact O-CG1 3.3Å; I430-I434 WeakPolarHBondContact O-CG1 3.39Å; I430-I434 PolarHBondContact O-N 3.26Å; D431-I434 PolarHBondContact O-N 3.44Å; I434-N436 VanDerWaalsContact C-N 3.31Å; I434-N436 PolarHBondContact O-N 2.91Å; I434-K437 PolarHBondContact O-N 2.66Å; I434-K437 VanDerWaalsContact O-N 3.14Å; I434-E438 WeakPolarHBondContact O-CB 3.42Å; I434-E438 PolarHBondContact O-N 2.99Å
435	Y	92.7	Very high	93	Very high	136 Å²	136	101.5 Å²	101.5	53%	0.533	48%	0.481	S	S	.	.	H	α-helix	trans	-57.4	-44	176	-179.8	-96.3	0	0	0	111.8	D431 E438 L439	D431-Y435 VanDerWaalsContact O-CB 3.32Å; D431-Y435 WeakPolarHBondContact O-CB 3.42Å; D431-Y435 PolarHBondContact O-N 2.92Å; Y435-E438 PolarHBondContact O-N 3.23Å; Y435-L439 HydrophobicContact CE1-CD1 3.97Å; Y435-L439 WeakPolarHBondContact O-CB 3.45Å; Y435-L439 PolarHBondContact O-N 3.37Å
436	N	93.2	Very high	93	Very high	77 Å²	77	103.7 Å²	103.7	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-38.2	176.6	-71.2	-22.8	0	0	0	112.5	Q432 E433 I434 L439 T440	Q432-N436 PolarHBondContact NE2-OD1 3.33Å; Q432-N436 WeakPolarHBondContact O-CB 3.42Å; Q432-N436 PolarHBondContact O-N 2.91Å; Q432-N436 PolarHBondContact O-ND2 3.34Å; E433-N436 PolarHBondContact O-N 3.46Å; I434-N436 VanDerWaalsContact C-N 3.31Å; I434-N436 PolarHBondContact O-N 2.91Å; N436-L439 PolarHBondContact O-N 3.06Å; N436-T440 WeakPolarHBondContact O-CB 3.5Å; N436-T440 WeakPolarHBondContact O-CG2 3.29Å; N436-T440 PolarHBondContact O-N 3.09Å; N436-T440 PolarHBondContact O-OG1 3.5Å
437	K	93.8	Very high	93.1	Very high	120 Å²	120	103.4 Å²	103.4	52%	0.522	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-41.1	175	-78.5	175.6	-176.5	166.2	0	111.8	E433 I434 T440 F441	E433-K437 HydrophobicContact CG-CD 4.48Å; E433-K437 WeakPolarHBondContact O-CB 3.33Å; E433-K437 WeakPolarHBondContact O-CG 3.43Å; E433-K437 PolarHBondContact O-N 2.85Å; E433-K437 WeakPolarHBondContact OE1-CE 3.39Å; E433-K437 IonicContact OE1-NZ 2.77Å; E433-K437 PolarHBondContact OE1-NZ 3.37Å; I434-K437 PolarHBondContact O-N 2.66Å; I434-K437 VanDerWaalsContact O-N 3.14Å; K437-T440 VanDerWaalsContact CA-OG1 3.26Å; K437-T440 WeakPolarHBondContact CA-OG1 3.3Å; K437-T440 PolarHBondContact O-N 3.38Å; K437-T440 PolarHBondContact O-OG1 3.32Å; K437-F441 VanDerWaalsContact O-CB 3.27Å; K437-F441 WeakPolarHBondContact O-CB 3.47Å; K437-F441 PolarHBondContact O-N 2.99Å
438	E	93.1	Very high	93	Very high	114 Å²	114	103.6 Å²	103.6	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-42	175.3	-173.5	164	-164.1	0	0	111.3	I434 Y435 T440 F441 L442	I434-E438 WeakPolarHBondContact O-CB 3.42Å; I434-E438 PolarHBondContact O-N 2.99Å; Y435-E438 PolarHBondContact O-N 3.23Å; E438-T440 VanDerWaalsContact C-N 3.34Å; E438-T440 PolarHBondContact O-N 3.44Å; E438-F441 PolarHBondContact O-N 2.71Å; E438-L442 HydrophobicContact CG-CD1 4.18Å; E438-L442 WeakPolarHBondContact O-CB 3.39Å; E438-L442 VanDerWaalsContact O-CG 3.3Å; E438-L442 WeakPolarHBondContact O-CG 3.47Å; E438-L442 PolarHBondContact O-N 2.66Å
439	L	91.4	Very high	92.9	Very high	55 Å²	55	100 Å²	100	29%	0.288	49%	0.488	S	S	.	.	H	α-helix	trans	-65.9	-35.7	177.1	-154.5	116.8	0	0	0	112.5	Y435 N436 R443	Y435-L439 HydrophobicContact CE1-CD1 3.97Å; Y435-L439 WeakPolarHBondContact O-CB 3.45Å; Y435-L439 PolarHBondContact O-N 3.37Å; N436-L439 PolarHBondContact O-N 3.06Å; L439-R443 VanDerWaalsContact CD2-CZ 3.43Å; L439-R443 WeakPolarHBondContact O-CB 3.39Å; L439-R443 WeakPolarHBondContact O-CG 3.4Å; L439-R443 PolarHBondContact O-N 3.37Å; L439-R443 VanDerWaalsContact O-N 3.11Å
440	T	93	Very high	92.9	Very high	81 Å²	81	99.9 Å²	99.9	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-71.2	-43.2	173.9	45.1	0	0	0	0	111.8	N436 K437 E438 L442 R443 E444	N436-T440 WeakPolarHBondContact O-CB 3.5Å; N436-T440 WeakPolarHBondContact O-CG2 3.29Å; N436-T440 PolarHBondContact O-N 3.09Å; N436-T440 PolarHBondContact O-OG1 3.5Å; K437-T440 VanDerWaalsContact CA-OG1 3.26Å; K437-T440 WeakPolarHBondContact CA-OG1 3.3Å; K437-T440 PolarHBondContact O-N 3.38Å; K437-T440 PolarHBondContact O-OG1 3.32Å; E438-T440 VanDerWaalsContact C-N 3.34Å; E438-T440 PolarHBondContact O-N 3.44Å; T440-L442 PolarHBondContact O-N 2.98Å; T440-R443 WeakPolarHBondContact O-CB 3.35Å; T440-R443 PolarHBondContact O-N 2.93Å; T440-E444 WeakPolarHBondContact O-CB 3.33Å; T440-E444 PolarHBondContact O-N 3.21Å
441	F	93.7	Very high	92.7	Very high	113 Å²	113	100.1 Å²	100.1	50%	0.496	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-43.4	174.9	178	-109.6	0	0	0	112.7	K437 E438 R443 E444 Q445	K437-F441 VanDerWaalsContact O-CB 3.27Å; K437-F441 WeakPolarHBondContact O-CB 3.47Å; K437-F441 PolarHBondContact O-N 2.99Å; E438-F441 PolarHBondContact O-N 2.71Å; F441-R443 VanDerWaalsContact C-N 3.35Å; F441-E444 PolarHBondContact O-N 3.04Å; F441-Q445 HydrophobicContact CE1-CG 4.41Å; F441-Q445 HydrophobicContact CE2-CG 4.38Å; F441-Q445 HydrophobicContact CZ-CG 4.19Å; F441-Q445 PolarHBondContact O-N 3.35Å
442	L	92.5	Very high	92.6	Very high	100 Å²	100	101.1 Å²	101.1	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-36.6	175.6	-72	172.7	0	0	0	112.1	E438 T440 K446	E438-L442 HydrophobicContact CG-CD1 4.18Å; E438-L442 WeakPolarHBondContact O-CB 3.39Å; E438-L442 VanDerWaalsContact O-CG 3.3Å; E438-L442 WeakPolarHBondContact O-CG 3.47Å; E438-L442 PolarHBondContact O-N 2.66Å; T440-L442 PolarHBondContact O-N 2.98Å; L442-K446 VanDerWaalsContact O-CB 3.29Å; L442-K446 WeakPolarHBondContact O-CB 3.27Å; L442-K446 PolarHBondContact O-N 3.47Å
443	R	92.7	Very high	92.2	Very high	168 Å²	168	100.1 Å²	100.1	63%	0.634	49%	0.492	S	S	*	.	H	α-helix	trans	-65.6	-42.2	173	-77.8	172.2	-179.4	-176.7	1.2	111.6	L439 T440 F441 K446 E447	L439-R443 VanDerWaalsContact CD2-CZ 3.43Å; L439-R443 WeakPolarHBondContact O-CB 3.39Å; L439-R443 WeakPolarHBondContact O-CG 3.4Å; L439-R443 PolarHBondContact O-N 3.37Å; L439-R443 VanDerWaalsContact O-N 3.11Å; T440-R443 WeakPolarHBondContact O-CB 3.35Å; T440-R443 PolarHBondContact O-N 2.93Å; F441-R443 VanDerWaalsContact C-N 3.35Å; R443-K446 PolarHBondContact O-N 2.91Å; R443-E447 WeakPolarHBondContact O-CB 3.39Å; R443-E447 PolarHBondContact O-N 3.19Å
444	E	92.7	Very high	92.1	Very high	119 Å²	119	99.3 Å²	99.3	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-65.1	-45.6	177	-174	177.9	-176	0	0	111.4	T440 F441 K446 E447 N448	T440-E444 WeakPolarHBondContact O-CB 3.33Å; T440-E444 PolarHBondContact O-N 3.21Å; F441-E444 PolarHBondContact O-N 3.04Å; E444-K446 VanDerWaalsContact C-N 3.31Å; E444-K446 PolarHBondContact O-N 2.83Å; E444-E447 PolarHBondContact O-N 3.34Å; E444-N448 WeakPolarHBondContact O-CB 3.36Å; E444-N448 VanDerWaalsContact O-CG 3.29Å; E444-N448 PolarHBondContact O-N 2.92Å
445	Q	92.4	Very high	92	Very high	103 Å²	103	99.2 Å²	99.2	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-41.3	172.7	-82.9	-154.5	63.6	0	0	112.3	F441 N448 A449	F441-Q445 HydrophobicContact CE1-CG 4.41Å; F441-Q445 HydrophobicContact CE2-CG 4.38Å; F441-Q445 HydrophobicContact CZ-CG 4.19Å; F441-Q445 PolarHBondContact O-N 3.35Å; Q445-N448 PolarHBondContact O-N 3.27Å; Q445-A449 WeakPolarHBondContact O-CB 3.32Å; Q445-A449 PolarHBondContact O-N 3.47Å
446	K	92.8	Very high	91.8	Very high	140 Å²	140	97.1 Å²	97.1	61%	0.609	49%	0.492	S	S	*	.	H	α-helix	trans	-62.9	-44.7	175.5	-167.5	-171.5	109.7	174.8	0	111.4	L442 R443 E444 A449 I450	L442-K446 VanDerWaalsContact O-CB 3.29Å; L442-K446 WeakPolarHBondContact O-CB 3.27Å; L442-K446 PolarHBondContact O-N 3.47Å; R443-K446 PolarHBondContact O-N 2.91Å; E444-K446 VanDerWaalsContact C-N 3.31Å; E444-K446 PolarHBondContact O-N 2.83Å; K446-A449 PolarHBondContact O-N 2.79Å; K446-I450 HydrophobicContact CG-CD1 4.09Å; K446-I450 VanDerWaalsContact O-CG1 3.22Å; K446-I450 WeakPolarHBondContact O-CG1 3.14Å; K446-I450 PolarHBondContact O-N 2.75Å
447	E	94.4	Very high	91.8	Very high	115 Å²	115	100.1 Å²	100.1	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-65.9	-41.6	178.8	-167.2	61.1	-151.2	0	0	111.4	R443 E444 I450 S451	R443-E447 WeakPolarHBondContact O-CB 3.39Å; R443-E447 PolarHBondContact O-N 3.19Å; E444-E447 PolarHBondContact O-N 3.34Å; E447-I450 CarbonylContact O-C 3.6Å; E447-I450 PolarHBondContact O-N 3.39Å; E447-S451 WeakPolarHBondContact O-CB 3.13Å; E447-S451 PolarHBondContact O-N 2.81Å
448	N	90.8	Very high	91.5	Very high	88 Å²	88	97.8 Å²	97.8	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-60.5	-47.4	173.9	-75.1	-17	0	0	0	111	E444 Q445 I450 S451 E452	E444-N448 WeakPolarHBondContact O-CB 3.36Å; E444-N448 VanDerWaalsContact O-CG 3.29Å; E444-N448 PolarHBondContact O-N 2.92Å; Q445-N448 PolarHBondContact O-N 3.27Å; N448-I450 VanDerWaalsContact C-N 3.3Å; N448-I450 PolarHBondContact O-N 3.14Å; N448-S451 WeakPolarHBondContact CA-OG 3.39Å; N448-S451 PolarHBondContact O-N 2.79Å; N448-S451 VanDerWaalsContact O-N 3.15Å; N448-S451 PolarHBondContact O-OG 2.87Å; N448-E452 WeakPolarHBondContact O-CB 3.36Å; N448-E452 PolarHBondContact O-N 3.37Å
449	A	91.2	Very high	91.3	Very high	48 Å²	48	96.5 Å²	96.5	40%	0.397	49%	0.494	S	S	.	.	H	α-helix	trans	-61.7	-36.4	175.6	0	0	0	0	0	112.5	Q445 K446 C453	Q445-A449 WeakPolarHBondContact O-CB 3.32Å; Q445-A449 PolarHBondContact O-N 3.47Å; K446-A449 PolarHBondContact O-N 2.79Å; A449-C453 VanDerWaalsContact O-CB 3.27Å; A449-C453 WeakPolarHBondContact O-CB 3.26Å; A449-C453 PolarHBondContact O-N 3.04Å; A449-C453 PolarHBondContact O-SG 3.37Å
450	I	93.1	Very high	91.1	Very high	72 Å²	72	98.1 Å²	98.1	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-66.8	-44.1	173.2	-70.7	165	0	0	0	110.7	K446 E447 N448 E452 C453 T454	K446-I450 HydrophobicContact CG-CD1 4.09Å; K446-I450 VanDerWaalsContact O-CG1 3.22Å; K446-I450 WeakPolarHBondContact O-CG1 3.14Å; K446-I450 PolarHBondContact O-N 2.75Å; E447-I450 CarbonylContact O-C 3.6Å; E447-I450 PolarHBondContact O-N 3.39Å; N448-I450 VanDerWaalsContact C-N 3.3Å; N448-I450 PolarHBondContact O-N 3.14Å; I450-E452 VanDerWaalsContact C-N 3.32Å; I450-E452 PolarHBondContact O-N 3.21Å; I450-C453 PolarHBondContact O-N 3.33Å; I450-T454 HydrophobicContact CG2-CG2 4.45Å; I450-T454 WeakPolarHBondContact O-CG2 3.45Å; I450-T454 PolarHBondContact O-N 2.79Å; I450-T454 PolarHBondContact O-OG1 3.32Å; I450-T454 VanDerWaalsContact O-OG1 3.13Å
451	S	90.7	Very high	90.9	Very high	61 Å²	61	100.6 Å²	100.6	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-63.5	-39.2	178.1	77.3	0	0	0	0	111.6	E447 N448 T454 N455	E447-S451 WeakPolarHBondContact O-CB 3.13Å; E447-S451 PolarHBondContact O-N 2.81Å; N448-S451 WeakPolarHBondContact CA-OG 3.39Å; N448-S451 PolarHBondContact O-N 2.79Å; N448-S451 VanDerWaalsContact O-N 3.15Å; N448-S451 PolarHBondContact O-OG 2.87Å; S451-T454 WeakPolarHBondContact CA-OG1 3.21Å; S451-T454 PolarHBondContact O-N 3.42Å; S451-T454 PolarHBondContact O-OG1 3.41Å; S451-N455 WeakPolarHBondContact O-CB 3.46Å; S451-N455 PolarHBondContact O-N 3.43Å
452	E	89.9	Confident	90.7	Very high	122 Å²	122	101.3 Å²	101.3	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-68.6	-43.5	174.8	-170	177.1	-174.7	0	0	110.9	N448 I450 T454 N455 L456	N448-E452 WeakPolarHBondContact O-CB 3.36Å; N448-E452 PolarHBondContact O-N 3.37Å; I450-E452 VanDerWaalsContact C-N 3.32Å; I450-E452 PolarHBondContact O-N 3.21Å; E452-T454 VanDerWaalsContact C-N 3.32Å; E452-T454 PolarHBondContact O-N 3.04Å; E452-N455 PolarHBondContact O-N 3.41Å; E452-L456 HydrophobicContact CG-CD1 4.19Å; E452-L456 HydrophobicContact CG-CG 4.48Å; E452-L456 WeakPolarHBondContact O-CB 3.31Å; E452-L456 WeakPolarHBondContact O-CG 3.4Å; E452-L456 PolarHBondContact O-N 2.87Å
453	C	86.5	Confident	90.2	Very high	85 Å²	85	100.5 Å²	100.5	57%	0.574	51%	0.511	S	S	*	.	H	α-helix	trans	-59.5	-40	173	-79.3	0	0	0	0	112.5	A449 I450 K457	A449-C453 VanDerWaalsContact O-CB 3.27Å; A449-C453 WeakPolarHBondContact O-CB 3.26Å; A449-C453 PolarHBondContact O-N 3.04Å; A449-C453 PolarHBondContact O-SG 3.37Å; I450-C453 PolarHBondContact O-N 3.33Å; C453-K457 WeakPolarHBondContact O-CB 3.46Å; C453-K457 PolarHBondContact O-N 2.89Å
454	T	89.5	Confident	90.1	Very high	77 Å²	77	97.1 Å²	97.1	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-71.6	-37.7	177.7	53.4	0	0	0	0	111.8	I450 S451 E452 K457 S458	I450-T454 HydrophobicContact CG2-CG2 4.45Å; I450-T454 WeakPolarHBondContact O-CG2 3.45Å; I450-T454 PolarHBondContact O-N 2.79Å; I450-T454 PolarHBondContact O-OG1 3.32Å; I450-T454 VanDerWaalsContact O-OG1 3.13Å; S451-T454 WeakPolarHBondContact CA-OG1 3.21Å; S451-T454 PolarHBondContact O-N 3.42Å; S451-T454 PolarHBondContact O-OG1 3.41Å; E452-T454 VanDerWaalsContact C-N 3.32Å; E452-T454 PolarHBondContact O-N 3.04Å; T454-K457 PolarHBondContact O-N 3.43Å; T454-S458 WeakPolarHBondContact O-CB 3.43Å; T454-S458 PolarHBondContact O-N 2.86Å; T454-S458 PolarHBondContact O-OG 2.96Å
455	N	90.9	Very high	89.7	Confident	89 Å²	89	94.8 Å²	94.8	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-51.4	172.7	-171.8	8.7	0	0	0	111.1	S451 E452 K457 S458 Q459	S451-N455 WeakPolarHBondContact O-CB 3.46Å; S451-N455 PolarHBondContact O-N 3.43Å; E452-N455 PolarHBondContact O-N 3.41Å; N455-K457 VanDerWaalsContact C-N 3.27Å; N455-K457 PolarHBondContact O-N 3.5Å; N455-S458 WeakPolarHBondContact O-CA 3.35Å; N455-S458 WeakPolarHBondContact O-CB 3.34Å; N455-S458 PolarHBondContact O-N 3.19Å; N455-Q459 WeakPolarHBondContact O-CG 3.4Å; N455-Q459 PolarHBondContact O-N 3.43Å; N455-Q459 PolarHBondContact OD1-NE2 3.4Å
456	L	89.5	Confident	89.5	Confident	93 Å²	93	93.3 Å²	93.3	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-59.5	-37.8	175.9	-72.7	174.5	0	0	0	111.9	E452 S458 Q459 L460	E452-L456 HydrophobicContact CG-CD1 4.19Å; E452-L456 HydrophobicContact CG-CG 4.48Å; E452-L456 WeakPolarHBondContact O-CB 3.31Å; E452-L456 WeakPolarHBondContact O-CG 3.4Å; E452-L456 PolarHBondContact O-N 2.87Å; L456-S458 VanDerWaalsContact C-N 3.32Å; L456-S458 PolarHBondContact O-N 3.32Å; L456-Q459 PolarHBondContact O-N 3.32Å; L456-L460 WeakPolarHBondContact O-CB 3.31Å; L456-L460 PolarHBondContact O-N 2.95Å
457	K	92.3	Very high	89	Confident	140 Å²	140	90.8 Å²	90.8	61%	0.609	49%	0.486	S	S	*	.	H	α-helix	trans	-68	-32	175	-168	171.6	-172.9	174.3	0	112.7	C453 T454 N455 K461	C453-K457 WeakPolarHBondContact O-CB 3.46Å; C453-K457 PolarHBondContact O-N 2.89Å; T454-K457 PolarHBondContact O-N 3.43Å; N455-K457 VanDerWaalsContact C-N 3.27Å; N455-K457 PolarHBondContact O-N 3.5Å; K457-K461 WeakPolarHBondContact O-CG 3.43Å; K457-K461 PolarHBondContact O-N 2.93Å
458	S	87.5	Confident	88.4	Confident	71 Å²	71	89.8 Å²	89.8	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-46.4	175	-53.2	0	0	0	0	110.8	T454 N455 L456 L460 K461 E462	T454-S458 WeakPolarHBondContact O-CB 3.43Å; T454-S458 PolarHBondContact O-N 2.86Å; T454-S458 PolarHBondContact O-OG 2.96Å; N455-S458 WeakPolarHBondContact O-CA 3.35Å; N455-S458 WeakPolarHBondContact O-CB 3.34Å; N455-S458 PolarHBondContact O-N 3.19Å; L456-S458 VanDerWaalsContact C-N 3.32Å; L456-S458 PolarHBondContact O-N 3.32Å; S458-L460 VanDerWaalsContact C-N 3.31Å; S458-L460 PolarHBondContact O-N 2.84Å; S458-K461 WeakPolarHBondContact O-CB 3.43Å; S458-K461 PolarHBondContact O-N 3.24Å; S458-E462 PolarHBondContact O-N 2.95Å
459	Q	89.5	Confident	88.1	Confident	86 Å²	86	91 Å²	91	40%	0.402	49%	0.487	S	S	.	.	H	α-helix	trans	-61	-40.6	172.8	-68.6	176.9	17	0	0	111.4	N455 L456 K461 E462 T463	N455-Q459 WeakPolarHBondContact O-CG 3.4Å; N455-Q459 PolarHBondContact O-N 3.43Å; N455-Q459 PolarHBondContact OD1-NE2 3.4Å; L456-Q459 PolarHBondContact O-N 3.32Å; Q459-K461 PolarHBondContact O-N 3.5Å; Q459-E462 PolarHBondContact O-N 3.42Å; Q459-T463 VanDerWaalsContact O-CG2 3.31Å; Q459-T463 WeakPolarHBondContact O-CG2 3.5Å; Q459-T463 PolarHBondContact O-N 2.96Å; Q459-T463 PolarHBondContact O-OG1 3.36Å
460	L	87.6	Confident	87.5	Confident	90 Å²	90	95 Å²	95	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-46.5	175.7	-173.3	141	0	0	0	110.6	L456 S458 E462 T463 E464	L456-L460 WeakPolarHBondContact O-CB 3.31Å; L456-L460 PolarHBondContact O-N 2.95Å; S458-L460 VanDerWaalsContact C-N 3.31Å; S458-L460 PolarHBondContact O-N 2.84Å; L460-E462 VanDerWaalsContact C-N 3.32Å; L460-E462 PolarHBondContact O-N 3.42Å; L460-T463 WeakPolarHBondContact CA-OG1 3.23Å; L460-T463 PolarHBondContact O-N 3.2Å; L460-T463 PolarHBondContact O-OG1 2.86Å; L460-E464 VanDerWaalsContact CD2-CD 3.48Å; L460-E464 HydrophobicContact CD2-CG 4.16Å; L460-E464 WeakPolarHBondContact CD2-OE1 3.47Å; L460-E464 WeakPolarHBondContact O-CB 3.43Å; L460-E464 WeakPolarHBondContact O-CG 3.43Å; L460-E464 PolarHBondContact O-N 3.47Å
461	K	89.4	Confident	86.9	Confident	133 Å²	133	96.5 Å²	96.5	58%	0.578	50%	0.496	S	S	*	.	H	α-helix	trans	-60.3	-39	173.2	-80	-177.2	175.3	-174.1	0	113.3	K457 S458 Q459 E464 C465	K457-K461 WeakPolarHBondContact O-CG 3.43Å; K457-K461 PolarHBondContact O-N 2.93Å; S458-K461 WeakPolarHBondContact O-CB 3.43Å; S458-K461 PolarHBondContact O-N 3.24Å; Q459-K461 PolarHBondContact O-N 3.5Å; K461-E464 PolarHBondContact O-N 2.98Å; K461-C465 WeakPolarHBondContact O-CB 3.4Å; K461-C465 PolarHBondContact O-N 3.06Å
462	E	88.9	Confident	86.2	Confident	128 Å²	128	100.3 Å²	100.3	60%	0.598	51%	0.508	S	S	*	.	H	α-helix	trans	-66.7	-44.2	177	-171.5	175.7	-170.7	0	0	111.2	S458 Q459 L460 E464 C465 L466	S458-E462 PolarHBondContact O-N 2.95Å; Q459-E462 PolarHBondContact O-N 3.42Å; L460-E462 VanDerWaalsContact C-N 3.32Å; L460-E462 PolarHBondContact O-N 3.42Å; E462-E464 VanDerWaalsContact C-N 3.34Å; E462-E464 PolarHBondContact O-N 2.96Å; E462-C465 WeakPolarHBondContact O-CB 3.41Å; E462-C465 PolarHBondContact O-N 3.36Å; E462-L466 PolarHBondContact O-N 2.97Å
463	T	82.4	Confident	85.5	Confident	83 Å²	83	100.1 Å²	100.1	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-66.6	-34.1	174.3	61.3	0	0	0	0	112.3	Q459 L460 L466 L467	Q459-T463 VanDerWaalsContact O-CG2 3.31Å; Q459-T463 WeakPolarHBondContact O-CG2 3.5Å; Q459-T463 PolarHBondContact O-N 2.96Å; Q459-T463 PolarHBondContact O-OG1 3.36Å; L460-T463 WeakPolarHBondContact CA-OG1 3.23Å; L460-T463 PolarHBondContact O-N 3.2Å; L460-T463 PolarHBondContact O-OG1 2.86Å; T463-L466 PolarHBondContact O-N 3.12Å; T463-L467 WeakPolarHBondContact O-CB 3.25Å; T463-L467 PolarHBondContact O-N 3.24Å
464	E	89.6	Confident	84.3	Confident	97 Å²	97	99.3 Å²	99.3	45%	0.453	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-38.2	171.5	-77.5	178.1	159.2	0	0	111.5	L460 K461 E462 L467 N468	L460-E464 VanDerWaalsContact CD2-CD 3.48Å; L460-E464 HydrophobicContact CD2-CG 4.16Å; L460-E464 WeakPolarHBondContact CD2-OE1 3.47Å; L460-E464 WeakPolarHBondContact O-CB 3.43Å; L460-E464 WeakPolarHBondContact O-CG 3.43Å; L460-E464 PolarHBondContact O-N 3.47Å; K461-E464 PolarHBondContact O-N 2.98Å; E462-E464 VanDerWaalsContact C-N 3.34Å; E462-E464 PolarHBondContact O-N 2.96Å; E464-L467 PolarHBondContact O-N 3.27Å; E464-N468 WeakPolarHBondContact O-CB 3.34Å; E464-N468 VanDerWaalsContact O-CG 3.3Å; E464-N468 PolarHBondContact O-N 2.88Å; E464-N468 PolarHBondContact O-ND2 3.29Å
465	C	85.1	Confident	83.1	Confident	69 Å²	69	100.5 Å²	100.5	47%	0.466	50%	0.498	S	S	.	.	H	α-helix	trans	-64.6	-47.2	173.9	-171.5	0	0	0	0	111.3	K461 E462 L467 N468 Q469	K461-C465 WeakPolarHBondContact O-CB 3.4Å; K461-C465 PolarHBondContact O-N 3.06Å; E462-C465 WeakPolarHBondContact O-CB 3.41Å; E462-C465 PolarHBondContact O-N 3.36Å; C465-L467 VanDerWaalsContact C-N 3.34Å; C465-L467 PolarHBondContact O-N 3.42Å; C465-N468 PolarHBondContact O-N 2.89Å; C465-Q469 PolarHBondContact O-N 3.48Å
466	L	88	Confident	81.6	Confident	72 Å²	72	103.2 Å²	103.2	38%	0.377	51%	0.507	S	S	.	.	H	α-helix	trans	-60.4	-42.6	172.7	-85.7	162.5	0	0	0	111.6	E462 T463 N468 Q469 Y470	E462-L466 PolarHBondContact O-N 2.97Å; T463-L466 PolarHBondContact O-N 3.12Å; L466-N468 VanDerWaalsContact C-N 3.31Å; L466-N468 PolarHBondContact O-N 2.79Å; L466-Q469 PolarHBondContact O-N 2.73Å; L466-Y470 HydrophobicContact CB-CD2 4.4Å; L466-Y470 HydrophobicContact CB-CE2 4.34Å; L466-Y470 HydrophobicContact CD2-CE2 4.17Å; L466-Y470 WeakPolarHBondContact O-CB 3.43Å; L466-Y470 WeakPolarHBondContact O-CD2 3.5Å; L466-Y470 PolarHBondContact O-N 3.48Å
467	L	81.8	Confident	79.6	Confident	88 Å²	88	103.8 Å²	103.8	46%	0.461	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-39	176.5	-170.9	99.9	0	0	0	110.8	T463 E464 C465 Y470 K471	T463-L467 WeakPolarHBondContact O-CB 3.25Å; T463-L467 PolarHBondContact O-N 3.24Å; E464-L467 PolarHBondContact O-N 3.27Å; C465-L467 VanDerWaalsContact C-N 3.34Å; C465-L467 PolarHBondContact O-N 3.42Å; L467-Y470 CarbonylContact O-C 3.46Å; L467-Y470 PolarHBondContact O-N 3.43Å; L467-K471 HydrophobicContact CD2-CD 4.27Å; L467-K471 WeakPolarHBondContact O-CB 3.45Å; L467-K471 VanDerWaalsContact O-CG 3.28Å; L467-K471 WeakPolarHBondContact O-CG 3.46Å; L467-K471 PolarHBondContact O-N 3.26Å
468	N	82.6	Confident	77.7	Confident	94 Å²	94	103.8 Å²	103.8	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-67.7	-41.6	175.2	-75.5	-21.1	0	0	0	111.5	E464 C465 L466 Y470 K471 E472	E464-N468 WeakPolarHBondContact O-CB 3.34Å; E464-N468 VanDerWaalsContact O-CG 3.3Å; E464-N468 PolarHBondContact O-N 2.88Å; E464-N468 PolarHBondContact O-ND2 3.29Å; C465-N468 PolarHBondContact O-N 2.89Å; L466-N468 VanDerWaalsContact C-N 3.31Å; L466-N468 PolarHBondContact O-N 2.79Å; N468-Y470 VanDerWaalsContact C-N 3.33Å; N468-Y470 PolarHBondContact O-N 3.4Å; N468-K471 PolarHBondContact O-N 3.08Å; N468-E472 WeakPolarHBondContact O-CB 3.37Å; N468-E472 PolarHBondContact O-N 3.43Å
469	Q	84.5	Confident	75.8	Confident	112 Å²	112	105.1 Å²	105.1	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-60.9	-42.1	170.6	-73.8	-178.6	24.6	0	0	111.9	C465 L466 E472 K473	C465-Q469 PolarHBondContact O-N 3.48Å; L466-Q469 PolarHBondContact O-N 2.73Å; Q469-E472 PolarHBondContact O-N 3.28Å; Q469-K473 WeakPolarHBondContact O-CB 3.29Å; Q469-K473 PolarHBondContact O-N 2.99Å
470	Y	78.9	Confident	73.6	Confident	132 Å²	132	105.8 Å²	105.8	52%	0.518	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-35.7	176	-77.4	-55.5	0	0	0	111.8	L466 L467 N468 E472 K473 I474	L466-Y470 HydrophobicContact CB-CD2 4.4Å; L466-Y470 HydrophobicContact CB-CE2 4.34Å; L466-Y470 HydrophobicContact CD2-CE2 4.17Å; L466-Y470 WeakPolarHBondContact O-CB 3.43Å; L466-Y470 WeakPolarHBondContact O-CD2 3.5Å; L466-Y470 PolarHBondContact O-N 3.48Å; L467-Y470 CarbonylContact O-C 3.46Å; L467-Y470 PolarHBondContact O-N 3.43Å; N468-Y470 VanDerWaalsContact C-N 3.33Å; N468-Y470 PolarHBondContact O-N 3.4Å; Y470-E472 VanDerWaalsContact C-N 3.35Å; Y470-K473 CarbonylContact O-C 3.56Å; Y470-K473 PolarHBondContact O-N 3.04Å; Y470-I474 WeakPolarHBondContact O-CA 3.28Å; Y470-I474 WeakPolarHBondContact O-CB 3.44Å; Y470-I474 WeakPolarHBondContact O-CD1 3.36Å; Y470-I474 WeakPolarHBondContact O-CG1 3.47Å; Y470-I474 PolarHBondContact O-N 3.28Å
471	K	80.2	Confident	71.2	Confident	104 Å²	104	107.7 Å²	107.7	45%	0.452	54%	0.543	S	S	.	.	H	α-helix	trans	-63.6	-43.2	173.2	-82.4	175.1	178.9	173.6	0	110.5	L467 N468 I474 D475	L467-K471 HydrophobicContact CD2-CD 4.27Å; L467-K471 WeakPolarHBondContact O-CB 3.45Å; L467-K471 VanDerWaalsContact O-CG 3.28Å; L467-K471 WeakPolarHBondContact O-CG 3.46Å; L467-K471 PolarHBondContact O-N 3.26Å; N468-K471 PolarHBondContact O-N 3.08Å; K471-I474 CarbonylContact O-C 3.55Å; K471-I474 WeakPolarHBondContact O-CA 3.37Å; K471-I474 PolarHBondContact O-N 3.32Å; K471-I474 VanDerWaalsContact O-N 3.11Å; K471-D475 WeakPolarHBondContact O-CB 3.4Å; K471-D475 VanDerWaalsContact O-CG 3.27Å; K471-D475 PolarHBondContact O-N 2.81Å
472	E	75.9	Confident	68.6	Low	142 Å²	142	110.6 Å²	110.6	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-61.3	-45.6	174.6	-155.6	170.3	-156.8	0	0	110.9	N468 Q469 Y470 I474 D475 E476	N468-E472 WeakPolarHBondContact O-CB 3.37Å; N468-E472 PolarHBondContact O-N 3.43Å; Q469-E472 PolarHBondContact O-N 3.28Å; Y470-E472 VanDerWaalsContact C-N 3.35Å; E472-I474 VanDerWaalsContact C-N 3.32Å; E472-I474 PolarHBondContact O-N 3.46Å; E472-D475 PolarHBondContact O-N 3.13Å; E472-E476 PolarHBondContact O-N 2.86Å
473	K	74.5	Confident	66.2	Low	118 Å²	118	114.5 Å²	114.5	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-62.6	-34.2	170.9	-108.2	-177.9	179.5	174.2	0	113.9	Q469 Y470 M477	Q469-K473 WeakPolarHBondContact O-CB 3.29Å; Q469-K473 PolarHBondContact O-N 2.99Å; Y470-K473 CarbonylContact O-C 3.56Å; Y470-K473 PolarHBondContact O-N 3.04Å; K473-M477 HydrophobicContact CB-CE 4.44Å; K473-M477 VanDerWaalsContact O-CB 3.28Å; K473-M477 WeakPolarHBondContact O-CB 3.49Å; K473-M477 PolarHBondContact O-N 3.45Å
474	I	62.5	Low	64.2	Low	67 Å²	67	119.1 Å²	119.1	34%	0.344	59%	0.587	S	S	.	*	H	α-helix	trans	-76.4	-30	178.4	-78.3	166.2	0	0	0	109.4	Y470 K471 E472 M477 K478	Y470-I474 WeakPolarHBondContact O-CA 3.28Å; Y470-I474 WeakPolarHBondContact O-CB 3.44Å; Y470-I474 WeakPolarHBondContact O-CD1 3.36Å; Y470-I474 WeakPolarHBondContact O-CG1 3.47Å; Y470-I474 PolarHBondContact O-N 3.28Å; K471-I474 CarbonylContact O-C 3.55Å; K471-I474 WeakPolarHBondContact O-CA 3.37Å; K471-I474 PolarHBondContact O-N 3.32Å; K471-I474 VanDerWaalsContact O-N 3.11Å; E472-I474 VanDerWaalsContact C-N 3.32Å; E472-I474 PolarHBondContact O-N 3.46Å; I474-M477 HydrophobicContact CG1-CE 4.45Å; I474-M477 CarbonylContact O-C 3.48Å; I474-M477 PolarHBondContact O-N 2.98Å; I474-K478 HydrophobicContact CG2-CD 3.63Å; I474-K478 HydrophobicContact CG2-CG 3.84Å; I474-K478 WeakPolarHBondContact O-CA 3.1Å; I474-K478 WeakPolarHBondContact O-CB 3.36Å; I474-K478 WeakPolarHBondContact O-CG 3.27Å; I474-K478 PolarHBondContact O-N 2.92Å
475	D	63.2	Low	62.1	Low	103 Å²	103	120.9 Å²	120.9	55%	0.551	60%	0.6	S	S	*	*	H	α-helix	trans	-75.4	-33.3	173.6	-68.5	-23.5	0	0	0	110.2	K471 E472 S479	K471-D475 WeakPolarHBondContact O-CB 3.4Å; K471-D475 VanDerWaalsContact O-CG 3.27Å; K471-D475 PolarHBondContact O-N 2.81Å; E472-D475 PolarHBondContact O-N 3.13Å; D475-S479 PolarHBondContact O-OG 3.35Å; D475-S479 VanDerWaalsContact O-OG 3.07Å
476	E	59	Low	60.7	Low	145 Å²	145	124 Å²	124	68%	0.678	61%	0.611	S	S	*	*	H	α-helix	trans	-64.7	-38.8	163.1	-81.6	-173.6	153.2	0	0	113.1	E472 S479	E472-E476 PolarHBondContact O-N 2.86Å; E476-S479 PolarHBondContact O-OG 3.4Å
477	M	49.4	Very low	59.3	Low	105 Å²	105	128 Å²	128	52%	0.517	63%	0.628	S	S	.	*	H	α-helix	trans	-85.6	-24.7	-179.5	-88.1	-171	-67.2	0	0	114	K473 I474 S479 S480 N481	K473-M477 HydrophobicContact CB-CE 4.44Å; K473-M477 VanDerWaalsContact O-CB 3.28Å; K473-M477 WeakPolarHBondContact O-CB 3.49Å; K473-M477 PolarHBondContact O-N 3.45Å; I474-M477 HydrophobicContact CG1-CE 4.45Å; I474-M477 CarbonylContact O-C 3.48Å; I474-M477 PolarHBondContact O-N 2.98Å; M477-S479 PolarHBondContact O-N 3.32Å; M477-S480 CarbonylContact O-C 3.57Å; M477-S480 VanDerWaalsContact O-C 3.28Å; M477-S480 VanDerWaalsContact O-CA 3.23Å; M477-S480 WeakPolarHBondContact O-CA 3.45Å; M477-S480 PolarHBondContact O-N 3.03Å; M477-N481 PolarHBondContact O-N 2.87Å
478	K	51	Low	58.3	Low	141 Å²	141	132.8 Å²	132.8	61%	0.613	64%	0.64	S	S	*	*	H	α-helix	trans	-72.2	-22.1	175.8	-86.6	173.1	179.8	166.5	0	111.2	I474 S480	I474-K478 HydrophobicContact CG2-CD 3.63Å; I474-K478 HydrophobicContact CG2-CG 3.84Å; I474-K478 WeakPolarHBondContact O-CA 3.1Å; I474-K478 WeakPolarHBondContact O-CB 3.36Å; I474-K478 WeakPolarHBondContact O-CG 3.27Å; I474-K478 PolarHBondContact O-N 2.92Å; K478-S480 PolarHBondContact O-N 3.17Å
479	S	48.8	Very low	57.5	Low	99 Å²	99	132.4 Å²	132.4	69%	0.692	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-6.4	161.5	31.5	0	0	0	0	112.8	D475 E476 M477	D475-S479 PolarHBondContact O-OG 3.35Å; D475-S479 VanDerWaalsContact O-OG 3.07Å; E476-S479 PolarHBondContact O-OG 3.4Å; M477-S479 PolarHBondContact O-N 3.32Å
480	S	42.6	Very low	56.6	Low	100 Å²	100	131.9 Å²	131.9	70%	0.699	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	-15.4	178	-100.4	0	0	0	0	117.7	M477 K478	M477-S480 CarbonylContact O-C 3.57Å; M477-S480 VanDerWaalsContact O-C 3.28Å; M477-S480 VanDerWaalsContact O-CA 3.23Å; M477-S480 WeakPolarHBondContact O-CA 3.45Å; M477-S480 PolarHBondContact O-N 3.03Å; K478-S480 PolarHBondContact O-N 3.17Å
481	N	38.2	Very low	56.4	Low	129 Å²	129	131 Å²	131	69%	0.69	64%	0.639	S	S	*	*			trans	-158.3	114.5	-170.5	-126.9	-34.7	0	0	0	115.2	M477	M477-N481 PolarHBondContact O-N 2.87Å
482	K	33.1	Very low	56.1	Low	194 Å²	194	130.1 Å²	130.1	84%	0.843	64%	0.639	S	S	*	*			trans	-119.7	29.2	-167.5	-155	-175.9	178.9	178.7	0	114.9
483	Y	38.7	Very low	55.9	Low	211 Å²	211	130.9 Å²	130.9	83%	0.827	64%	0.636	S	S	*	*			trans	-132.5	17.1	-167.5	-87.7	-75.8	0	0	0	120.4
484	L	39.8	Very low	56	Low	179 Å²	179	129.9 Å²	129.9	94%	0.937	63%	0.633	S	S	*	*			trans	-133.4	54.7	179.4	-70.4	176.4	0	0	0	115.9
485	N	47.2	Very low	56.8	Low	135 Å²	135	132.5 Å²	132.5	72%	0.722	64%	0.644	S	S	*	*			trans	-120	9.1	-176.6	-137.3	26.4	0	0	0	116.8
486	N	54.4	Low	57.6	Low	133 Å²	133	132.3 Å²	132.3	71%	0.711	64%	0.642	S	S	*	*	S	Bend	trans	-99.3	-17.9	-171.9	-72.2	-10.6	0	0	0	115.7	N490	N486-N490 PolarHBondContact O-ND2 3.29Å
487	E	60	Low	58.8	Low	156 Å²	156	130.6 Å²	130.6	73%	0.729	63%	0.632	S	S	*	*	H	α-helix	trans	-84.1	-36.4	-170.2	-165.6	170.9	179.3	0	0	113.3	N490 Q491	E487-N490 PolarHBondContact O-N 2.84Å; E487-Q491 PolarHBondContact O-N 3.4Å
488	R	60	Low	60.4	Low	189 Å²	189	129 Å²	129	71%	0.713	63%	0.628	S	S	*	*	H	α-helix	trans	-70.7	-33.2	-177.3	-164.3	173.6	167.8	85.4	0.6	112.9	N490 Q491 L492	R488-N490 VanDerWaalsContact C-N 3.31Å; R488-N490 PolarHBondContact O-N 3.26Å; R488-Q491 PolarHBondContact O-N 2.95Å; R488-L492 PolarHBondContact O-N 3.33Å
489	D	65.6	Low	62	Low	87 Å²	87	125.1 Å²	125.1	47%	0.465	62%	0.622	S	S	.	*	H	α-helix	trans	-67.5	-33.1	175.3	-78	-6.9	0	0	0	112	R493	D489-R493 VanDerWaalsContact O-CG 3.28Å; D489-R493 WeakPolarHBondContact O-CG 3.28Å; D489-R493 PolarHBondContact O-N 3.11Å
490	N	65.2	Low	63.7	Low	100 Å²	100	124.6 Å²	124.6	54%	0.535	61%	0.611	S	S	.	*	H	α-helix	trans	-68.9	-42.3	176.2	-73.5	-19	0	0	0	111.5	N486 E487 R488 L492 R493 E494	N486-N490 PolarHBondContact O-ND2 3.29Å; E487-N490 PolarHBondContact O-N 2.84Å; R488-N490 VanDerWaalsContact C-N 3.31Å; R488-N490 PolarHBondContact O-N 3.26Å; N490-L492 VanDerWaalsContact C-N 3.34Å; N490-L492 PolarHBondContact O-N 2.97Å; N490-R493 PolarHBondContact O-N 3.4Å; N490-E494 WeakPolarHBondContact O-CG 3.31Å; N490-E494 PolarHBondContact O-N 2.99Å
491	Q	75.5	Confident	65.9	Low	113 Å²	113	123.9 Å²	123.9	53%	0.528	60%	0.599	S	S	.	*	H	α-helix	trans	-61.2	-41.6	176.2	-72.8	-179.2	-8.2	0	0	112.4	E487 R488 E494 Q495	E487-Q491 PolarHBondContact O-N 3.4Å; R488-Q491 PolarHBondContact O-N 2.95Å; Q491-E494 PolarHBondContact O-N 3.48Å; Q491-Q495 WeakPolarHBondContact O-CG 3.15Å; Q491-Q495 PolarHBondContact O-N 3.41Å
492	L	72.9	Confident	68.2	Low	86 Å²	86	122.8 Å²	122.8	45%	0.45	59%	0.593	S	S	.	*	H	α-helix	trans	-65.1	-40.8	175.8	-87.9	166.1	0	0	0	112.4	R488 N490 E494 Q495 I496	R488-L492 PolarHBondContact O-N 3.33Å; N490-L492 VanDerWaalsContact C-N 3.34Å; N490-L492 PolarHBondContact O-N 2.97Å; L492-E494 VanDerWaalsContact C-N 3.32Å; L492-E494 PolarHBondContact O-N 2.96Å; L492-Q495 PolarHBondContact O-N 3.36Å; L492-I496 VanDerWaalsContact O-CG1 3.32Å; L492-I496 WeakPolarHBondContact O-CG1 3.28Å; L492-I496 PolarHBondContact O-N 2.99Å
493	R	73	Confident	70.9	Confident	158 Å²	158	118.5 Å²	118.5	60%	0.596	58%	0.578	S	S	*	*	H	α-helix	trans	-62.3	-40.4	176.1	-74.4	175.1	-170.5	-76.1	-1.7	111.9	D489 N490 I496 K497	D489-R493 VanDerWaalsContact O-CG 3.28Å; D489-R493 WeakPolarHBondContact O-CG 3.28Å; D489-R493 PolarHBondContact O-N 3.11Å; N490-R493 PolarHBondContact O-N 3.4Å; R493-I496 PolarHBondContact O-N 2.85Å; R493-K497 WeakPolarHBondContact O-CG 3.47Å; R493-K497 PolarHBondContact O-N 3.39Å
494	E	76.7	Confident	73.3	Confident	97 Å²	97	114.3 Å²	114.3	45%	0.453	57%	0.566	S	S	.	*	H	α-helix	trans	-69	-40.9	176.6	-68.3	-52.6	128	0	0	112.1	N490 Q491 L492 I496 K497 T498	N490-E494 WeakPolarHBondContact O-CG 3.31Å; N490-E494 PolarHBondContact O-N 2.99Å; Q491-E494 PolarHBondContact O-N 3.48Å; L492-E494 VanDerWaalsContact C-N 3.32Å; L492-E494 PolarHBondContact O-N 2.96Å; E494-I496 VanDerWaalsContact C-N 3.35Å; E494-I496 PolarHBondContact O-N 2.86Å; E494-K497 PolarHBondContact O-N 3.27Å; E494-K497 IonicContact OE1-NZ 2.84Å; E494-K497 PolarHBondContact OE1-NZ 2.93Å; E494-T498 WeakPolarHBondContact O-CG2 3.41Å; E494-T498 PolarHBondContact O-N 3.46Å; E494-T498 PolarHBondContact O-OG1 3.36Å
495	Q	79.1	Confident	75.6	Confident	123 Å²	123	110 Å²	110	58%	0.575	55%	0.547	S	S	*	.	H	α-helix	trans	-60.1	-43.5	173.5	-75	-179.2	0.6	0	0	112.3	Q491 L492 T498 A499	Q491-Q495 WeakPolarHBondContact O-CG 3.15Å; Q491-Q495 PolarHBondContact O-N 3.41Å; L492-Q495 PolarHBondContact O-N 3.36Å; Q495-T498 WeakPolarHBondContact CA-OG1 3.48Å; Q495-T498 PolarHBondContact O-N 2.95Å; Q495-T498 PolarHBondContact O-OG1 3.4Å; Q495-A499 WeakPolarHBondContact O-CB 3.28Å; Q495-A499 PolarHBondContact O-N 3Å
496	I	80.3	Confident	77.5	Confident	99 Å²	99	107.9 Å²	107.9	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-63.2	-43.9	176.6	-69	167.2	0	0	0	110.8	L492 R493 E494 A499 I500	L492-I496 VanDerWaalsContact O-CG1 3.32Å; L492-I496 WeakPolarHBondContact O-CG1 3.28Å; L492-I496 PolarHBondContact O-N 2.99Å; R493-I496 PolarHBondContact O-N 2.85Å; E494-I496 VanDerWaalsContact C-N 3.35Å; E494-I496 PolarHBondContact O-N 2.86Å; I496-A499 PolarHBondContact O-N 3.08Å; I496-I500 HydrophobicContact CG2-CD1 3.83Å; I496-I500 HydrophobicContact CG2-CG1 4.5Å; I496-I500 VanDerWaalsContact O-CG1 3.29Å; I496-I500 WeakPolarHBondContact O-CG1 3.33Å; I496-I500 PolarHBondContact O-N 3.45Å
497	K	82.6	Confident	79.2	Confident	109 Å²	109	106.4 Å²	106.4	47%	0.474	52%	0.522	S	S	.	.	H	α-helix	trans	-60.3	-47.5	175.8	-75.1	175.3	-173.2	171.2	0	111.9	R493 E494 A499 I500 I501	R493-K497 WeakPolarHBondContact O-CG 3.47Å; R493-K497 PolarHBondContact O-N 3.39Å; E494-K497 PolarHBondContact O-N 3.27Å; E494-K497 IonicContact OE1-NZ 2.84Å; E494-K497 PolarHBondContact OE1-NZ 2.93Å; K497-A499 VanDerWaalsContact C-N 3.31Å; K497-A499 PolarHBondContact O-N 2.81Å; K497-I500 PolarHBondContact O-N 3.36Å; K497-I501 WeakPolarHBondContact O-CG1 3.43Å; K497-I501 PolarHBondContact O-N 3.48Å
498	T	84.1	Confident	80.4	Confident	71 Å²	71	101.3 Å²	101.3	44%	0.436	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-38.7	178	55.9	0	0	0	0	112.2	E494 Q495 I501 N502	E494-T498 WeakPolarHBondContact O-CG2 3.41Å; E494-T498 PolarHBondContact O-N 3.46Å; E494-T498 PolarHBondContact O-OG1 3.36Å; Q495-T498 WeakPolarHBondContact CA-OG1 3.48Å; Q495-T498 PolarHBondContact O-N 2.95Å; Q495-T498 PolarHBondContact O-OG1 3.4Å; T498-I501 PolarHBondContact O-N 3.25Å; T498-N502 WeakPolarHBondContact O-CB 3.35Å; T498-N502 PolarHBondContact O-N 2.93Å; T498-N502 PolarHBondContact O-ND2 3.04Å
499	A	84.3	Confident	81.7	Confident	59 Å²	59	94.4 Å²	94.4	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-65.5	-39.3	175.6	0	0	0	0	0	112.7	Q495 I496 K497 N502 L503	Q495-A499 WeakPolarHBondContact O-CB 3.28Å; Q495-A499 PolarHBondContact O-N 3Å; I496-A499 PolarHBondContact O-N 3.08Å; K497-A499 VanDerWaalsContact C-N 3.31Å; K497-A499 PolarHBondContact O-N 2.81Å; A499-N502 PolarHBondContact O-N 2.91Å; A499-L503 WeakPolarHBondContact O-CB 3.42Å; A499-L503 PolarHBondContact O-N 3.4Å
500	I	84.8	Confident	82.6	Confident	88 Å²	88	98.4 Å²	98.4	45%	0.451	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-46.9	175.7	-69.4	166.3	0	0	0	110.6	I496 K497 N502 L503 E504	I496-I500 HydrophobicContact CG2-CD1 3.83Å; I496-I500 HydrophobicContact CG2-CG1 4.5Å; I496-I500 VanDerWaalsContact O-CG1 3.29Å; I496-I500 WeakPolarHBondContact O-CG1 3.33Å; I496-I500 PolarHBondContact O-N 3.45Å; K497-I500 PolarHBondContact O-N 3.36Å; I500-N502 VanDerWaalsContact C-N 3.34Å; I500-N502 PolarHBondContact O-N 3.1Å; I500-L503 WeakPolarHBondContact O-CB 3.29Å; I500-L503 PolarHBondContact O-N 2.78Å; I500-E504 PolarHBondContact O-N 3.31Å
501	I	89	Confident	84	Confident	86 Å²	86	100.4 Å²	100.4	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-59.7	-46	177.6	-66.8	165.2	0	0	0	110.4	K497 T498 L503 E504 V505	K497-I501 WeakPolarHBondContact O-CG1 3.43Å; K497-I501 PolarHBondContact O-N 3.48Å; T498-I501 PolarHBondContact O-N 3.25Å; I501-L503 VanDerWaalsContact C-N 3.31Å; I501-L503 PolarHBondContact O-N 3.41Å; I501-E504 PolarHBondContact O-N 3.45Å; I501-V505 WeakPolarHBondContact O-CG2 3.39Å; I501-V505 PolarHBondContact O-N 2.71Å
502	N	86.8	Confident	84.6	Confident	106 Å²	106	100.1 Å²	100.1	57%	0.567	51%	0.505	S	S	*	.	H	α-helix	trans	-62.3	-38.2	177.7	-71.6	-15.9	0	0	0	112.4	T498 A499 I500 V505 E506	T498-N502 WeakPolarHBondContact O-CB 3.35Å; T498-N502 PolarHBondContact O-N 2.93Å; T498-N502 PolarHBondContact O-ND2 3.04Å; A499-N502 PolarHBondContact O-N 2.91Å; I500-N502 VanDerWaalsContact C-N 3.34Å; I500-N502 PolarHBondContact O-N 3.1Å; N502-V505 PolarHBondContact O-N 2.74Å; N502-E506 WeakPolarHBondContact O-CB 3.36Å; N502-E506 PolarHBondContact O-N 3.33Å
503	L	88.5	Confident	85.3	Confident	103 Å²	103	98.8 Å²	98.8	54%	0.539	51%	0.506	S	S	.	.	H	α-helix	trans	-65.2	-40.4	176.3	-176.3	68.1	0	0	0	111.8	A499 I500 I501 E506 Q507	A499-L503 WeakPolarHBondContact O-CB 3.42Å; A499-L503 PolarHBondContact O-N 3.4Å; I500-L503 WeakPolarHBondContact O-CB 3.29Å; I500-L503 PolarHBondContact O-N 2.78Å; I501-L503 VanDerWaalsContact C-N 3.31Å; I501-L503 PolarHBondContact O-N 3.41Å; L503-E506 PolarHBondContact O-N 3.34Å; L503-Q507 WeakPolarHBondContact O-CB 3.47Å; L503-Q507 VanDerWaalsContact O-CG 3.29Å; L503-Q507 WeakPolarHBondContact O-CG 3.43Å; L503-Q507 PolarHBondContact O-N 2.96Å
504	E	88.8	Confident	86.3	Confident	123 Å²	123	95 Å²	95	58%	0.575	50%	0.504	S	S	*	.	H	α-helix	trans	-65.7	-41.6	175.8	-73.9	179.3	171.3	0	0	111.9	I500 I501 Q507 A508	I500-E504 PolarHBondContact O-N 3.31Å; I501-E504 PolarHBondContact O-N 3.45Å; E504-Q507 PolarHBondContact O-N 3.29Å; E504-A508 PolarHBondContact O-N 3.32Å
505	V	89	Confident	87.1	Confident	89 Å²	89	95.4 Å²	95.4	54%	0.539	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-45.2	174.9	171.8	0	0	0	0	111.2	I501 N502 Q507 A508 A509	I501-V505 WeakPolarHBondContact O-CG2 3.39Å; I501-V505 PolarHBondContact O-N 2.71Å; N502-V505 PolarHBondContact O-N 2.74Å; V505-Q507 VanDerWaalsContact C-N 3.34Å; V505-Q507 PolarHBondContact O-N 3.32Å; V505-A508 PolarHBondContact O-N 2.99Å; V505-A509 PolarHBondContact O-N 3.46Å
506	E	87.3	Confident	87.7	Confident	91 Å²	91	93.6 Å²	93.6	43%	0.425	50%	0.5	S	S	.	.	H	α-helix	trans	-63.4	-39.3	177.1	179.1	60.9	-156.3	0	0	111.7	N502 L503 A509 R510	N502-E506 WeakPolarHBondContact O-CB 3.36Å; N502-E506 PolarHBondContact O-N 3.33Å; L503-E506 PolarHBondContact O-N 3.34Å; E506-A509 PolarHBondContact O-N 3.27Å; E506-R510 WeakPolarHBondContact O-CG 3.18Å; E506-R510 PolarHBondContact O-N 2.93Å; E506-R510 IonicContact OE1-CZ 3.5Å; E506-R510 IonicContact OE1-NE 2.71Å; E506-R510 PolarHBondContact OE1-NE 3.4Å; E506-R510 IonicContact OE1-NH2 3.5Å
507	Q	88.8	Confident	88.2	Confident	101 Å²	101	92.9 Å²	92.9	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-37.8	174.4	-76	178.2	10	0	0	112.6	L503 E504 V505 K511	L503-Q507 WeakPolarHBondContact O-CB 3.47Å; L503-Q507 VanDerWaalsContact O-CG 3.29Å; L503-Q507 WeakPolarHBondContact O-CG 3.43Å; L503-Q507 PolarHBondContact O-N 2.96Å; E504-Q507 PolarHBondContact O-N 3.29Å; V505-Q507 VanDerWaalsContact C-N 3.34Å; V505-Q507 PolarHBondContact O-N 3.32Å; Q507-K511 WeakPolarHBondContact O-CG 3.48Å; Q507-K511 PolarHBondContact O-N 3.49Å
508	A	86.2	Confident	88.8	Confident	49 Å²	49	93.8 Å²	93.8	41%	0.405	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-47.9	174.3	0	0	0	0	0	111.2	E504 V505 R510 K511 D512	E504-A508 PolarHBondContact O-N 3.32Å; V505-A508 PolarHBondContact O-N 2.99Å; A508-R510 VanDerWaalsContact C-N 3.29Å; A508-R510 PolarHBondContact O-N 3.47Å; A508-K511 WeakPolarHBondContact O-CB 3.44Å; A508-K511 PolarHBondContact O-N 3.46Å; A508-D512 PolarHBondContact O-N 2.78Å
509	A	87.6	Confident	89.2	Confident	45 Å²	45	95.2 Å²	95.2	37%	0.372	51%	0.506	S	S	.	.	H	α-helix	trans	-59.2	-38.2	177.4	0	0	0	0	0	112.7	V505 E506 D512 A513	V505-A509 PolarHBondContact O-N 3.46Å; E506-A509 PolarHBondContact O-N 3.27Å; A509-D512 PolarHBondContact O-N 3.19Å; A509-A513 WeakPolarHBondContact O-CB 3.44Å; A509-A513 PolarHBondContact O-N 2.98Å
510	R	84.8	Confident	89.7	Confident	170 Å²	170	96.8 Å²	96.8	64%	0.642	51%	0.506	S	S	*	.	H	α-helix	trans	-65.3	-36.7	174.2	-75.7	179.1	-173.1	-155.3	1.5	113.2	E506 A508 S514	E506-R510 WeakPolarHBondContact O-CG 3.18Å; E506-R510 PolarHBondContact O-N 2.93Å; E506-R510 IonicContact OE1-CZ 3.5Å; E506-R510 IonicContact OE1-NE 2.71Å; E506-R510 PolarHBondContact OE1-NE 3.4Å; E506-R510 IonicContact OE1-NH2 3.5Å; A508-R510 VanDerWaalsContact C-N 3.29Å; A508-R510 PolarHBondContact O-N 3.47Å; R510-S514 WeakPolarHBondContact O-CB 3.44Å; R510-S514 PolarHBondContact O-N 3.22Å
511	K	92.9	Very high	90.2	Very high	142 Å²	142	97 Å²	97	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-65.8	-44	175.3	-73.6	174.6	-178.4	175.5	0	111	Q507 A508 S514 L515	Q507-K511 WeakPolarHBondContact O-CG 3.48Å; Q507-K511 PolarHBondContact O-N 3.49Å; A508-K511 WeakPolarHBondContact O-CB 3.44Å; A508-K511 PolarHBondContact O-N 3.46Å; K511-S514 WeakPolarHBondContact O-CB 3.44Å; K511-S514 PolarHBondContact O-N 3.36Å; K511-L515 WeakPolarHBondContact O-CG 3.4Å; K511-L515 PolarHBondContact O-N 2.97Å
512	D	88.9	Confident	90.4	Very high	108 Å²	108	95.6 Å²	95.6	58%	0.578	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-43.9	177.9	-65.2	-20.4	0	0	0	111.8	A508 A509 S514 L515 E516	A508-D512 PolarHBondContact O-N 2.78Å; A509-D512 PolarHBondContact O-N 3.19Å; D512-S514 VanDerWaalsContact C-N 3.3Å; D512-S514 PolarHBondContact O-N 3.02Å; D512-L515 PolarHBondContact O-N 3.13Å; D512-E516 PolarHBondContact O-N 2.97Å
513	A	88.5	Confident	90.8	Very high	58 Å²	58	95.5 Å²	95.5	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-39	174.5	0	0	0	0	0	112.1	A509 E516 V517	A509-A513 WeakPolarHBondContact O-CB 3.44Å; A509-A513 PolarHBondContact O-N 2.98Å; A513-E516 PolarHBondContact O-N 3.24Å; A513-V517 WeakPolarHBondContact O-CG2 3.46Å; A513-V517 PolarHBondContact O-N 3.43Å
514	S	93	Very high	91.1	Very high	78 Å²	78	94.6 Å²	94.6	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-63.4	-41.1	175.6	-171	0	0	0	0	112.3	R510 K511 D512 V517 E518	R510-S514 WeakPolarHBondContact O-CB 3.44Å; R510-S514 PolarHBondContact O-N 3.22Å; K511-S514 WeakPolarHBondContact O-CB 3.44Å; K511-S514 PolarHBondContact O-N 3.36Å; D512-S514 VanDerWaalsContact C-N 3.3Å; D512-S514 PolarHBondContact O-N 3.02Å; S514-V517 PolarHBondContact O-N 3.44Å; S514-E518 PolarHBondContact O-N 2.88Å
515	L	92.7	Very high	91.3	Very high	106 Å²	106	92.3 Å²	92.3	56%	0.555	49%	0.493	S	S	*	.	H	α-helix	trans	-68	-37.9	177.4	-70.9	172.9	0	0	0	112.1	K511 D512 E518 K519	K511-L515 WeakPolarHBondContact O-CG 3.4Å; K511-L515 PolarHBondContact O-N 2.97Å; D512-L515 PolarHBondContact O-N 3.13Å; L515-E518 PolarHBondContact O-N 2.88Å; L515-K519 WeakPolarHBondContact O-CB 3.43Å; L515-K519 PolarHBondContact O-N 3.37Å
516	E	93.4	Very high	91.6	Very high	85 Å²	85	91.9 Å²	91.9	40%	0.397	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-37.9	175.7	-170.3	61.2	-156.2	0	0	111.6	D512 A513 E518 K519 L520	D512-E516 PolarHBondContact O-N 2.97Å; A513-E516 PolarHBondContact O-N 3.24Å; E516-E518 VanDerWaalsContact C-N 3.33Å; E516-E518 PolarHBondContact O-N 2.98Å; E516-K519 VanDerWaalsContact CD-NZ 3.31Å; E516-K519 PolarHBondContact O-N 3.14Å; E516-K519 IonicContact OE1-NZ 2.75Å; E516-K519 PolarHBondContact OE1-NZ 2.86Å; E516-K519 IonicContact OE2-NZ 3.82Å; E516-K519 PolarHBondContact OE2-NZ 3.42Å; E516-L520 HydrophobicContact CG-CD1 4.5Å; E516-L520 WeakPolarHBondContact O-CG 3.48Å; E516-L520 PolarHBondContact O-N 3.14Å
517	V	90.9	Very high	91.7	Very high	83 Å²	83	91 Å²	91	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-41.6	172.4	169.1	0	0	0	0	111.1	A513 S514 L520 N521	A513-V517 WeakPolarHBondContact O-CG2 3.46Å; A513-V517 PolarHBondContact O-N 3.43Å; S514-V517 PolarHBondContact O-N 3.44Å; V517-L520 PolarHBondContact O-N 3.15Å; V517-N521 WeakPolarHBondContact O-CB 3.43Å; V517-N521 VanDerWaalsContact O-CG 3.3Å; V517-N521 PolarHBondContact O-N 3.5Å; V517-N521 PolarHBondContact O-ND2 3.3Å; V517-N521 VanDerWaalsContact O-ND2 3.08Å
518	E	94.3	Very high	92.1	Very high	128 Å²	128	91.1 Å²	91.1	60%	0.598	49%	0.493	S	S	*	.	H	α-helix	trans	-63.3	-43.1	176	-169.4	176.3	-180	0	0	112	S514 L515 E516 N521 A522	S514-E518 PolarHBondContact O-N 2.88Å; L515-E518 PolarHBondContact O-N 2.88Å; E516-E518 VanDerWaalsContact C-N 3.33Å; E516-E518 PolarHBondContact O-N 2.98Å; E518-N521 PolarHBondContact O-N 3.07Å; E518-A522 PolarHBondContact O-N 3.36Å
519	K	93.5	Very high	92.6	Very high	102 Å²	102	95 Å²	95	44%	0.443	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-45.1	175.3	176.3	175.2	152.1	-127.1	0	112.5	L515 E516 N521 A522 Q523	L515-K519 WeakPolarHBondContact O-CB 3.43Å; L515-K519 PolarHBondContact O-N 3.37Å; E516-K519 VanDerWaalsContact CD-NZ 3.31Å; E516-K519 PolarHBondContact O-N 3.14Å; E516-K519 IonicContact OE1-NZ 2.75Å; E516-K519 PolarHBondContact OE1-NZ 2.86Å; E516-K519 IonicContact OE2-NZ 3.82Å; E516-K519 PolarHBondContact OE2-NZ 3.42Å; K519-N521 VanDerWaalsContact C-N 3.34Å; K519-A522 PolarHBondContact O-N 3.03Å; K519-Q523 WeakPolarHBondContact O-CG 3.29Å; K519-Q523 PolarHBondContact O-N 3.35Å
520	L	94.3	Very high	92.9	Very high	91 Å²	91	97.9 Å²	97.9	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-38.4	175.6	-71.9	175.1	0	0	0	111.8	E516 V517 Q523 L524	E516-L520 HydrophobicContact CG-CD1 4.5Å; E516-L520 WeakPolarHBondContact O-CG 3.48Å; E516-L520 PolarHBondContact O-N 3.14Å; V517-L520 PolarHBondContact O-N 3.15Å; L520-Q523 PolarHBondContact O-N 3.43Å; L520-L524 WeakPolarHBondContact O-CB 3.38Å; L520-L524 PolarHBondContact O-N 3.09Å
521	N	94.1	Very high	93.5	Very high	93 Å²	93	96.3 Å²	96.3	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-39.6	174.5	-78.7	-38.1	0	0	0	112.3	V517 E518 K519 L524 D525	V517-N521 WeakPolarHBondContact O-CB 3.43Å; V517-N521 VanDerWaalsContact O-CG 3.3Å; V517-N521 PolarHBondContact O-N 3.5Å; V517-N521 PolarHBondContact O-ND2 3.3Å; V517-N521 VanDerWaalsContact O-ND2 3.08Å; E518-N521 PolarHBondContact O-N 3.07Å; K519-N521 VanDerWaalsContact C-N 3.34Å; N521-L524 PolarHBondContact O-N 2.61Å; N521-D525 PolarHBondContact O-N 2.7Å
522	A	94.7	Very high	93.6	Very high	57 Å²	57	96.6 Å²	96.6	47%	0.471	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-42.3	174.1	0	0	0	0	0	111.9	E518 K519 L524 D525 V526	E518-A522 PolarHBondContact O-N 3.36Å; K519-A522 PolarHBondContact O-N 3.03Å; A522-L524 VanDerWaalsContact C-N 3.33Å; A522-L524 PolarHBondContact O-N 2.81Å; A522-D525 PolarHBondContact O-N 2.65Å; A522-V526 WeakPolarHBondContact O-CG2 3.35Å; A522-V526 PolarHBondContact O-N 2.92Å
523	Q	94.8	Very high	93.9	Very high	104 Å²	104	96 Å²	96	49%	0.486	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-38.4	174.1	-72.6	-179	-2.4	0	0	112.5	K519 L520 V526 S527	K519-Q523 WeakPolarHBondContact O-CG 3.29Å; K519-Q523 PolarHBondContact O-N 3.35Å; L520-Q523 PolarHBondContact O-N 3.43Å; Q523-V526 PolarHBondContact O-N 3.45Å; Q523-S527 WeakPolarHBondContact O-CB 3.48Å; Q523-S527 PolarHBondContact O-N 3.47Å; Q523-S527 PolarHBondContact O-OG 3.45Å
524	L	93.2	Very high	94.2	Very high	84 Å²	84	99 Å²	99	44%	0.44	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-41.3	174.7	-179.6	62.8	0	0	0	111.6	L520 N521 A522 S527 K528	L520-L524 WeakPolarHBondContact O-CB 3.38Å; L520-L524 PolarHBondContact O-N 3.09Å; N521-L524 PolarHBondContact O-N 2.61Å; A522-L524 VanDerWaalsContact C-N 3.33Å; A522-L524 PolarHBondContact O-N 2.81Å; L524-S527 PolarHBondContact O-N 2.98Å; L524-K528 HydrophobicContact CG-CD 4.37Å; L524-K528 WeakPolarHBondContact O-CB 3.27Å; L524-K528 VanDerWaalsContact O-CG 3.3Å; L524-K528 WeakPolarHBondContact O-CG 3.29Å; L524-K528 PolarHBondContact O-N 3.27Å
525	D	95	Very high	94.4	Very high	75 Å²	75	99 Å²	99	40%	0.401	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-42.6	176.8	-170.9	59.1	0	0	0	112.3	N521 A522 K528 K529	N521-D525 PolarHBondContact O-N 2.7Å; A522-D525 PolarHBondContact O-N 2.65Å; D525-K528 PolarHBondContact O-N 2.92Å; D525-K529 WeakPolarHBondContact O-CG 3.2Å; D525-K529 PolarHBondContact O-N 3.3Å; D525-K529 WeakPolarHBondContact OD2-CE 3.31Å; D525-K529 IonicContact OD2-NZ 3.71Å; D525-K529 PolarHBondContact OD2-NZ 2.78Å
526	V	94.1	Very high	94.5	Very high	80 Å²	80	96.8 Å²	96.8	49%	0.485	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-45.4	173.5	172.6	0	0	0	0	110.9	A522 Q523 K528 K529 L530	A522-V526 WeakPolarHBondContact O-CG2 3.35Å; A522-V526 PolarHBondContact O-N 2.92Å; Q523-V526 PolarHBondContact O-N 3.45Å; V526-K528 VanDerWaalsContact C-N 3.34Å; V526-K528 PolarHBondContact O-N 3.36Å; V526-K529 PolarHBondContact O-N 3.45Å; V526-L530 HydrophobicContact CG1-CD1 4.22Å; V526-L530 WeakPolarHBondContact O-CG 3.21Å; V526-L530 PolarHBondContact O-N 2.84Å
527	S	90.4	Very high	94.6	Very high	71 Å²	71	100 Å²	100	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-39.1	179.2	-58.9	0	0	0	0	112	Q523 L524 L530 Y531	Q523-S527 WeakPolarHBondContact O-CB 3.48Å; Q523-S527 PolarHBondContact O-N 3.47Å; Q523-S527 PolarHBondContact O-OG 3.45Å; L524-S527 PolarHBondContact O-N 2.98Å; S527-L530 PolarHBondContact O-N 3.27Å; S527-Y531 WeakPolarHBondContact O-CB 3.49Å; S527-Y531 PolarHBondContact O-N 2.96Å
528	K	96.1	Very high	94.8	Very high	105 Å²	105	102.4 Å²	102.4	46%	0.457	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-43.7	173.4	-76.8	173.6	178.4	177.7	0	112.1	L524 D525 V526 Y531 Y532	L524-K528 HydrophobicContact CG-CD 4.37Å; L524-K528 WeakPolarHBondContact O-CB 3.27Å; L524-K528 VanDerWaalsContact O-CG 3.3Å; L524-K528 WeakPolarHBondContact O-CG 3.29Å; L524-K528 PolarHBondContact O-N 3.27Å; D525-K528 PolarHBondContact O-N 2.92Å; V526-K528 VanDerWaalsContact C-N 3.34Å; V526-K528 PolarHBondContact O-N 3.36Å; K528-Y531 WeakPolarHBondContact O-CB 3.48Å; K528-Y531 PolarHBondContact O-N 3.35Å; K528-Y532 HydrophobicContact CB-CE2 4.39Å; K528-Y532 WeakPolarHBondContact O-CD2 3.42Å; K528-Y532 PolarHBondContact O-N 2.92Å
529	K	96.7	Very high	94.9	Very high	130 Å²	130	100 Å²	100	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-60.2	-45.4	175.8	-77	168.8	175	155.5	0	111.9	D525 V526 Y532 E533	D525-K529 WeakPolarHBondContact O-CG 3.2Å; D525-K529 PolarHBondContact O-N 3.3Å; D525-K529 WeakPolarHBondContact OD2-CE 3.31Å; D525-K529 IonicContact OD2-NZ 3.71Å; D525-K529 PolarHBondContact OD2-NZ 2.78Å; V526-K529 PolarHBondContact O-N 3.45Å; K529-Y532 PolarHBondContact O-N 2.89Å; K529-E533 PolarHBondContact O-N 3.48Å
530	L	94.9	Very high	95	Very high	106 Å²	106	100.6 Å²	100.6	56%	0.555	50%	0.496	S	S	*	.	H	α-helix	trans	-63.8	-39.6	176.4	-68.9	175.2	0	0	0	112.2	V526 S527 E533 L534	V526-L530 HydrophobicContact CG1-CD1 4.22Å; V526-L530 WeakPolarHBondContact O-CG 3.21Å; V526-L530 PolarHBondContact O-N 2.84Å; S527-L530 PolarHBondContact O-N 3.27Å; L530-E533 PolarHBondContact O-N 2.92Å; L530-L534 WeakPolarHBondContact O-CB 3.5Å; L530-L534 PolarHBondContact O-N 3.38Å
531	Y	96.4	Very high	95.1	Very high	137 Å²	137	101.4 Å²	101.4	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-48.8	174.6	173.5	-91.1	0	0	0	111.6	S527 K528 E533 L534 E535	S527-Y531 WeakPolarHBondContact O-CB 3.49Å; S527-Y531 PolarHBondContact O-N 2.96Å; K528-Y531 WeakPolarHBondContact O-CB 3.48Å; K528-Y531 PolarHBondContact O-N 3.35Å; Y531-E533 PolarHBondContact O-N 2.87Å; Y531-L534 PolarHBondContact O-N 3.4Å; Y531-E535 VanDerWaalsContact CE1-OE2 3.27Å; Y531-E535 WeakPolarHBondContact CE1-OE2 3.46Å; Y531-E535 WeakPolarHBondContact O-CB 3.36Å; Y531-E535 PolarHBondContact O-N 3.39Å
532	Y	96.1	Very high	95.1	Very high	148 Å²	148	103.3 Å²	103.3	58%	0.58	50%	0.501	S	S	*	.	H	α-helix	trans	-67.6	-34	179.2	-68.6	-51.3	0	0	0	113.1	K528 K529 S536	K528-Y532 HydrophobicContact CB-CE2 4.39Å; K528-Y532 WeakPolarHBondContact O-CD2 3.42Å; K528-Y532 PolarHBondContact O-N 2.92Å; K529-Y532 PolarHBondContact O-N 2.89Å; Y532-S536 WeakPolarHBondContact O-CB 3.38Å; Y532-S536 PolarHBondContact O-N 3.23Å
533	E	95	Very high	95.1	Very high	95 Å²	95	104.4 Å²	104.4	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-44.8	172.4	-170	-176.4	163.1	0	0	111.1	K529 L530 Y531 S536 R537	K529-E533 PolarHBondContact O-N 3.48Å; L530-E533 PolarHBondContact O-N 2.92Å; Y531-E533 PolarHBondContact O-N 2.87Å; E533-S536 WeakPolarHBondContact O-CB 3.49Å; E533-S536 PolarHBondContact O-N 3.22Å; E533-R537 WeakPolarHBondContact O-CG 3.36Å; E533-R537 PolarHBondContact O-N 3.11Å; E533-R537 IonicContact OE1-CZ 3.75Å; E533-R537 IonicContact OE1-NE 3.6Å; E533-R537 IonicContact OE1-NH2 2.68Å; E533-R537 PolarHBondContact OE1-NH2 3.04Å
534	L	94.7	Very high	95.1	Very high	120 Å²	120	103.6 Å²	103.6	63%	0.628	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-43.5	177.3	-175.5	64	0	0	0	111.7	L530 Y531 S536 R537 F538	L530-L534 WeakPolarHBondContact O-CB 3.5Å; L530-L534 PolarHBondContact O-N 3.38Å; Y531-L534 PolarHBondContact O-N 3.4Å; L534-S536 VanDerWaalsContact C-N 3.32Å; L534-S536 PolarHBondContact O-N 3.36Å; L534-R537 PolarHBondContact O-N 3.07Å; L534-F538 WeakPolarHBondContact O-CB 3.47Å; L534-F538 PolarHBondContact O-N 3.44Å
535	E	96.8	Very high	95.1	Very high	78 Å²	78	106.1 Å²	106.1	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-39.7	175.4	-176.6	170.8	-155.6	0	0	111.6	Y531 F538 N539	Y531-E535 VanDerWaalsContact CE1-OE2 3.27Å; Y531-E535 WeakPolarHBondContact CE1-OE2 3.46Å; Y531-E535 WeakPolarHBondContact O-CB 3.36Å; Y531-E535 PolarHBondContact O-N 3.39Å; E535-F538 PolarHBondContact O-N 2.84Å; E535-N539 WeakPolarHBondContact O-CB 3.49Å; E535-N539 PolarHBondContact O-N 3.01Å; E535-N539 PolarHBondContact O-ND2 3.5Å
536	S	94.7	Very high	95.2	Very high	60 Å²	60	109.7 Å²	109.7	42%	0.42	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-47.2	173.9	-170.1	0	0	0	0	111.8	Y532 E533 L534 N539 Q540	Y532-S536 WeakPolarHBondContact O-CB 3.38Å; Y532-S536 PolarHBondContact O-N 3.23Å; E533-S536 WeakPolarHBondContact O-CB 3.49Å; E533-S536 PolarHBondContact O-N 3.22Å; L534-S536 VanDerWaalsContact C-N 3.32Å; L534-S536 PolarHBondContact O-N 3.36Å; S536-N539 PolarHBondContact O-N 3.11Å; S536-Q540 WeakPolarHBondContact O-CG 3.3Å; S536-Q540 PolarHBondContact O-N 3.32Å
537	R	94.9	Very high	95.2	Very high	153 Å²	153	111.2 Å²	111.2	58%	0.577	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-43.3	177	-71.6	-168.7	-171.8	-165.3	6.7	112.2	E533 L534 N539 Q540 E541	E533-R537 WeakPolarHBondContact O-CG 3.36Å; E533-R537 PolarHBondContact O-N 3.11Å; E533-R537 IonicContact OE1-CZ 3.75Å; E533-R537 IonicContact OE1-NE 3.6Å; E533-R537 IonicContact OE1-NH2 2.68Å; E533-R537 PolarHBondContact OE1-NH2 3.04Å; L534-R537 PolarHBondContact O-N 3.07Å; R537-N539 VanDerWaalsContact C-N 3.32Å; R537-N539 PolarHBondContact O-N 3.41Å; R537-Q540 PolarHBondContact O-N 2.88Å; R537-E541 WeakPolarHBondContact O-CB 3.26Å; R537-E541 PolarHBondContact O-N 3.46Å
538	F	96.1	Very high	95.5	Very high	134 Å²	134	112 Å²	112	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-60.5	-42.6	176.8	-178.9	-99.9	0	0	0	111.7	L534 E535 E541 K542	L534-F538 WeakPolarHBondContact O-CB 3.47Å; L534-F538 PolarHBondContact O-N 3.44Å; E535-F538 PolarHBondContact O-N 2.84Å; F538-E541 PolarHBondContact O-N 3.4Å; F538-K542 VanDerWaalsContact O-CB 3.3Å; F538-K542 WeakPolarHBondContact O-CB 3.48Å; F538-K542 PolarHBondContact O-N 3.25Å
539	N	96.3	Very high	95.4	Very high	76 Å²	76	113.2 Å²	113.2	41%	0.406	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-38.3	176.4	-75.6	-44.1	0	0	0	112.6	E535 S536 R537 K542 T543	E535-N539 WeakPolarHBondContact O-CB 3.49Å; E535-N539 PolarHBondContact O-N 3.01Å; E535-N539 PolarHBondContact O-ND2 3.5Å; S536-N539 PolarHBondContact O-N 3.11Å; R537-N539 VanDerWaalsContact C-N 3.32Å; R537-N539 PolarHBondContact O-N 3.41Å; N539-K542 PolarHBondContact O-N 2.97Å; N539-T543 WeakPolarHBondContact O-CG2 3.44Å; N539-T543 PolarHBondContact O-N 2.93Å; N539-T543 VanDerWaalsContact O-N 3.07Å
540	Q	95.9	Very high	95.3	Very high	115 Å²	115	111.4 Å²	111.4	54%	0.537	52%	0.516	S	S	.	.	H	α-helix	trans	-64.4	-42.4	173.2	-70.8	173	9.9	0	0	112	S536 R537 K542 T543 I544	S536-Q540 WeakPolarHBondContact O-CG 3.3Å; S536-Q540 PolarHBondContact O-N 3.32Å; R537-Q540 PolarHBondContact O-N 2.88Å; Q540-K542 VanDerWaalsContact C-N 3.35Å; Q540-T543 PolarHBondContact O-N 2.98Å; Q540-T543 PolarHBondContact O-OG1 3.5Å; Q540-I544 WeakPolarHBondContact O-CG1 3.45Å; Q540-I544 PolarHBondContact O-N 3.3Å; Q540-I544 VanDerWaalsContact O-N 3.11Å
541	E	95.4	Very high	95.2	Very high	108 Å²	108	109.9 Å²	109.9	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-40.3	176.8	179.5	158.8	-163.7	0	0	111.4	R537 F538 T543 I544 W545	R537-E541 WeakPolarHBondContact O-CB 3.26Å; R537-E541 PolarHBondContact O-N 3.46Å; F538-E541 PolarHBondContact O-N 3.4Å; E541-T543 VanDerWaalsContact C-N 3.34Å; E541-T543 PolarHBondContact O-N 3.05Å; E541-I544 PolarHBondContact O-N 2.99Å; E541-W545 VanDerWaalsContact CG-CD1 3.49Å; E541-W545 PolarHBondContact O-N 2.85Å; E541-W545 PolarHBondContact OE1-NE1 3.13Å
542	K	95.1	Very high	95.1	Very high	133 Å²	133	110 Å²	110	58%	0.578	51%	0.508	S	S	*	.	H	α-helix	trans	-59.6	-40	174.5	-174.4	177.2	-179.5	178.6	0	112.6	F538 N539 Q540 K546	F538-K542 VanDerWaalsContact O-CB 3.3Å; F538-K542 WeakPolarHBondContact O-CB 3.48Å; F538-K542 PolarHBondContact O-N 3.25Å; N539-K542 PolarHBondContact O-N 2.97Å; Q540-K542 VanDerWaalsContact C-N 3.35Å; K542-K546 WeakPolarHBondContact O-CB 3.23Å; K542-K546 PolarHBondContact O-N 3.21Å
543	T	93.9	Very high	95	Very high	81 Å²	81	109.2 Å²	109.2	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-70	-37.7	176.3	57.3	0	0	0	0	112	N539 Q540 E541 K546 I547	N539-T543 WeakPolarHBondContact O-CG2 3.44Å; N539-T543 PolarHBondContact O-N 2.93Å; N539-T543 VanDerWaalsContact O-N 3.07Å; Q540-T543 PolarHBondContact O-N 2.98Å; Q540-T543 PolarHBondContact O-OG1 3.5Å; E541-T543 VanDerWaalsContact C-N 3.34Å; E541-T543 PolarHBondContact O-N 3.05Å; T543-K546 PolarHBondContact O-N 3.24Å; T543-I547 WeakPolarHBondContact O-CG1 3.47Å; T543-I547 PolarHBondContact O-N 3.25Å
544	I	94.1	Very high	94.9	Very high	87 Å²	87	110.6 Å²	110.6	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-60.6	-45.7	173.4	-67.8	165.6	0	0	0	110.8	Q540 E541 K546 I547 K548	Q540-I544 WeakPolarHBondContact O-CG1 3.45Å; Q540-I544 PolarHBondContact O-N 3.3Å; Q540-I544 VanDerWaalsContact O-N 3.11Å; E541-I544 PolarHBondContact O-N 2.99Å; I544-K546 VanDerWaalsContact C-N 3.34Å; I544-K546 PolarHBondContact O-N 3.4Å; I544-I547 PolarHBondContact O-N 3.28Å; I544-K548 HydrophobicContact CG2-CD 4.36Å; I544-K548 WeakPolarHBondContact O-CG 3.2Å; I544-K548 PolarHBondContact O-N 2.9Å
545	W	94.1	Very high	94.7	Very high	136 Å²	136	110.1 Å²	110.1	52%	0.515	51%	0.505	S	S	.	.	H	α-helix	trans	-64	-39.1	177.8	-77.7	115.7	0	0	0	112.5	E541 I547 K548 E549	E541-W545 VanDerWaalsContact CG-CD1 3.49Å; E541-W545 PolarHBondContact O-N 2.85Å; E541-W545 PolarHBondContact OE1-NE1 3.13Å; W545-I547 VanDerWaalsContact C-N 3.34Å; W545-I547 PolarHBondContact O-N 2.74Å; W545-K548 HydrophobicContact CE3-CB 4.45Å; W545-K548 HydrophobicContact CE3-CD 3.91Å; W545-K548 HydrophobicContact CZ3-CD 3.95Å; W545-K548 PolarHBondContact O-N 2.84Å; W545-E549 WeakPolarHBondContact O-CB 3.16Å; W545-E549 PolarHBondContact O-N 3.02Å
546	K	96.5	Very high	94.2	Very high	150 Å²	150	111.2 Å²	111.2	65%	0.652	51%	0.512	S	S	*	.	H	α-helix	trans	-61.8	-40.1	174.9	-167.1	177.1	-177.6	-177.8	0	112.6	K542 T543 I544 E549 E550	K542-K546 WeakPolarHBondContact O-CB 3.23Å; K542-K546 PolarHBondContact O-N 3.21Å; T543-K546 PolarHBondContact O-N 3.24Å; I544-K546 VanDerWaalsContact C-N 3.34Å; I544-K546 PolarHBondContact O-N 3.4Å; K546-E549 PolarHBondContact O-N 2.81Å; K546-E550 PolarHBondContact O-N 3.41Å; K546-E550 VanDerWaalsContact O-N 3.07Å
547	I	94.5	Very high	94	Very high	112 Å²	112	113.5 Å²	113.5	57%	0.574	52%	0.516	S	S	*	.	H	α-helix	trans	-66	-40.6	175.2	-66.7	164.8	0	0	0	110.8	T543 I544 W545 E550 D551	T543-I547 WeakPolarHBondContact O-CG1 3.47Å; T543-I547 PolarHBondContact O-N 3.25Å; I544-I547 PolarHBondContact O-N 3.28Å; W545-I547 VanDerWaalsContact C-N 3.34Å; W545-I547 PolarHBondContact O-N 2.74Å; I547-E550 PolarHBondContact O-N 3.46Å; I547-D551 PolarHBondContact O-N 3.34Å
548	K	96.3	Very high	93.6	Very high	88 Å²	88	110.4 Å²	110.4	38%	0.383	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-41.2	177	-73.5	178.4	179.2	176.4	0	112.3	I544 W545 E550 D551 Y552	I544-K548 HydrophobicContact CG2-CD 4.36Å; I544-K548 WeakPolarHBondContact O-CG 3.2Å; I544-K548 PolarHBondContact O-N 2.9Å; W545-K548 HydrophobicContact CE3-CB 4.45Å; W545-K548 HydrophobicContact CE3-CD 3.91Å; W545-K548 HydrophobicContact CZ3-CD 3.95Å; W545-K548 PolarHBondContact O-N 2.84Å; K548-E550 VanDerWaalsContact C-N 3.34Å; K548-D551 PolarHBondContact O-N 2.84Å; K548-Y552 HydrophobicContact CB-CE2 4.26Å; K548-Y552 WeakPolarHBondContact O-CD2 3.49Å; K548-Y552 PolarHBondContact O-N 3.29Å
549	E	93.9	Very high	92.9	Very high	131 Å²	131	109.9 Å²	109.9	61%	0.612	51%	0.508	S	S	*	.	H	α-helix	trans	-58.6	-46.9	174.5	-175.6	177.4	-163.4	0	0	110.7	W545 K546 D551 Y552 E553	W545-E549 WeakPolarHBondContact O-CB 3.16Å; W545-E549 PolarHBondContact O-N 3.02Å; K546-E549 PolarHBondContact O-N 2.81Å; E549-D551 PolarHBondContact O-N 3.5Å; E549-Y552 PolarHBondContact O-N 2.7Å; E549-E553 WeakPolarHBondContact O-CB 3.43Å; E549-E553 PolarHBondContact O-N 3.2Å
550	E	95.4	Very high	92.4	Very high	92 Å²	92	110.2 Å²	110.2	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-38.9	175.4	-171.1	-175.6	165.2	0	0	112.6	K546 I547 K548 E553 K554	K546-E550 PolarHBondContact O-N 3.41Å; K546-E550 VanDerWaalsContact O-N 3.07Å; I547-E550 PolarHBondContact O-N 3.46Å; K548-E550 VanDerWaalsContact C-N 3.34Å; E550-E553 PolarHBondContact O-N 3.4Å; E550-K554 HydrophobicContact CG-CD 4.36Å; E550-K554 WeakPolarHBondContact O-CB 3.34Å; E550-K554 VanDerWaalsContact O-CG 3.26Å; E550-K554 WeakPolarHBondContact O-CG 3.49Å; E550-K554 PolarHBondContact O-N 2.93Å; E550-K554 VanDerWaalsContact OE1-CE 3.23Å; E550-K554 WeakPolarHBondContact OE1-CE 3.42Å; E550-K554 IonicContact OE1-NZ 2.84Å; E550-K554 PolarHBondContact OE1-NZ 2.9Å
551	D	93.6	Very high	91.9	Very high	74 Å²	74	107.7 Å²	107.7	40%	0.396	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-41.9	174.5	-175.8	60.3	0	0	0	112	I547 K548 E549 R555	I547-D551 PolarHBondContact O-N 3.34Å; K548-D551 PolarHBondContact O-N 2.84Å; E549-D551 PolarHBondContact O-N 3.5Å; D551-R555 WeakPolarHBondContact O-CB 3.37Å; D551-R555 PolarHBondContact O-N 3Å; D551-R555 IonicContact OD1-NH2 2.69Å; D551-R555 IonicContact OD2-CZ 2.61Å; D551-R555 IonicContact OD2-NH1 2.73Å; D551-R555 IonicContact OD2-NH2 2.65Å; D551-R555 PolarHBondContact OD2-NH2 3.29Å
552	Y	93.4	Very high	91.1	Very high	138 Å²	138	103.9 Å²	103.9	54%	0.541	48%	0.48	S	S	.	.	H	α-helix	trans	-67.2	-39.6	175.9	-69.8	-48.9	0	0	0	112.2	K548 E549 R555 L556	K548-Y552 HydrophobicContact CB-CE2 4.26Å; K548-Y552 WeakPolarHBondContact O-CD2 3.49Å; K548-Y552 PolarHBondContact O-N 3.29Å; E549-Y552 PolarHBondContact O-N 2.7Å; Y552-R555 PolarHBondContact O-N 3Å; Y552-L556 WeakPolarHBondContact O-CB 3.33Å; Y552-L556 PolarHBondContact O-N 3.5Å
553	E	94.2	Very high	90.3	Very high	133 Å²	133	102.9 Å²	102.9	62%	0.621	48%	0.477	S	S	*	.	H	α-helix	trans	-65.3	-44	176.6	-168.7	177.6	-174.3	0	0	111.3	E549 E550 R555 L556 H557	E549-E553 WeakPolarHBondContact O-CB 3.43Å; E549-E553 PolarHBondContact O-N 3.2Å; E550-E553 PolarHBondContact O-N 3.4Å; E553-R555 VanDerWaalsContact C-N 3.33Å; E553-R555 PolarHBondContact O-N 3.32Å; E553-L556 PolarHBondContact O-N 3.2Å; E553-H557 WeakPolarHBondContact O-CB 3.36Å; E553-H557 PolarHBondContact O-N 3.05Å
554	K	93	Very high	89.7	Confident	124 Å²	124	105.7 Å²	105.7	54%	0.539	48%	0.483	S	S	.	.	H	α-helix	trans	-60.1	-42.2	172.8	-75.1	171.2	-175.4	166.8	0	112	E550 L558	E550-K554 HydrophobicContact CG-CD 4.36Å; E550-K554 WeakPolarHBondContact O-CB 3.34Å; E550-K554 VanDerWaalsContact O-CG 3.26Å; E550-K554 WeakPolarHBondContact O-CG 3.49Å; E550-K554 PolarHBondContact O-N 2.93Å; E550-K554 VanDerWaalsContact OE1-CE 3.23Å; E550-K554 WeakPolarHBondContact OE1-CE 3.42Å; E550-K554 IonicContact OE1-NZ 2.84Å; E550-K554 PolarHBondContact OE1-NZ 2.9Å; K554-L558 WeakPolarHBondContact O-CB 3.38Å; K554-L558 PolarHBondContact O-N 3.49Å
555	R	91.2	Very high	88.8	Confident	110 Å²	110	105 Å²	105	42%	0.415	48%	0.478	S	S	.	.	H	α-helix	trans	-67.2	-40	177.7	-171.9	175	-63.3	133.4	15.8	111.7	D551 Y552 E553 L558 F559	D551-R555 WeakPolarHBondContact O-CB 3.37Å; D551-R555 PolarHBondContact O-N 3Å; D551-R555 IonicContact OD1-NH2 2.69Å; D551-R555 IonicContact OD2-CZ 2.61Å; D551-R555 IonicContact OD2-NH1 2.73Å; D551-R555 IonicContact OD2-NH2 2.65Å; D551-R555 PolarHBondContact OD2-NH2 3.29Å; Y552-R555 PolarHBondContact O-N 3Å; E553-R555 VanDerWaalsContact C-N 3.33Å; E553-R555 PolarHBondContact O-N 3.32Å; R555-L558 PolarHBondContact O-N 2.97Å; R555-F559 HydrophobicContact CG-CD2 4.13Å; R555-F559 HydrophobicContact CG-CE2 3.58Å; R555-F559 HydrophobicContact CG-CZ 4.2Å; R555-F559 WeakPolarHBondContact O-CD2 3.5Å; R555-F559 PolarHBondContact O-N 2.85Å
556	L	84.8	Confident	87.6	Confident	100 Å²	100	102.7 Å²	102.7	52%	0.524	47%	0.474	S	S	.	.	H	α-helix	trans	-64.2	-47.9	175.8	-174.7	65.7	0	0	0	110.9	Y552 E553 L558 F559 E560	Y552-L556 WeakPolarHBondContact O-CB 3.33Å; Y552-L556 PolarHBondContact O-N 3.5Å; E553-L556 PolarHBondContact O-N 3.2Å; L556-L558 VanDerWaalsContact C-N 3.28Å; L556-L558 PolarHBondContact O-N 3.45Å; L556-F559 CarbonylContact O-C 3.58Å; L556-F559 WeakPolarHBondContact O-CA 3.45Å; L556-F559 WeakPolarHBondContact O-CB 3.47Å; L556-F559 PolarHBondContact O-N 3.01Å; L556-E560 WeakPolarHBondContact O-CG 3.49Å; L556-E560 PolarHBondContact O-N 3.3Å
557	H	91.3	Very high	86.4	Confident	108 Å²	108	99.5 Å²	99.5	50%	0.5	46%	0.464	S	S	.	.	H	α-helix	trans	-59.6	-37.8	176.4	-176.4	-95.1	0	0	0	112.3	E553 E560 I561	E553-H557 WeakPolarHBondContact O-CB 3.36Å; E553-H557 PolarHBondContact O-N 3.05Å; H557-E560 PolarHBondContact O-N 3.18Å; H557-I561 WeakPolarHBondContact CE1-CD1 3.15Å; H557-I561 WeakPolarHBondContact ND1-CD1 3.4Å; H557-I561 WeakPolarHBondContact O-CG1 3.45Å; H557-I561 PolarHBondContact O-N 3.18Å
558	L	85.9	Confident	85.5	Confident	89 Å²	89	99.5 Å²	99.5	47%	0.466	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-42	172.5	-177.5	64	0	0	0	111.7	K554 R555 L556 I561 N562	K554-L558 WeakPolarHBondContact O-CB 3.38Å; K554-L558 PolarHBondContact O-N 3.49Å; R555-L558 PolarHBondContact O-N 2.97Å; L556-L558 VanDerWaalsContact C-N 3.28Å; L556-L558 PolarHBondContact O-N 3.45Å; L558-I561 PolarHBondContact O-N 3Å; L558-N562 WeakPolarHBondContact O-CB 3.38Å; L558-N562 PolarHBondContact O-N 3.33Å; L558-N562 PolarHBondContact O-ND2 2.91Å
559	F	82.3	Confident	84.1	Confident	123 Å²	123	96.2 Å²	96.2	54%	0.539	45%	0.448	S	S	.	.	H	α-helix	trans	-64.7	-40.3	174.3	-69.9	-50.7	0	0	0	112.4	R555 L556 N562 E563	R555-F559 HydrophobicContact CG-CD2 4.13Å; R555-F559 HydrophobicContact CG-CE2 3.58Å; R555-F559 HydrophobicContact CG-CZ 4.2Å; R555-F559 WeakPolarHBondContact O-CD2 3.5Å; R555-F559 PolarHBondContact O-N 2.85Å; L556-F559 CarbonylContact O-C 3.58Å; L556-F559 WeakPolarHBondContact O-CA 3.45Å; L556-F559 WeakPolarHBondContact O-CB 3.47Å; L556-F559 PolarHBondContact O-N 3.01Å; F559-N562 PolarHBondContact O-N 3.04Å; F559-E563 WeakPolarHBondContact O-CB 3.45Å; F559-E563 PolarHBondContact O-N 3.07Å
560	E	84.9	Confident	82.7	Confident	83 Å²	83	95.2 Å²	95.2	39%	0.388	45%	0.446	S	S	.	.	H	α-helix	trans	-63.9	-40.4	176	-70.1	179.7	176.3	0	0	112.6	L556 H557 E563 K564	L556-E560 WeakPolarHBondContact O-CG 3.49Å; L556-E560 PolarHBondContact O-N 3.3Å; H557-E560 PolarHBondContact O-N 3.18Å; E560-E563 PolarHBondContact O-N 3.25Å; E560-K564 WeakPolarHBondContact O-CG 3.46Å; E560-K564 PolarHBondContact O-N 3.4Å
561	I	86.2	Confident	81.1	Confident	61 Å²	61	97.6 Å²	97.6	31%	0.313	46%	0.461	S	S	.	.	H	α-helix	trans	-61.7	-48.2	172.9	-70.4	167.2	0	0	0	109.9	H557 L558 E563 K564 E565	H557-I561 WeakPolarHBondContact CE1-CD1 3.15Å; H557-I561 WeakPolarHBondContact ND1-CD1 3.4Å; H557-I561 WeakPolarHBondContact O-CG1 3.45Å; H557-I561 PolarHBondContact O-N 3.18Å; L558-I561 PolarHBondContact O-N 3Å; I561-E563 VanDerWaalsContact C-N 3.28Å; I561-E563 PolarHBondContact O-N 2.91Å; I561-K564 PolarHBondContact O-N 3.27Å; I561-E565 HydrophobicContact CG2-CG 4.35Å; I561-E565 WeakPolarHBondContact O-CG 3.49Å; I561-E565 PolarHBondContact O-N 3.04Å
562	N	79	Confident	79.7	Confident	28 Å²	28	96.1 Å²	96.1	15%	0.15	45%	0.453	C	S	.	.	H	α-helix	trans	-61.3	-37.6	-179.9	-71.2	-35.3	0	0	0	112.1	L558 F559 M566 C591	L558-N562 WeakPolarHBondContact O-CB 3.38Å; L558-N562 PolarHBondContact O-N 3.33Å; L558-N562 PolarHBondContact O-ND2 2.91Å; F559-N562 PolarHBondContact O-N 3.04Å; N562-M566 WeakPolarHBondContact O-CB 3.22Å; N562-M566 PolarHBondContact O-N 3.47Å; N562-C591 VanDerWaalsContact CG-SG 3.55Å; N562-C591 PolarHBondContact ND2-SG 3.11Å
563	E	78.1	Confident	77.9	Confident	112 Å²	112	91.2 Å²	91.2	52%	0.523	44%	0.436	S	S	.	.	H	α-helix	trans	-65.6	-44.6	174.8	-168.9	-173	159.4	0	0	111.5	F559 E560 I561 E565 M566 N567	F559-E563 WeakPolarHBondContact O-CB 3.45Å; F559-E563 PolarHBondContact O-N 3.07Å; E560-E563 PolarHBondContact O-N 3.25Å; I561-E563 VanDerWaalsContact C-N 3.28Å; I561-E563 PolarHBondContact O-N 2.91Å; E563-E565 PolarHBondContact O-N 3.08Å; E563-M566 PolarHBondContact O-N 3.36Å; E563-N567 WeakPolarHBondContact O-CB 3.1Å; E563-N567 PolarHBondContact O-N 3.3Å; E563-N567 PolarHBondContact O-ND2 2.99Å
564	K	80.8	Confident	76	Confident	141 Å²	141	92.7 Å²	92.7	61%	0.613	44%	0.442	S	S	*	.	H	α-helix	trans	-60.4	-45.3	175.7	-74.2	171.2	-176.5	167.3	0	112	E560 I561 N567 E568	E560-K564 WeakPolarHBondContact O-CG 3.46Å; E560-K564 PolarHBondContact O-N 3.4Å; I561-K564 PolarHBondContact O-N 3.27Å; K564-N567 PolarHBondContact O-N 3.48Å; K564-E568 PolarHBondContact O-N 3.04Å
565	E	76.5	Confident	73.7	Confident	72 Å²	72	90.2 Å²	90.2	34%	0.336	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-40.3	176.3	-71.4	-179.7	179.2	0	0	111.9	I561 E563 E568 L569 K595	I561-E565 HydrophobicContact CG2-CG 4.35Å; I561-E565 WeakPolarHBondContact O-CG 3.49Å; I561-E565 PolarHBondContact O-N 3.04Å; E563-E565 PolarHBondContact O-N 3.08Å; E565-E568 PolarHBondContact O-N 2.97Å; E565-L569 WeakPolarHBondContact O-CG 3.39Å; E565-L569 PolarHBondContact O-N 3.24Å; E565-K595 WeakPolarHBondContact OE2-CE 3.41Å; E565-K595 IonicContact OE2-NZ 3.17Å; E565-K595 PolarHBondContact OE2-NZ 3.44Å
566	M	67	Low	71.5	Confident	88 Å²	88	91.7 Å²	91.7	43%	0.433	46%	0.456	S	S	.	.	H	α-helix	trans	-64.6	-41.8	175.8	-176	179.7	63.9	0	0	111.8	N562 E563 E568 L569 L570	N562-M566 WeakPolarHBondContact O-CB 3.22Å; N562-M566 PolarHBondContact O-N 3.47Å; E563-M566 PolarHBondContact O-N 3.36Å; M566-E568 VanDerWaalsContact C-N 3.31Å; M566-E568 PolarHBondContact O-N 3.02Å; M566-L569 PolarHBondContact O-N 3.41Å; M566-L570 PolarHBondContact O-N 3.17Å
567	N	71.8	Confident	69.9	Low	82 Å²	82	90.9 Å²	90.9	44%	0.439	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-36.5	175.2	-70.6	-23.3	0	0	0	111.5	E563 K564 L570 L571	E563-N567 WeakPolarHBondContact O-CB 3.1Å; E563-N567 PolarHBondContact O-N 3.3Å; E563-N567 PolarHBondContact O-ND2 2.99Å; K564-N567 PolarHBondContact O-N 3.48Å; N567-L570 PolarHBondContact O-N 3.43Å; N567-L571 PolarHBondContact O-N 2.94Å; N567-L571 VanDerWaalsContact O-N 3.08Å
568	E	76	Confident	67.9	Low	112 Å²	112	90.9 Å²	90.9	52%	0.523	47%	0.467	S	S	.	.	H	α-helix	trans	-66.8	-42.7	172.8	-160.1	-155.1	153.6	0	0	112	K564 E565 M566 L570 L571 N572	K564-E568 PolarHBondContact O-N 3.04Å; E565-E568 PolarHBondContact O-N 2.97Å; M566-E568 VanDerWaalsContact C-N 3.31Å; M566-E568 PolarHBondContact O-N 3.02Å; E568-L570 VanDerWaalsContact C-N 3.32Å; E568-L570 PolarHBondContact O-N 2.95Å; E568-L571 PolarHBondContact O-N 3.42Å; E568-N572 WeakPolarHBondContact O-CB 3.37Å; E568-N572 PolarHBondContact O-N 3.5Å; E568-N572 PolarHBondContact OE1-ND2 3.41Å
569	L	66.5	Low	66.1	Low	20 Å²	20	93.2 Å²	93.2	11%	0.105	47%	0.473	C	S	.	.	H	α-helix	trans	-61.1	-40.3	174.8	-73.9	174.5	0	0	0	111.8	E565 M566 L571 N572 I573 I583 V599 L602	E565-L569 WeakPolarHBondContact O-CG 3.39Å; E565-L569 PolarHBondContact O-N 3.24Å; M566-L569 PolarHBondContact O-N 3.41Å; L569-L571 VanDerWaalsContact C-N 3.32Å; L569-L571 PolarHBondContact O-N 3.49Å; L569-N572 PolarHBondContact O-N 3.04Å; L569-I573 WeakPolarHBondContact O-CG1 3.46Å; L569-I573 PolarHBondContact O-N 2.89Å; L569-I583 HydrophobicContact CD2-CD1 4.23Å; L569-V599 HydrophobicContact CD1-CG2 4.34Å; L569-L602 HydrophobicContact CB-CD1 4.06Å
570	L	64.7	Low	64.5	Low	110 Å²	110	89.9 Å²	89.9	58%	0.576	46%	0.46	S	S	*	.	H	α-helix	trans	-64	-38.1	176.1	-163.3	82.9	0	0	0	111.6	M566 N567 E568 I573 L602	M566-L570 PolarHBondContact O-N 3.17Å; N567-L570 PolarHBondContact O-N 3.43Å; E568-L570 VanDerWaalsContact C-N 3.32Å; E568-L570 PolarHBondContact O-N 2.95Å; L570-I573 HydrophobicContact CD1-CD1 4.06Å; L570-I573 HydrophobicContact CG-CD1 4.44Å; L570-I573 WeakPolarHBondContact O-CD1 3.48Å; L570-I573 WeakPolarHBondContact O-CG1 3.46Å; L570-L602 HydrophobicContact CD1-CD2 4.1Å
571	L	62.9	Low	62.7	Low	141 Å²	141	90.6 Å²	90.6	74%	0.738	47%	0.471	S	S	*	.	H	α-helix	trans	-71.3	-36	177.3	-164.5	69.1	0	0	0	112.1	N567 E568 L569 I573	N567-L571 PolarHBondContact O-N 2.94Å; N567-L571 VanDerWaalsContact O-N 3.08Å; E568-L571 PolarHBondContact O-N 3.42Å; L569-L571 VanDerWaalsContact C-N 3.32Å; L569-L571 PolarHBondContact O-N 3.49Å; L571-I573 VanDerWaalsContact C-N 3.34Å; L571-I573 PolarHBondContact O-N 3.43Å
572	N	63.7	Low	60.8	Low	44 Å²	44	93.9 Å²	93.9	24%	0.235	49%	0.489	C	S	.	.	H	α-helix	trans	-77.1	-7.4	-178.9	-84.7	-27.8	0	0	0	115	E568 L569 H574 C575	E568-N572 WeakPolarHBondContact O-CB 3.37Å; E568-N572 PolarHBondContact O-N 3.5Å; E568-N572 PolarHBondContact OE1-ND2 3.41Å; L569-N572 PolarHBondContact O-N 3.04Å; N572-H574 PolarHBondContact O-N 3.26Å; N572-C575 PolarHBondContact O-N 3.45Å
573	I	56	Low	59.3	Low	35 Å²	35	96.4 Å²	96.4	18%	0.179	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.4	173.6	-46.5	169.5	0	0	0	111.7	L569 L570 L571 C575 L602	L569-I573 WeakPolarHBondContact O-CG1 3.46Å; L569-I573 PolarHBondContact O-N 2.89Å; L570-I573 HydrophobicContact CD1-CD1 4.06Å; L570-I573 HydrophobicContact CG-CD1 4.44Å; L570-I573 WeakPolarHBondContact O-CD1 3.48Å; L570-I573 WeakPolarHBondContact O-CG1 3.46Å; L571-I573 VanDerWaalsContact C-N 3.34Å; L571-I573 PolarHBondContact O-N 3.43Å; I573-C575 VanDerWaalsContact C-N 3.33Å; I573-L602 HydrophobicContact CD1-CD2 3.17Å; I573-L602 HydrophobicContact CG1-CD2 3.78Å
574	H	53.9	Low	57.9	Low	163 Å²	163	96.3 Å²	96.3	76%	0.755	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-14.9	174.1	-156.9	47.1	0	0	0	114	N572	N572-H574 PolarHBondContact O-N 3.26Å
575	C	44.3	Very low	56.1	Low	73 Å²	73	93.5 Å²	93.5	49%	0.493	52%	0.517	S	S	.	.	S	Bend	trans	-105.6	144.5	-176	-68	0	0	0	0	112.4	N572 I573	N572-C575 PolarHBondContact O-N 3.45Å; I573-C575 VanDerWaalsContact C-N 3.33Å
576	D	44.1	Very low	54.5	Low	140 Å²	140	98.2 Å²	98.2	75%	0.749	54%	0.536	S	S	*	.			trans	-46.5	149.1	-173.3	-67.8	-47.4	0	0	0	116	T578	D576-T578 PolarHBondContact O-N 2.93Å
577	S	51.6	Low	53.1	Low	83 Å²	83	98.4 Å²	98.4	58%	0.58	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-10.3	-171.8	-171.5	0	0	0	0	118
578	T	49.8	Very low	51.5	Low	109 Å²	109	102.9 Å²	102.9	67%	0.669	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-18.9	-170	56.4	0	0	0	0	114.2	D576	D576-T578 PolarHBondContact O-N 2.93Å
579	K	48.9	Very low	50	Low	138 Å²	138	103.1 Å²	103.1	60%	0.6	57%	0.569	S	S	*	*	S	Bend	trans	-85.7	-21.1	178	-72.7	-174.2	179.6	-179.8	0	114.3	T581	K579-T581 PolarHBondContact O-N 2.89Å
580	L	47.3	Very low	49.2	Very low	52 Å²	52	110.5 Å²	110.5	27%	0.272	61%	0.608	S	S	.	*	H	α-helix	trans	-71.1	-31.6	-175.8	-133.3	82.6	0	0	0	112.9
581	T	47.2	Very low	48.4	Very low	99 Å²	99	107 Å²	107	61%	0.607	59%	0.592	S	S	*	*	H	α-helix	trans	-69	-36	-177.3	7.5	0	0	0	0	113.1	K579 I583 S584	K579-T581 PolarHBondContact O-N 2.89Å; T581-I583 VanDerWaalsContact C-N 3.33Å; T581-I583 PolarHBondContact O-N 3.05Å; T581-S584 PolarHBondContact O-OG 3.31Å; T581-S584 VanDerWaalsContact O-OG 3.06Å
582	N	47.1	Very low	47.7	Very low	129 Å²	129	103 Å²	103	69%	0.69	58%	0.576	S	S	*	*	H	α-helix	trans	-76.3	-16.2	-174.2	-79.2	-10.4	0	0	0	114.2
583	I	47.6	Very low	47.2	Very low	82 Å²	82	109.1 Å²	109.1	42%	0.421	60%	0.6	S	S	.	*	H	α-helix	trans	-88.2	-18.1	-176.9	-57.3	175.3	0	0	0	112	L569 T581 A585 F586	L569-I583 HydrophobicContact CD2-CD1 4.23Å; T581-I583 VanDerWaalsContact C-N 3.33Å; T581-I583 PolarHBondContact O-N 3.05Å; I583-A585 PolarHBondContact O-N 3.19Å; I583-F586 PolarHBondContact O-N 2.81Å
584	S	47.6	Very low	47.4	Very low	110 Å²	110	111.7 Å²	111.7	77%	0.769	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-15.4	173.5	71.5	0	0	0	0	113.9	T581	T581-S584 PolarHBondContact O-OG 3.31Å; T581-S584 VanDerWaalsContact O-OG 3.06Å
585	A	44.7	Very low	47.3	Very low	82 Å²	82	106.6 Å²	106.6	68%	0.678	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-9.6	-177.1	0	0	0	0	0	114.6	I583	I583-A585 PolarHBondContact O-N 3.19Å
586	F	41	Very low	48	Very low	170 Å²	170	108.7 Å²	108.7	75%	0.746	60%	0.601	S	S	*	*	S	Bend	trans	-105.7	118.7	-177	-96.2	-88.5	0	0	0	113.5	I583	I583-F586 PolarHBondContact O-N 2.81Å
587	S	39.4	Very low	49.1	Very low	93 Å²	93	107.6 Å²	107.6	65%	0.65	60%	0.595	S	S	*	*			trans	93.3	106.6	145	-43.5	0	0	0	0	117.9
588	H	37.7	Very low	49.8	Very low	176 Å²	176	105 Å²	105	82%	0.815	58%	0.578	S	S	*	*			trans	-65.4	154.8	174.4	-110.4	-102.3	0	0	0	114
589	D	45.1	Very low	50.7	Low	116 Å²	116	102.7 Å²	102.7	62%	0.62	56%	0.563	S	S	*	*	S	Bend	trans	96.2	115.8	157.8	-55.6	-16.2	0	0	0	119.5	C591	D589-C591 PolarHBondContact O-N 3.17Å
590	L	48	Very low	51.7	Low	175 Å²	175	103.4 Å²	103.4	92%	0.916	56%	0.563	S	S	*	*	S	Bend	trans	48.9	-36.9	176.8	-83.5	82.3	0	0	0	119.5	S592	L590-S592 PolarHBondContact O-N 3.44Å
591	C	47.7	Very low	52.9	Low	36 Å²	36	106 Å²	106	24%	0.243	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-12	177.9	-167.4	0	0	0	0	112.9	N562 D589 K593 S594 K595	N562-C591 VanDerWaalsContact CG-SG 3.55Å; N562-C591 PolarHBondContact ND2-SG 3.11Å; D589-C591 PolarHBondContact O-N 3.17Å; C591-K593 VanDerWaalsContact C-N 3.28Å; C591-K593 PolarHBondContact O-N 2.82Å; C591-S594 PolarHBondContact O-N 3.33Å; C591-K595 VanDerWaalsContact O-CB 3.31Å; C591-K595 WeakPolarHBondContact O-CB 3.3Å; C591-K595 PolarHBondContact O-N 3.39Å; C591-K595 VanDerWaalsContact O-N 3.09Å
592	S	49.8	Very low	54.2	Low	58 Å²	58	102.2 Å²	102.2	41%	0.406	55%	0.553	S	S	.	*	H	α-helix	trans	-57.9	-33.5	-174.1	-43.3	0	0	0	0	113.5	L590 M596	L590-S592 PolarHBondContact O-N 3.44Å; S592-M596 WeakPolarHBondContact O-CA 3.47Å; S592-M596 WeakPolarHBondContact O-CB 3.42Å; S592-M596 PolarHBondContact O-N 3.18Å
593	K	52	Low	55.6	Low	172 Å²	172	101.3 Å²	101.3	75%	0.748	54%	0.542	S	S	*	.	H	α-helix	trans	-71.2	-48.8	-178.6	-83.3	-177.1	177.9	177.4	0	113.3	C591 K595 M596 N597	C591-K593 VanDerWaalsContact C-N 3.28Å; C591-K593 PolarHBondContact O-N 2.82Å; K593-K595 VanDerWaalsContact C-N 3.35Å; K593-M596 PolarHBondContact O-N 2.84Å; K593-N597 WeakPolarHBondContact O-CB 3.38Å; K593-N597 VanDerWaalsContact O-CG 3.28Å; K593-N597 PolarHBondContact O-N 2.97Å
594	S	59.8	Low	57	Low	90 Å²	90	99.9 Å²	99.9	63%	0.629	54%	0.537	S	S	*	.	H	α-helix	trans	-65.6	-42	177.9	-168.5	0	0	0	0	110.9	C591 N597 S598	C591-S594 PolarHBondContact O-N 3.33Å; S594-N597 PolarHBondContact O-N 3.29Å; S594-S598 PolarHBondContact O-N 2.99Å; S594-S598 PolarHBondContact O-OG 2.97Å
595	K	53.4	Low	58.4	Low	55 Å²	55	98.3 Å²	98.3	24%	0.239	52%	0.519	C	S	.	.	H	α-helix	trans	-64.6	-39.8	177.1	-152.9	174.5	-170.4	175.6	0	111.9	E565 C591 K593 S598 V599	E565-K595 WeakPolarHBondContact OE2-CE 3.41Å; E565-K595 IonicContact OE2-NZ 3.17Å; E565-K595 PolarHBondContact OE2-NZ 3.44Å; C591-K595 VanDerWaalsContact O-CB 3.31Å; C591-K595 WeakPolarHBondContact O-CB 3.3Å; C591-K595 PolarHBondContact O-N 3.39Å; C591-K595 VanDerWaalsContact O-N 3.09Å; K593-K595 VanDerWaalsContact C-N 3.35Å; K595-S598 PolarHBondContact O-N 3.49Å; K595-S598 PolarHBondContact O-OG 3.26Å; K595-V599 WeakPolarHBondContact O-CB 3.47Å; K595-V599 WeakPolarHBondContact O-CG2 3.38Å; K595-V599 PolarHBondContact O-N 3.26Å
596	M	57.5	Low	60.1	Low	117 Å²	117	96.9 Å²	96.9	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-70.5	-37.7	178	-171.2	148.7	178.1	0	0	112.2	S592 K593 Y600	S592-M596 WeakPolarHBondContact O-CA 3.47Å; S592-M596 WeakPolarHBondContact O-CB 3.42Å; S592-M596 PolarHBondContact O-N 3.18Å; K593-M596 PolarHBondContact O-N 2.84Å; M596-Y600 HydrophobicContact CE-CE2 4.44Å; M596-Y600 HydrophobicContact CG-CD2 4.41Å; M596-Y600 WeakPolarHBondContact O-CB 3.34Å; M596-Y600 PolarHBondContact O-N 3.11Å
597	N	68.4	Low	62	Low	117 Å²	117	93.5 Å²	93.5	63%	0.626	49%	0.486	S	S	*	.	H	α-helix	trans	-65.6	-43.2	173.4	-72.2	-7.2	0	0	0	111.6	K593 S594 Y600 L601	K593-N597 WeakPolarHBondContact O-CB 3.38Å; K593-N597 VanDerWaalsContact O-CG 3.28Å; K593-N597 PolarHBondContact O-N 2.97Å; S594-N597 PolarHBondContact O-N 3.29Å; N597-Y600 PolarHBondContact O-N 3.45Å; N597-L601 PolarHBondContact O-N 3.26Å
598	S	66.7	Low	63.9	Low	30 Å²	30	93.9 Å²	93.9	21%	0.21	48%	0.48	C	S	.	.	H	α-helix	trans	-69.4	-38.9	178.4	64.1	0	0	0	0	112.3	S594 K595 L601 L602	S594-S598 PolarHBondContact O-N 2.99Å; S594-S598 PolarHBondContact O-OG 2.97Å; K595-S598 PolarHBondContact O-N 3.49Å; K595-S598 PolarHBondContact O-OG 3.26Å; S598-L601 PolarHBondContact O-N 2.98Å; S598-L602 WeakPolarHBondContact O-CB 3.43Å; S598-L602 VanDerWaalsContact O-CG 3.26Å; S598-L602 WeakPolarHBondContact O-CG 3.37Å; S598-L602 PolarHBondContact O-N 2.87Å
599	V	67.8	Low	65.9	Low	59 Å²	59	91 Å²	91	36%	0.358	47%	0.465	S	S	.	.	H	α-helix	trans	-63.3	-40	172.5	170.3	0	0	0	0	111.4	L569 K595 L602 K603	L569-V599 HydrophobicContact CD1-CG2 4.34Å; K595-V599 WeakPolarHBondContact O-CB 3.47Å; K595-V599 WeakPolarHBondContact O-CG2 3.38Å; K595-V599 PolarHBondContact O-N 3.26Å; V599-L602 PolarHBondContact O-N 2.71Å; V599-K603 WeakPolarHBondContact O-CB 3.4Å; V599-K603 PolarHBondContact O-N 2.91Å
600	Y	69.7	Low	67.5	Low	154 Å²	154	89 Å²	89	60%	0.604	46%	0.46	S	S	*	.	H	α-helix	trans	-60.2	-46.7	172.5	-112	-84.8	0	0	0	111.4	M596 N597 L602 K603 T604	M596-Y600 HydrophobicContact CE-CE2 4.44Å; M596-Y600 HydrophobicContact CG-CD2 4.41Å; M596-Y600 WeakPolarHBondContact O-CB 3.34Å; M596-Y600 PolarHBondContact O-N 3.11Å; N597-Y600 PolarHBondContact O-N 3.45Å; Y600-L602 PolarHBondContact O-N 3.23Å; Y600-K603 PolarHBondContact O-N 3.27Å; Y600-T604 WeakPolarHBondContact O-CG2 3.35Å; Y600-T604 PolarHBondContact O-N 3.44Å; Y600-T604 PolarHBondContact O-OG1 3.33Å
601	L	73.3	Confident	69.4	Low	106 Å²	106	85.9 Å²	85.9	56%	0.555	44%	0.441	S	S	*	.	H	α-helix	trans	-61.2	-46.2	178.1	-170.2	70.2	0	0	0	111.1	N597 S598 K603 T604 I605	N597-L601 PolarHBondContact O-N 3.26Å; S598-L601 PolarHBondContact O-N 2.98Å; L601-K603 VanDerWaalsContact C-N 3.3Å; L601-K603 PolarHBondContact O-N 3.44Å; L601-T604 WeakPolarHBondContact CA-OG1 3.41Å; L601-T604 PolarHBondContact O-N 2.84Å; L601-T604 PolarHBondContact O-OG1 3.37Å; L601-I605 HydrophobicContact CD2-CD1 4.44Å; L601-I605 HydrophobicContact CG-CD1 3.95Å; L601-I605 WeakPolarHBondContact O-CB 3.31Å; L601-I605 VanDerWaalsContact O-CG1 3.27Å; L601-I605 WeakPolarHBondContact O-CG1 3.49Å; L601-I605 PolarHBondContact O-N 3.49Å
602	L	73.8	Confident	71.1	Confident	20 Å²	20	87.9 Å²	87.9	11%	0.105	45%	0.451	C	S	.	.	H	α-helix	trans	-57.4	-42.7	175.8	-74.1	167.1	0	0	0	112	L569 L570 I573 S598 V599 Y600 I605 Q606	L569-L602 HydrophobicContact CB-CD1 4.06Å; L570-L602 HydrophobicContact CD1-CD2 4.1Å; I573-L602 HydrophobicContact CD1-CD2 3.17Å; I573-L602 HydrophobicContact CG1-CD2 3.78Å; S598-L602 WeakPolarHBondContact O-CB 3.43Å; S598-L602 VanDerWaalsContact O-CG 3.26Å; S598-L602 WeakPolarHBondContact O-CG 3.37Å; S598-L602 PolarHBondContact O-N 2.87Å; V599-L602 PolarHBondContact O-N 2.71Å; Y600-L602 PolarHBondContact O-N 3.23Å; L602-I605 PolarHBondContact O-N 3.48Å; L602-Q606 WeakPolarHBondContact O-CB 3.38Å; L602-Q606 PolarHBondContact O-N 3.14Å
603	K	75.8	Confident	72.5	Confident	110 Å²	110	88.1 Å²	88.1	48%	0.478	45%	0.453	S	S	.	.	H	α-helix	trans	-63.9	-45.7	176.1	-169.3	-179.8	-180	-172.4	0	111.7	V599 Y600 L601 I605 Q606 E607	V599-K603 WeakPolarHBondContact O-CB 3.4Å; V599-K603 PolarHBondContact O-N 2.91Å; Y600-K603 PolarHBondContact O-N 3.27Å; L601-K603 VanDerWaalsContact C-N 3.3Å; L601-K603 PolarHBondContact O-N 3.44Å; K603-I605 VanDerWaalsContact C-N 3.32Å; K603-I605 PolarHBondContact O-N 3.18Å; K603-Q606 WeakPolarHBondContact O-CB 3.45Å; K603-Q606 PolarHBondContact O-N 2.88Å; K603-Q606 VanDerWaalsContact O-N 3.17Å; K603-E607 VanDerWaalsContact CE-OE1 3.25Å; K603-E607 WeakPolarHBondContact CE-OE1 3.15Å; K603-E607 WeakPolarHBondContact O-CG 3.22Å; K603-E607 PolarHBondContact O-N 3.12Å
604	T	78.9	Confident	74.1	Confident	51 Å²	51	83 Å²	83	31%	0.313	44%	0.439	S	S	.	.	H	α-helix	trans	-63.4	-37.8	176.3	58.8	0	0	0	0	112.3	Y600 L601 Q606 E607 L608	Y600-T604 WeakPolarHBondContact O-CG2 3.35Å; Y600-T604 PolarHBondContact O-N 3.44Å; Y600-T604 PolarHBondContact O-OG1 3.33Å; L601-T604 WeakPolarHBondContact CA-OG1 3.41Å; L601-T604 PolarHBondContact O-N 2.84Å; L601-T604 PolarHBondContact O-OG1 3.37Å; T604-Q606 VanDerWaalsContact C-N 3.33Å; T604-E607 PolarHBondContact O-N 2.91Å; T604-L608 WeakPolarHBondContact O-CB 3.37Å; T604-L608 VanDerWaalsContact O-CG 3.27Å; T604-L608 WeakPolarHBondContact O-CG 3.47Å; T604-L608 PolarHBondContact O-N 2.85Å
605	I	76.6	Confident	75.4	Confident	77 Å²	77	83 Å²	83	40%	0.395	43%	0.432	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.7	-70	166.5	0	0	0	110.2	L601 L602 K603 L608 K609	L601-I605 HydrophobicContact CD2-CD1 4.44Å; L601-I605 HydrophobicContact CG-CD1 3.95Å; L601-I605 WeakPolarHBondContact O-CB 3.31Å; L601-I605 VanDerWaalsContact O-CG1 3.27Å; L601-I605 WeakPolarHBondContact O-CG1 3.49Å; L601-I605 PolarHBondContact O-N 3.49Å; L602-I605 PolarHBondContact O-N 3.48Å; K603-I605 VanDerWaalsContact C-N 3.32Å; K603-I605 PolarHBondContact O-N 3.18Å; I605-L608 PolarHBondContact O-N 3.21Å; I605-K609 VanDerWaalsContact O-CB 3.32Å; I605-K609 WeakPolarHBondContact O-CB 3.05Å; I605-K609 PolarHBondContact O-N 3.01Å
606	Q	79.3	Confident	77	Confident	52 Å²	52	86.2 Å²	86.2	24%	0.243	45%	0.447	C	S	.	.	H	α-helix	trans	-66	-43.3	177.1	-174.9	177.1	-5.6	0	0	112.1	L602 K603 T604 K609 S610	L602-Q606 WeakPolarHBondContact O-CB 3.38Å; L602-Q606 PolarHBondContact O-N 3.14Å; K603-Q606 WeakPolarHBondContact O-CB 3.45Å; K603-Q606 PolarHBondContact O-N 2.88Å; K603-Q606 VanDerWaalsContact O-N 3.17Å; T604-Q606 VanDerWaalsContact C-N 3.33Å; Q606-K609 PolarHBondContact O-N 3.35Å; Q606-S610 PolarHBondContact O-N 3.39Å; Q606-S610 PolarHBondContact O-OG 2.89Å
607	E	81.7	Confident	78.2	Confident	100 Å²	100	83.4 Å²	83.4	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-60.9	-45.8	174.8	-73.4	169.2	-178	0	0	111.3	K603 T604 K609 S610 E611	K603-E607 VanDerWaalsContact CE-OE1 3.25Å; K603-E607 WeakPolarHBondContact CE-OE1 3.15Å; K603-E607 WeakPolarHBondContact O-CG 3.22Å; K603-E607 PolarHBondContact O-N 3.12Å; T604-E607 PolarHBondContact O-N 2.91Å; E607-K609 VanDerWaalsContact C-N 3.3Å; E607-K609 PolarHBondContact O-N 3.49Å; E607-S610 PolarHBondContact O-N 3.5Å; E607-S610 PolarHBondContact O-OG 2.97Å; E607-E611 WeakPolarHBondContact O-CB 3Å; E607-E611 PolarHBondContact O-N 3.2Å
608	L	78.9	Confident	79.1	Confident	101 Å²	101	82.9 Å²	82.9	53%	0.529	43%	0.433	S	S	.	.	H	α-helix	trans	-63.3	-36.9	175.1	-73.3	170	0	0	0	111.9	T604 I605 E611 V612	T604-L608 WeakPolarHBondContact O-CB 3.37Å; T604-L608 VanDerWaalsContact O-CG 3.27Å; T604-L608 WeakPolarHBondContact O-CG 3.47Å; T604-L608 PolarHBondContact O-N 2.85Å; I605-L608 PolarHBondContact O-N 3.21Å; L608-E611 PolarHBondContact O-N 3.32Å; L608-V612 WeakPolarHBondContact O-CB 3.48Å; L608-V612 WeakPolarHBondContact O-CG2 3.33Å; L608-V612 PolarHBondContact O-N 3.5Å
609	K	80.2	Confident	80	Confident	114 Å²	114	86.8 Å²	86.8	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-70.2	-38	179.1	-167.2	177.7	-179	-177.8	0	112.2	I605 Q606 E607 S613	I605-K609 VanDerWaalsContact O-CB 3.32Å; I605-K609 WeakPolarHBondContact O-CB 3.05Å; I605-K609 PolarHBondContact O-N 3.01Å; Q606-K609 PolarHBondContact O-N 3.35Å; E607-K609 VanDerWaalsContact C-N 3.3Å; E607-K609 PolarHBondContact O-N 3.49Å; K609-S613 WeakPolarHBondContact O-CB 3.4Å; K609-S613 PolarHBondContact O-N 3.33Å; K609-S613 PolarHBondContact O-OG 2.97Å
610	S	78.2	Confident	80.9	Confident	74 Å²	74	88 Å²	88	52%	0.517	46%	0.458	S	S	.	.	H	α-helix	trans	-69.6	-38.7	174.1	65	0	0	0	0	111.2	Q606 E607 S613 S614	Q606-S610 PolarHBondContact O-N 3.39Å; Q606-S610 PolarHBondContact O-OG 2.89Å; E607-S610 PolarHBondContact O-N 3.5Å; E607-S610 PolarHBondContact O-OG 2.97Å; S610-S613 PolarHBondContact O-N 2.98Å; S610-S614 WeakPolarHBondContact O-CB 3.38Å; S610-S614 PolarHBondContact O-N 3.26Å
611	E	88.4	Confident	81.7	Confident	111 Å²	111	87.2 Å²	87.2	52%	0.519	46%	0.458	S	S	.	.	H	α-helix	trans	-62.6	-44.8	173.6	-170.8	173.5	-168.4	0	0	111.7	E607 L608 S613 S614 L615	E607-E611 WeakPolarHBondContact O-CB 3Å; E607-E611 PolarHBondContact O-N 3.2Å; L608-E611 PolarHBondContact O-N 3.32Å; E611-S613 VanDerWaalsContact C-N 3.32Å; E611-S613 PolarHBondContact O-N 3.41Å; E611-S614 WeakPolarHBondContact O-CB 3.13Å; E611-S614 PolarHBondContact O-N 2.9Å; E611-L615 HydrophobicContact CG-CD1 4.15Å; E611-L615 WeakPolarHBondContact O-CB 3.4Å; E611-L615 WeakPolarHBondContact O-CG 3.39Å; E611-L615 PolarHBondContact O-N 3.4Å
612	V	81.9	Confident	82.2	Confident	77 Å²	77	87.1 Å²	87.1	47%	0.467	45%	0.453	S	S	.	.	H	α-helix	trans	-61.5	-41.2	174.2	167.8	0	0	0	0	111.4	L608 L615 Q616	L608-V612 WeakPolarHBondContact O-CB 3.48Å; L608-V612 WeakPolarHBondContact O-CG2 3.33Å; L608-V612 PolarHBondContact O-N 3.5Å; V612-L615 PolarHBondContact O-N 2.94Å; V612-Q616 WeakPolarHBondContact O-CB 3.3Å; V612-Q616 WeakPolarHBondContact O-CG 3.44Å; V612-Q616 PolarHBondContact O-N 3.29Å
613	S	80	Confident	82.3	Confident	63 Å²	63	89.5 Å²	89.5	44%	0.441	47%	0.47	S	S	.	.	H	α-helix	trans	-66.2	-39.7	177.2	-56.3	0	0	0	0	111.3	K609 S610 E611 S617	K609-S613 WeakPolarHBondContact O-CB 3.4Å; K609-S613 PolarHBondContact O-N 3.33Å; K609-S613 PolarHBondContact O-OG 2.97Å; S610-S613 PolarHBondContact O-N 2.98Å; E611-S613 VanDerWaalsContact C-N 3.32Å; E611-S613 PolarHBondContact O-N 3.41Å; S613-S617 PolarHBondContact O-N 3.19Å
614	S	86.6	Confident	82.5	Confident	64 Å²	64	89.6 Å²	89.6	45%	0.448	47%	0.473	S	S	.	.	H	α-helix	trans	-62.7	-51.4	174.2	-177.6	0	0	0	0	111.1	S610 E611 Q616 S617 E618	S610-S614 WeakPolarHBondContact O-CB 3.38Å; S610-S614 PolarHBondContact O-N 3.26Å; E611-S614 WeakPolarHBondContact O-CB 3.13Å; E611-S614 PolarHBondContact O-N 2.9Å; S614-Q616 VanDerWaalsContact C-N 3.32Å; S614-Q616 PolarHBondContact O-N 2.85Å; S614-S617 WeakPolarHBondContact O-CB 3.34Å; S614-S617 PolarHBondContact O-N 3.05Å; S614-S617 VanDerWaalsContact O-N 3.07Å; S614-S617 PolarHBondContact O-OG 2.99Å; S614-E618 WeakPolarHBondContact O-CB 3.4Å; S614-E618 PolarHBondContact O-N 2.63Å
615	L	85.7	Confident	82.6	Confident	92 Å²	92	91.7 Å²	91.7	48%	0.482	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-36.9	178.3	-72.7	172.8	0	0	0	112.1	E611 V612 E618 L619	E611-L615 HydrophobicContact CG-CD1 4.15Å; E611-L615 WeakPolarHBondContact O-CB 3.4Å; E611-L615 WeakPolarHBondContact O-CG 3.39Å; E611-L615 PolarHBondContact O-N 3.4Å; V612-L615 PolarHBondContact O-N 2.94Å; L615-E618 PolarHBondContact O-N 3.28Å; L615-L619 WeakPolarHBondContact O-CB 3.44Å; L615-L619 PolarHBondContact O-N 3.44Å
616	Q	87.9	Confident	82.6	Confident	121 Å²	121	93 Å²	93	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-63.5	-42.9	171.9	-85.6	178.3	-29.3	0	0	111.6	V612 S614 E618 L619 V620	V612-Q616 WeakPolarHBondContact O-CB 3.3Å; V612-Q616 WeakPolarHBondContact O-CG 3.44Å; V612-Q616 PolarHBondContact O-N 3.29Å; S614-Q616 VanDerWaalsContact C-N 3.32Å; S614-Q616 PolarHBondContact O-N 2.85Å; Q616-E618 VanDerWaalsContact C-N 3.33Å; Q616-E618 PolarHBondContact O-N 3.41Å; Q616-L619 PolarHBondContact O-N 3.06Å; Q616-V620 VanDerWaalsContact O-CG2 3.29Å; Q616-V620 WeakPolarHBondContact O-CG2 3.48Å; Q616-V620 PolarHBondContact O-N 3.4Å
617	S	82.1	Confident	82.3	Confident	59 Å²	59	96.2 Å²	96.2	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-37.9	176.5	83.9	0	0	0	0	112.3	S613 S614 V620 K621	S613-S617 PolarHBondContact O-N 3.19Å; S614-S617 WeakPolarHBondContact O-CB 3.34Å; S614-S617 PolarHBondContact O-N 3.05Å; S614-S617 VanDerWaalsContact O-N 3.07Å; S614-S617 PolarHBondContact O-OG 2.99Å; S617-V620 PolarHBondContact O-N 3.43Å; S617-K621 WeakPolarHBondContact O-CG 3.49Å; S617-K621 PolarHBondContact O-N 3.4Å
618	E	87.7	Confident	81.9	Confident	106 Å²	106	97.3 Å²	97.3	50%	0.495	51%	0.506	S	S	.	.	H	α-helix	trans	-71.9	-38.7	178.6	-165.5	169.8	-161.4	0	0	111.3	S614 L615 Q616 K621 K622	S614-E618 WeakPolarHBondContact O-CB 3.4Å; S614-E618 PolarHBondContact O-N 2.63Å; L615-E618 PolarHBondContact O-N 3.28Å; Q616-E618 VanDerWaalsContact C-N 3.33Å; Q616-E618 PolarHBondContact O-N 3.41Å; E618-K621 PolarHBondContact O-N 2.96Å; E618-K622 WeakPolarHBondContact O-CB 3.39Å; E618-K622 WeakPolarHBondContact O-CG 3.37Å; E618-K622 PolarHBondContact O-N 3.48Å
619	L	84.6	Confident	81.2	Confident	111 Å²	111	97.8 Å²	97.8	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-44.6	171.8	-176.9	68.2	0	0	0	111.2	L615 Q616 K622 C623	L615-L619 WeakPolarHBondContact O-CB 3.44Å; L615-L619 PolarHBondContact O-N 3.44Å; Q616-L619 PolarHBondContact O-N 3.06Å; L619-K622 PolarHBondContact O-N 3.34Å; L619-C623 WeakPolarHBondContact O-CB 3.44Å; L619-C623 PolarHBondContact O-N 2.92Å; L619-C623 PolarHBondContact O-SG 3.07Å
620	V	87.2	Confident	80.8	Confident	84 Å²	84	97.6 Å²	97.6	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-61.6	-45	176.2	169.1	0	0	0	0	111	Q616 S617 K622 C623 Q624	Q616-V620 VanDerWaalsContact O-CG2 3.29Å; Q616-V620 WeakPolarHBondContact O-CG2 3.48Å; Q616-V620 PolarHBondContact O-N 3.4Å; S617-V620 PolarHBondContact O-N 3.43Å; V620-K622 PolarHBondContact O-N 3.31Å; V620-C623 PolarHBondContact O-N 3Å; V620-Q624 PolarHBondContact O-N 3.32Å
621	K	86	Confident	80.1	Confident	138 Å²	138	101.5 Å²	101.5	60%	0.6	52%	0.52	S	S	*	.	H	α-helix	trans	-60.6	-43.9	174.4	-76.9	179.3	-179.5	177.9	0	111.9	S617 E618 Q624 E625	S617-K621 WeakPolarHBondContact O-CG 3.49Å; S617-K621 PolarHBondContact O-N 3.4Å; E618-K621 PolarHBondContact O-N 2.96Å; K621-Q624 PolarHBondContact O-N 2.87Å; K621-E625 PolarHBondContact O-N 3.29Å
622	K	83.9	Confident	78.6	Confident	105 Å²	105	100.4 Å²	100.4	46%	0.457	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-39	176.5	-81.8	-73.2	170.7	-154.1	0	112.3	E618 L619 V620 E625 I626	E618-K622 WeakPolarHBondContact O-CB 3.39Å; E618-K622 WeakPolarHBondContact O-CG 3.37Å; E618-K622 PolarHBondContact O-N 3.48Å; L619-K622 PolarHBondContact O-N 3.34Å; V620-K622 PolarHBondContact O-N 3.31Å; K622-E625 IonicContact NZ-OE2 2.71Å; K622-E625 PolarHBondContact NZ-OE2 2.87Å; K622-E625 PolarHBondContact O-N 2.95Å; K622-I626 WeakPolarHBondContact O-CB 3.24Å; K622-I626 WeakPolarHBondContact O-CD1 3.39Å; K622-I626 WeakPolarHBondContact O-CG1 3.33Å; K622-I626 PolarHBondContact O-N 2.96Å
623	C	77.1	Confident	76.8	Confident	69 Å²	69	100.8 Å²	100.8	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-42.1	173.3	-73.4	0	0	0	0	111.4	L619 V620 I626 E627	L619-C623 WeakPolarHBondContact O-CB 3.44Å; L619-C623 PolarHBondContact O-N 2.92Å; L619-C623 PolarHBondContact O-SG 3.07Å; V620-C623 PolarHBondContact O-N 3Å; C623-I626 PolarHBondContact O-N 2.65Å; C623-E627 PolarHBondContact O-N 3.4Å
624	Q	79	Confident	75	Confident	113 Å²	113	104.1 Å²	104.1	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-64	-45.1	174.2	-75.3	177.4	-19.6	0	0	112.2	V620 K621 I626 E627 E628	V620-Q624 PolarHBondContact O-N 3.32Å; K621-Q624 PolarHBondContact O-N 2.87Å; Q624-I626 VanDerWaalsContact C-N 3.33Å; Q624-I626 PolarHBondContact O-N 2.97Å; Q624-E627 WeakPolarHBondContact O-CB 3.15Å; Q624-E627 PolarHBondContact O-N 3.09Å; Q624-E627 VanDerWaalsContact O-N 3.13Å; Q624-E628 PolarHBondContact O-N 3.03Å
625	E	82.8	Confident	72.8	Confident	94 Å²	94	111 Å²	111	44%	0.439	55%	0.552	S	S	.	*	H	α-helix	trans	-59	-42.2	174.1	-105.9	-177.5	-179.9	0	0	112.1	K621 K622 E627 E628 L629	K621-E625 PolarHBondContact O-N 3.29Å; K622-E625 IonicContact NZ-OE2 2.71Å; K622-E625 PolarHBondContact NZ-OE2 2.87Å; K622-E625 PolarHBondContact O-N 2.95Å; E625-E627 VanDerWaalsContact C-N 3.32Å; E625-E628 PolarHBondContact O-N 2.82Å; E625-L629 WeakPolarHBondContact O-CB 3.44Å; E625-L629 WeakPolarHBondContact O-CG 3.33Å; E625-L629 PolarHBondContact O-N 3.19Å
626	I	75.1	Confident	70.7	Confident	105 Å²	105	115.9 Å²	115.9	54%	0.538	57%	0.569	S	S	.	*	H	α-helix	trans	-64.9	-39.3	175.8	-71.7	165.9	0	0	0	110.1	K622 C623 Q624 L629 N630	K622-I626 WeakPolarHBondContact O-CB 3.24Å; K622-I626 WeakPolarHBondContact O-CD1 3.39Å; K622-I626 WeakPolarHBondContact O-CG1 3.33Å; K622-I626 PolarHBondContact O-N 2.96Å; C623-I626 PolarHBondContact O-N 2.65Å; Q624-I626 VanDerWaalsContact C-N 3.33Å; Q624-I626 PolarHBondContact O-N 2.97Å; I626-L629 PolarHBondContact O-N 3.44Å; I626-N630 WeakPolarHBondContact O-CB 3.38Å; I626-N630 PolarHBondContact O-N 3.39Å
627	E	74	Confident	68.3	Low	119 Å²	119	114.5 Å²	114.5	56%	0.556	57%	0.573	S	S	*	*	H	α-helix	trans	-64.9	-40.1	175.5	-125.1	177.4	-170.4	0	0	112.2	C623 Q624 E625 K631	C623-E627 PolarHBondContact O-N 3.4Å; Q624-E627 WeakPolarHBondContact O-CB 3.15Å; Q624-E627 PolarHBondContact O-N 3.09Å; Q624-E627 VanDerWaalsContact O-N 3.13Å; E625-E627 VanDerWaalsContact C-N 3.32Å; E627-K631 VanDerWaalsContact O-CG 3.25Å; E627-K631 WeakPolarHBondContact O-CG 3.32Å; E627-K631 PolarHBondContact O-N 2.94Å
628	E	72.5	Confident	66.5	Low	124 Å²	124	117.2 Å²	117.2	58%	0.579	58%	0.581	S	S	*	*	H	α-helix	trans	-68.2	-44.3	173.9	-73.7	-177.4	178.2	0	0	112.3	Q624 E625 N630 K631 S632	Q624-E628 PolarHBondContact O-N 3.03Å; E625-E628 PolarHBondContact O-N 2.82Å; E628-N630 VanDerWaalsContact C-N 3.33Å; E628-N630 PolarHBondContact O-N 3.47Å; E628-K631 WeakPolarHBondContact O-CB 3.26Å; E628-K631 PolarHBondContact O-N 2.86Å; E628-S632 WeakPolarHBondContact O-CB 3.41Å; E628-S632 PolarHBondContact O-N 2.94Å; E628-S632 PolarHBondContact O-OG 3.36Å
629	L	64.1	Low	64	Low	111 Å²	111	116.3 Å²	116.3	58%	0.581	59%	0.592	S	S	*	*	H	α-helix	trans	-62.6	-41.4	173.6	-81.8	173.4	0	0	0	110.7	E625 I626 K631 S632 M633	E625-L629 WeakPolarHBondContact O-CB 3.44Å; E625-L629 WeakPolarHBondContact O-CG 3.33Å; E625-L629 PolarHBondContact O-N 3.19Å; I626-L629 PolarHBondContact O-N 3.44Å; L629-K631 VanDerWaalsContact C-N 3.28Å; L629-K631 PolarHBondContact O-N 2.95Å; L629-S632 CarbonylContact O-C 3.6Å; L629-S632 WeakPolarHBondContact O-CA 3.49Å; L629-S632 PolarHBondContact O-N 3.33Å; L629-M633 WeakPolarHBondContact O-CA 3.23Å; L629-M633 WeakPolarHBondContact O-CB 3.39Å; L629-M633 PolarHBondContact O-N 3Å
630	N	71	Confident	61.8	Low	110 Å²	110	118.3 Å²	118.3	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-64.8	-33.6	177.3	-163.9	22	0	0	0	111.8	I626 E628	I626-N630 WeakPolarHBondContact O-CB 3.38Å; I626-N630 PolarHBondContact O-N 3.39Å; E628-N630 VanDerWaalsContact C-N 3.33Å; E628-N630 PolarHBondContact O-N 3.47Å
631	K	65.1	Low	59.6	Low	156 Å²	156	121.3 Å²	121.3	68%	0.678	61%	0.612	S	S	*	*	H	α-helix	trans	-69.5	-34.9	169.2	-71.2	166.4	-173.6	167.6	0	112.4	E627 E628 L629	E627-K631 VanDerWaalsContact O-CG 3.25Å; E627-K631 WeakPolarHBondContact O-CG 3.32Å; E627-K631 PolarHBondContact O-N 2.94Å; E628-K631 WeakPolarHBondContact O-CB 3.26Å; E628-K631 PolarHBondContact O-N 2.86Å; L629-K631 VanDerWaalsContact C-N 3.28Å; L629-K631 PolarHBondContact O-N 2.95Å
632	S	56.9	Low	57.6	Low	87 Å²	87	119.5 Å²	119.5	61%	0.608	62%	0.615	S	S	*	*	H	α-helix	trans	-83	-23.5	-178.4	-53	0	0	0	0	113.3	E628 L629 N634	E628-S632 WeakPolarHBondContact O-CB 3.41Å; E628-S632 PolarHBondContact O-N 2.94Å; E628-S632 PolarHBondContact O-OG 3.36Å; L629-S632 CarbonylContact O-C 3.6Å; L629-S632 WeakPolarHBondContact O-CA 3.49Å; L629-S632 PolarHBondContact O-N 3.33Å; S632-N634 PolarHBondContact O-N 3.29Å
633	M	44.7	Very low	55.9	Low	86 Å²	86	120.2 Å²	120.2	42%	0.424	63%	0.628	S	S	.	*			trans	-75.7	61.5	176.9	-155.6	83.2	162.9	0	0	108.3	L629 W635 I638	L629-M633 WeakPolarHBondContact O-CA 3.23Å; L629-M633 WeakPolarHBondContact O-CB 3.39Å; L629-M633 PolarHBondContact O-N 3Å; M633-W635 PolarHBondContact O-N 3.49Å; M633-I638 HydrophobicContact CE-CD1 3.31Å; M633-I638 HydrophobicContact SD-CD1 4.27Å
634	N	40.3	Very low	54.6	Low	132 Å²	132	123.5 Å²	123.5	71%	0.706	64%	0.641	S	S	*	*			trans	-60.7	104.1	163.2	-118.2	-31.5	0	0	0	106.1	S632 K636	S632-N634 PolarHBondContact O-N 3.29Å; N634-K636 PolarHBondContact O-N 3.45Å
635	W	41.3	Very low	53.3	Low	208 Å²	208	121.5 Å²	121.5	79%	0.788	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	10.7	-173.3	-75.3	96.1	0	0	0	116.7	M633	M633-W635 PolarHBondContact O-N 3.49Å
636	K	41.9	Very low	51.9	Low	195 Å²	195	122.2 Å²	122.2	85%	0.848	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-9.3	-176.8	-77.6	-175.3	174.2	178.4	0	116.1	N634	N634-K636 PolarHBondContact O-N 3.45Å
637	S	38.1	Very low	51.4	Low	92 Å²	92	125.8 Å²	125.8	64%	0.643	65%	0.653	S	S	*	*	S	Bend	trans	-98.6	-12.7	-173	-55.2	0	0	0	0	116.1
638	I	43.3	Very low	51.4	Low	116 Å²	116	126.4 Å²	126.4	60%	0.595	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-89.7	-10.2	-171	-66.5	168.9	0	0	0	113.3	M633 N640	M633-I638 HydrophobicContact CE-CD1 3.31Å; M633-I638 HydrophobicContact SD-CD1 4.27Å; I638-N640 VanDerWaalsContact C-N 3.32Å; I638-N640 PolarHBondContact O-N 2.98Å
639	A	35.7	Very low	51.6	Low	88 Å²	88	123.7 Å²	123.7	73%	0.727	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-72.1	-14.3	-172.8	0	0	0	0	0	115.8
640	N	37.1	Very low	52.2	Low	153 Å²	153	123.1 Å²	123.1	82%	0.818	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-130.9	23.3	-166.6	-71.4	-13.9	0	0	0	116.4	I638	I638-N640 VanDerWaalsContact C-N 3.32Å; I638-N640 PolarHBondContact O-N 2.98Å
641	Q	41.4	Very low	52.7	Low	146 Å²	146	120.4 Å²	120.4	68%	0.682	63%	0.634	S	S	*	*			trans	-95.1	143.8	-179.2	-68.7	-163.8	6.6	0	0	114.7
642	P	44.3	Very low	53.6	Low	101 Å²	101	118.7 Å²	118.7	66%	0.656	63%	0.628	S	S	*	*			trans	-74.4	144.9	-161.2	-12.4	29.7	0	0	0	113.2	N644 C645	P642-N644 PolarHBondContact O-N 2.66Å; P642-C645 PolarHBondContact O-N 3.31Å
643	T	47.7	Very low	54.8	Low	119 Å²	119	120 Å²	120	73%	0.73	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.9	-15.3	-170.5	-2.3	0	0	0	0	116.7	Y647	T643-Y647 PolarHBondContact O-N 3.39Å
644	N	50	Low	57	Low	138 Å²	138	119.7 Å²	119.7	74%	0.738	62%	0.623	S	S	*	*	H	α-helix	trans	-72.9	-32.8	-178.1	-135.4	7.1	0	0	0	113	P642 Q648	P642-N644 PolarHBondContact O-N 2.66Å; N644-Q648 PolarHBondContact O-N 3.14Å
645	C	53	Low	59.4	Low	72 Å²	72	118.2 Å²	118.2	49%	0.486	62%	0.615	S	S	.	*	H	α-helix	trans	-71	-35.4	178.8	-173.1	0	0	0	0	112	P642 T649	P642-C645 PolarHBondContact O-N 3.31Å; C645-T649 PolarHBondContact O-N 3.33Å; C645-T649 VanDerWaalsContact O-N 3.11Å; C645-T649 PolarHBondContact O-OG1 3.39Å
646	L	51.6	Low	61.8	Low	108 Å²	108	113.3 Å²	113.3	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-65.9	-42.6	176.5	-74.1	170.5	0	0	0	111.6	Q648 T649 I650	L646-Q648 VanDerWaalsContact C-N 3.33Å; L646-Q648 PolarHBondContact O-N 3.19Å; L646-T649 PolarHBondContact O-N 3.02Å; L646-I650 WeakPolarHBondContact O-CB 3.34Å; L646-I650 VanDerWaalsContact O-CG1 3.24Å; L646-I650 WeakPolarHBondContact O-CG1 3.37Å; L646-I650 PolarHBondContact O-N 2.93Å
647	Y	66.4	Low	63.9	Low	180 Å²	180	107.8 Å²	107.8	71%	0.706	58%	0.58	S	S	*	*	H	α-helix	trans	-62.5	-41.2	-179.9	-153.8	-86.6	0	0	0	112.1	T643 I650 S651	T643-Y647 PolarHBondContact O-N 3.39Å; Y647-I650 PolarHBondContact O-N 3.22Å; Y647-S651 WeakPolarHBondContact O-CB 3.37Å; Y647-S651 PolarHBondContact O-N 3.37Å
648	Q	72.5	Confident	66.4	Low	132 Å²	132	109 Å²	109	62%	0.617	58%	0.575	S	S	*	*	H	α-helix	trans	-66.8	-39.2	177.2	-166.8	173.1	9.4	0	0	112.1	N644 L646 S651 Q652	N644-Q648 PolarHBondContact O-N 3.14Å; L646-Q648 VanDerWaalsContact C-N 3.33Å; L646-Q648 PolarHBondContact O-N 3.19Å; Q648-S651 PolarHBondContact O-N 2.87Å; Q648-Q652 PolarHBondContact O-N 3.47Å
649	T	76.5	Confident	68.6	Low	67 Å²	67	105.8 Å²	105.8	41%	0.411	57%	0.566	S	S	.	*	H	α-helix	trans	-67	-42.9	177.3	-52.8	0	0	0	0	111.2	C645 L646 Q652 K653	C645-T649 PolarHBondContact O-N 3.33Å; C645-T649 VanDerWaalsContact O-N 3.11Å; C645-T649 PolarHBondContact O-OG1 3.39Å; L646-T649 PolarHBondContact O-N 3.02Å; T649-Q652 PolarHBondContact O-N 2.94Å; T649-K653 VanDerWaalsContact O-CG 3.31Å; T649-K653 WeakPolarHBondContact O-CG 3.3Å; T649-K653 PolarHBondContact O-N 3Å
650	I	76.6	Confident	71.3	Confident	99 Å²	99	106.4 Å²	106.4	51%	0.508	56%	0.557	S	S	.	*	H	α-helix	trans	-63.1	-47.4	176	-67.8	165.4	0	0	0	110	L646 Y647 Q652 K653 D654	L646-I650 WeakPolarHBondContact O-CB 3.34Å; L646-I650 VanDerWaalsContact O-CG1 3.24Å; L646-I650 WeakPolarHBondContact O-CG1 3.37Å; L646-I650 PolarHBondContact O-N 2.93Å; Y647-I650 PolarHBondContact O-N 3.22Å; I650-Q652 PolarHBondContact O-N 3.46Å; I650-K653 CarbonylContact O-C 3.55Å; I650-K653 WeakPolarHBondContact O-CB 3.27Å; I650-K653 PolarHBondContact O-N 3.04Å; I650-D654 PolarHBondContact O-N 2.92Å
651	S	82.8	Confident	74	Confident	53 Å²	53	106.4 Å²	106.4	37%	0.371	55%	0.546	S	S	.	.	H	α-helix	trans	-61.5	-39.1	178.1	-179.7	0	0	0	0	113.1	Y647 Q648 K653 D654 N655	Y647-S651 WeakPolarHBondContact O-CB 3.37Å; Y647-S651 PolarHBondContact O-N 3.37Å; Q648-S651 PolarHBondContact O-N 2.87Å; S651-K653 VanDerWaalsContact C-N 3.34Å; S651-D654 PolarHBondContact O-N 2.86Å; S651-N655 VanDerWaalsContact O-CG 3.28Å; S651-N655 PolarHBondContact O-N 3.26Å; S651-N655 PolarHBondContact O-ND2 2.83Å
652	Q	83.4	Confident	76.4	Confident	120 Å²	120	104.6 Å²	104.6	56%	0.561	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-40.7	172.3	-90.4	-175.8	-21.9	0	0	112.4	Q648 T649 I650 N655 Q656	Q648-Q652 PolarHBondContact O-N 3.47Å; T649-Q652 PolarHBondContact O-N 2.94Å; I650-Q652 PolarHBondContact O-N 3.46Å; Q652-N655 PolarHBondContact O-N 3.02Å; Q652-Q656 WeakPolarHBondContact O-CG 3.34Å; Q652-Q656 PolarHBondContact O-N 3.47Å
653	K	82.5	Confident	78.7	Confident	116 Å²	116	105.4 Å²	105.4	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-66.9	-41	177	-70.5	-67	178.9	-172.4	0	111.8	T649 I650 S651 N655 Q656 I657	T649-K653 VanDerWaalsContact O-CG 3.31Å; T649-K653 WeakPolarHBondContact O-CG 3.3Å; T649-K653 PolarHBondContact O-N 3Å; I650-K653 CarbonylContact O-C 3.55Å; I650-K653 WeakPolarHBondContact O-CB 3.27Å; I650-K653 PolarHBondContact O-N 3.04Å; S651-K653 VanDerWaalsContact C-N 3.34Å; K653-N655 VanDerWaalsContact C-N 3.34Å; K653-N655 PolarHBondContact O-N 3Å; K653-Q656 WeakPolarHBondContact O-CB 3.33Å; K653-Q656 PolarHBondContact O-N 3.45Å; K653-I657 WeakPolarHBondContact O-CB 3.48Å; K653-I657 VanDerWaalsContact O-CG1 3.27Å; K653-I657 WeakPolarHBondContact O-CG1 3.45Å; K653-I657 PolarHBondContact O-N 3.36Å
654	D	91	Very high	80.8	Confident	79 Å²	79	104 Å²	104	42%	0.422	52%	0.524	S	S	.	.	H	α-helix	trans	-61.7	-41.6	174.7	-73.8	-22.8	0	0	0	111.7	I650 S651 Q656 I657 H658	I650-D654 PolarHBondContact O-N 2.92Å; S651-D654 PolarHBondContact O-N 2.86Å; D654-Q656 PolarHBondContact O-N 3.33Å; D654-I657 PolarHBondContact O-N 2.86Å; D654-H658 WeakPolarHBondContact O-CB 3.39Å; D654-H658 PolarHBondContact O-CD2 2.91Å; D654-H658 PolarHBondContact O-N 3.32Å
655	N	89.4	Confident	82.8	Confident	101 Å²	101	99.8 Å²	99.8	54%	0.54	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-38.5	174.7	-70.4	-29.5	0	0	0	112.6	S651 Q652 K653 H658 A659	S651-N655 VanDerWaalsContact O-CG 3.28Å; S651-N655 PolarHBondContact O-N 3.26Å; S651-N655 PolarHBondContact O-ND2 2.83Å; Q652-N655 PolarHBondContact O-N 3.02Å; K653-N655 VanDerWaalsContact C-N 3.34Å; K653-N655 PolarHBondContact O-N 3Å; N655-H658 PolarHBondContact O-N 3.46Å; N655-A659 WeakPolarHBondContact O-CB 3.42Å; N655-A659 PolarHBondContact O-N 2.89Å
656	Q	91.8	Very high	84.7	Confident	105 Å²	105	101 Å²	101	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-42.2	174	-75.9	178.2	-5.2	0	0	111.7	Q652 K653 D654 H658 A659 L660	Q652-Q656 WeakPolarHBondContact O-CG 3.34Å; Q652-Q656 PolarHBondContact O-N 3.47Å; K653-Q656 WeakPolarHBondContact O-CB 3.33Å; K653-Q656 PolarHBondContact O-N 3.45Å; D654-Q656 PolarHBondContact O-N 3.33Å; Q656-H658 VanDerWaalsContact C-N 3.35Å; Q656-A659 PolarHBondContact O-N 2.91Å; Q656-L660 WeakPolarHBondContact O-CG 3.47Å; Q656-L660 PolarHBondContact O-N 3.21Å
657	I	86.4	Confident	86.7	Confident	78 Å²	78	100.3 Å²	100.3	40%	0.4	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-44.4	176.1	-72	167.2	0	0	0	110.1	K653 D654 A659 L660 Y661	K653-I657 WeakPolarHBondContact O-CB 3.48Å; K653-I657 VanDerWaalsContact O-CG1 3.27Å; K653-I657 WeakPolarHBondContact O-CG1 3.45Å; K653-I657 PolarHBondContact O-N 3.36Å; D654-I657 PolarHBondContact O-N 2.86Å; I657-A659 PolarHBondContact O-N 3.13Å; I657-L660 PolarHBondContact O-N 2.94Å; I657-Y661 HydrophobicContact CG2-CD2 3.52Å; I657-Y661 HydrophobicContact CG2-CE2 3.27Å; I657-Y661 WeakPolarHBondContact O-CD2 3.33Å; I657-Y661 PolarHBondContact O-N 3.41Å
658	H	90.1	Very high	88	Confident	117 Å²	117	97.7 Å²	97.7	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-40.9	174.3	-79.3	-57.4	0	0	0	112.9	D654 N655 Q656 L660 Y661 N662	D654-H658 WeakPolarHBondContact O-CB 3.39Å; D654-H658 PolarHBondContact O-CD2 2.91Å; D654-H658 PolarHBondContact O-N 3.32Å; N655-H658 PolarHBondContact O-N 3.46Å; Q656-H658 VanDerWaalsContact C-N 3.35Å; H658-L660 VanDerWaalsContact C-N 3.35Å; H658-Y661 PolarHBondContact O-N 2.79Å; H658-N662 PolarHBondContact O-N 3.07Å; H658-N662 PolarHBondContact O-ND2 2.92Å
659	A	91	Very high	89.1	Confident	50 Å²	50	98.2 Å²	98.2	41%	0.413	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-41.5	174.7	0	0	0	0	0	111.9	N655 Q656 I657 N662 Q663	N655-A659 WeakPolarHBondContact O-CB 3.42Å; N655-A659 PolarHBondContact O-N 2.89Å; Q656-A659 PolarHBondContact O-N 2.91Å; I657-A659 PolarHBondContact O-N 3.13Å; A659-N662 PolarHBondContact O-N 2.95Å; A659-Q663 WeakPolarHBondContact O-CG 3.47Å; A659-Q663 PolarHBondContact O-N 2.99Å
660	L	91	Very high	90	Very high	101 Å²	101	101.2 Å²	101.2	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-42.2	175.2	-73.4	173.3	0	0	0	111.9	Q656 I657 H658 N662 Q663 L664	Q656-L660 WeakPolarHBondContact O-CG 3.47Å; Q656-L660 PolarHBondContact O-N 3.21Å; I657-L660 PolarHBondContact O-N 2.94Å; H658-L660 VanDerWaalsContact C-N 3.35Å; L660-N662 VanDerWaalsContact C-N 3.32Å; L660-N662 PolarHBondContact O-N 3.2Å; L660-Q663 PolarHBondContact O-N 3.49Å; L660-L664 WeakPolarHBondContact O-CB 3.43Å; L660-L664 PolarHBondContact O-N 3.36Å
661	Y	93.9	Very high	90.8	Very high	152 Å²	152	100.2 Å²	100.2	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-60.3	-41.1	174.8	-83.2	-59	0	0	0	112.2	I657 H658 L664 A665	I657-Y661 HydrophobicContact CG2-CD2 3.52Å; I657-Y661 HydrophobicContact CG2-CE2 3.27Å; I657-Y661 WeakPolarHBondContact O-CD2 3.33Å; I657-Y661 PolarHBondContact O-N 3.41Å; H658-Y661 PolarHBondContact O-N 2.79Å; Y661-L664 PolarHBondContact O-N 3.41Å; Y661-A665 WeakPolarHBondContact O-CB 3.32Å; Y661-A665 PolarHBondContact O-N 3.34Å
662	N	91.8	Very high	91.3	Very high	109 Å²	109	102.4 Å²	102.4	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-64.9	-42.5	175.2	-72.1	-19.3	0	0	0	111.9	H658 A659 L660 L664 A665 D666	H658-N662 PolarHBondContact O-N 3.07Å; H658-N662 PolarHBondContact O-ND2 2.92Å; A659-N662 PolarHBondContact O-N 2.95Å; L660-N662 VanDerWaalsContact C-N 3.32Å; L660-N662 PolarHBondContact O-N 3.2Å; N662-L664 VanDerWaalsContact C-N 3.33Å; N662-L664 PolarHBondContact O-N 3.24Å; N662-A665 PolarHBondContact O-N 3.37Å; N662-D666 PolarHBondContact O-N 3.02Å
663	Q	94.2	Very high	91.9	Very high	118 Å²	118	101.2 Å²	101.2	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-63	-39.7	174.7	-74	-180	-9.2	0	0	112.2	A659 L660 D666 I667	A659-Q663 WeakPolarHBondContact O-CG 3.47Å; A659-Q663 PolarHBondContact O-N 2.99Å; L660-Q663 PolarHBondContact O-N 3.49Å; Q663-D666 PolarHBondContact O-N 2.91Å; Q663-I667 VanDerWaalsContact O-CG1 3.25Å; Q663-I667 WeakPolarHBondContact O-CG1 3.38Å; Q663-I667 PolarHBondContact O-N 3.09Å
664	L	90	Very high	92.4	Very high	90 Å²	90	102.9 Å²	102.9	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-45.5	175.6	-123.6	145.9	0	0	0	110.7	L660 Y661 N662 D666 I667 E668	L660-L664 WeakPolarHBondContact O-CB 3.43Å; L660-L664 PolarHBondContact O-N 3.36Å; Y661-L664 PolarHBondContact O-N 3.41Å; N662-L664 VanDerWaalsContact C-N 3.33Å; N662-L664 PolarHBondContact O-N 3.24Å; L664-D666 PolarHBondContact O-N 3.42Å; L664-I667 PolarHBondContact O-N 3.22Å; L664-E668 HydrophobicContact CD2-CG 4.47Å; L664-E668 WeakPolarHBondContact O-CB 3.44Å; L664-E668 WeakPolarHBondContact O-CG 3.38Å; L664-E668 PolarHBondContact O-N 3.22Å
665	A	92.8	Very high	92.5	Very high	49 Å²	49	104.6 Å²	104.6	41%	0.405	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-41	175.7	0	0	0	0	0	112.6	Y661 N662 E668 K669	Y661-A665 WeakPolarHBondContact O-CB 3.32Å; Y661-A665 PolarHBondContact O-N 3.34Å; N662-A665 PolarHBondContact O-N 3.37Å; A665-E668 PolarHBondContact O-N 2.98Å; A665-K669 WeakPolarHBondContact O-CB 3.26Å; A665-K669 PolarHBondContact O-N 3.27Å
666	D	93.7	Very high	92.8	Very high	98 Å²	98	104.2 Å²	104.2	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-67.7	-35.1	175.6	-80	-23.2	0	0	0	112.8	N662 Q663 L664 R670	N662-D666 PolarHBondContact O-N 3.02Å; Q663-D666 PolarHBondContact O-N 2.91Å; L664-D666 PolarHBondContact O-N 3.42Å; D666-R670 WeakPolarHBondContact O-CG 3.45Å; D666-R670 PolarHBondContact O-N 2.92Å; D666-R670 VanDerWaalsContact O-N 3.14Å; D666-R670 PolarHBondContact O-NE 3.18Å
667	I	93.2	Very high	93	Very high	92 Å²	92	104.2 Å²	104.2	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-46.8	174	-71.3	163.8	0	0	0	110.4	Q663 L664 K669 R670 S671	Q663-I667 VanDerWaalsContact O-CG1 3.25Å; Q663-I667 WeakPolarHBondContact O-CG1 3.38Å; Q663-I667 PolarHBondContact O-N 3.09Å; L664-I667 PolarHBondContact O-N 3.22Å; I667-K669 VanDerWaalsContact C-N 3.33Å; I667-K669 PolarHBondContact O-N 3.3Å; I667-R670 PolarHBondContact O-N 2.75Å; I667-S671 WeakPolarHBondContact O-CB 3.49Å; I667-S671 PolarHBondContact O-N 3.17Å
668	E	94.4	Very high	93.3	Very high	125 Å²	125	107.7 Å²	107.7	58%	0.584	52%	0.521	S	S	*	.	H	α-helix	trans	-60.1	-43.7	178.2	-75.4	176.6	173	0	0	111.4	L664 A665 R670 S671 L672	L664-E668 HydrophobicContact CD2-CG 4.47Å; L664-E668 WeakPolarHBondContact O-CB 3.44Å; L664-E668 WeakPolarHBondContact O-CG 3.38Å; L664-E668 PolarHBondContact O-N 3.22Å; A665-E668 PolarHBondContact O-N 2.98Å; E668-R670 PolarHBondContact O-N 2.87Å; E668-S671 WeakPolarHBondContact O-CB 3.41Å; E668-S671 PolarHBondContact O-N 3.35Å; E668-L672 PolarHBondContact O-N 2.96Å
669	K	95.1	Very high	93.5	Very high	144 Å²	144	105.7 Å²	105.7	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-60.4	-43.2	175.1	-172.2	177.4	-179.7	-179.8	0	112.3	A665 I667 L672 L673	A665-K669 WeakPolarHBondContact O-CB 3.26Å; A665-K669 PolarHBondContact O-N 3.27Å; I667-K669 VanDerWaalsContact C-N 3.33Å; I667-K669 PolarHBondContact O-N 3.3Å; K669-L672 PolarHBondContact O-N 3.49Å; K669-L673 PolarHBondContact O-N 3.35Å; K669-L673 VanDerWaalsContact O-N 3.16Å
670	R	95.4	Very high	93.7	Very high	129 Å²	129	109.5 Å²	109.5	49%	0.487	52%	0.521	S	S	.	.	H	α-helix	trans	-67.7	-38.6	175.9	-75.6	-178.7	-68.7	139	-8.7	112.5	D666 I667 E668 L672 L673 Y674	D666-R670 WeakPolarHBondContact O-CG 3.45Å; D666-R670 PolarHBondContact O-N 2.92Å; D666-R670 VanDerWaalsContact O-N 3.14Å; D666-R670 PolarHBondContact O-NE 3.18Å; I667-R670 PolarHBondContact O-N 2.75Å; E668-R670 PolarHBondContact O-N 2.87Å; R670-L672 VanDerWaalsContact C-N 3.27Å; R670-L672 PolarHBondContact O-N 3.48Å; R670-L673 PolarHBondContact O-N 3.03Å; R670-Y674 HydrophobicContact CB-CE2 4.47Å; R670-Y674 WeakPolarHBondContact O-CD2 3.31Å; R670-Y674 PolarHBondContact O-N 2.93Å
671	S	92.3	Very high	93.8	Very high	78 Å²	78	109.1 Å²	109.1	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-59.8	-40.4	174.9	-176.9	0	0	0	0	111.4	I667 E668 Y674 K675	I667-S671 WeakPolarHBondContact O-CB 3.49Å; I667-S671 PolarHBondContact O-N 3.17Å; E668-S671 WeakPolarHBondContact O-CB 3.41Å; E668-S671 PolarHBondContact O-N 3.35Å; S671-Y674 PolarHBondContact O-N 2.92Å; S671-K675 WeakPolarHBondContact O-CB 3.46Å; S671-K675 PolarHBondContact O-N 2.82Å
672	L	94.1	Very high	93.8	Very high	100 Å²	100	103.3 Å²	103.3	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-44.5	174.9	-165.5	75.2	0	0	0	112	E668 K669 R670 K675 E676	E668-L672 PolarHBondContact O-N 2.96Å; K669-L672 PolarHBondContact O-N 3.49Å; R670-L672 VanDerWaalsContact C-N 3.27Å; R670-L672 PolarHBondContact O-N 3.48Å; L672-K675 WeakPolarHBondContact O-CB 3.46Å; L672-K675 PolarHBondContact O-N 2.97Å; L672-E676 PolarHBondContact O-N 3.47Å
673	L	94.7	Very high	93.9	Very high	95 Å²	95	101.4 Å²	101.4	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-61.4	-44.9	176.8	-71	173.3	0	0	0	112.5	K669 R670 K675 E676 E677	K669-L673 PolarHBondContact O-N 3.35Å; K669-L673 VanDerWaalsContact O-N 3.16Å; R670-L673 PolarHBondContact O-N 3.03Å; L673-K675 VanDerWaalsContact C-N 3.25Å; L673-K675 PolarHBondContact O-N 3.23Å; L673-E676 PolarHBondContact O-N 3.28Å; L673-E677 PolarHBondContact O-N 3.23Å
674	Y	93	Very high	94	Very high	151 Å²	151	101 Å²	101	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-32.4	176	-71.6	-49	0	0	0	112.5	R670 S671 R678	R670-Y674 HydrophobicContact CB-CE2 4.47Å; R670-Y674 WeakPolarHBondContact O-CD2 3.31Å; R670-Y674 PolarHBondContact O-N 2.93Å; S671-Y674 PolarHBondContact O-N 2.92Å; Y674-R678 VanDerWaalsContact O-CB 3.24Å; Y674-R678 WeakPolarHBondContact O-CB 3.24Å; Y674-R678 PolarHBondContact O-N 3.35Å
675	K	94.9	Very high	94.2	Very high	115 Å²	115	103.5 Å²	103.5	50%	0.5	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-45.2	173.8	-173	-179	176.5	-175.8	0	111.4	S671 L672 L673 E677 R678 D679	S671-K675 WeakPolarHBondContact O-CB 3.46Å; S671-K675 PolarHBondContact O-N 2.82Å; L672-K675 WeakPolarHBondContact O-CB 3.46Å; L672-K675 PolarHBondContact O-N 2.97Å; L673-K675 VanDerWaalsContact C-N 3.25Å; L673-K675 PolarHBondContact O-N 3.23Å; K675-E677 VanDerWaalsContact C-N 3.35Å; K675-E677 PolarHBondContact O-N 2.97Å; K675-R678 PolarHBondContact O-N 2.79Å; K675-D679 WeakPolarHBondContact O-CB 3.33Å; K675-D679 PolarHBondContact O-N 3.18Å
676	E	95.6	Very high	94.3	Very high	93 Å²	93	105.3 Å²	105.3	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-61.3	-42.1	175	-71.3	178.6	-177.8	0	0	112.2	L672 L673 D679 K680	L672-E676 PolarHBondContact O-N 3.47Å; L673-E676 PolarHBondContact O-N 3.28Å; E676-D679 PolarHBondContact O-N 3.16Å; E676-K680 WeakPolarHBondContact O-CG 3.46Å; E676-K680 PolarHBondContact O-N 2.98Å
677	E	94.7	Very high	94.3	Very high	104 Å²	104	105.6 Å²	105.6	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-45.1	175.9	-174	179.3	-175.4	0	0	111.6	L673 K675 D679 K680 L681	L673-E677 PolarHBondContact O-N 3.23Å; K675-E677 VanDerWaalsContact C-N 3.35Å; K675-E677 PolarHBondContact O-N 2.97Å; E677-D679 VanDerWaalsContact C-N 3.28Å; E677-D679 PolarHBondContact O-N 2.98Å; E677-K680 WeakPolarHBondContact O-CB 3.42Å; E677-K680 PolarHBondContact O-N 3.26Å; E677-L681 HydrophobicContact CG-CD1 4.22Å; E677-L681 WeakPolarHBondContact O-CG 3.44Å; E677-L681 PolarHBondContact O-N 3.38Å
678	R	93.5	Very high	94.3	Very high	152 Å²	152	106.8 Å²	106.8	57%	0.574	51%	0.509	S	S	*	.	H	α-helix	trans	-58.7	-41.9	174.8	-175	-160.2	68.7	156.2	3.9	111.5	Y674 K675 A682	Y674-R678 VanDerWaalsContact O-CB 3.24Å; Y674-R678 WeakPolarHBondContact O-CB 3.24Å; Y674-R678 PolarHBondContact O-N 3.35Å; K675-R678 PolarHBondContact O-N 2.79Å; R678-A682 VanDerWaalsContact O-CB 3.24Å; R678-A682 WeakPolarHBondContact O-CB 3.31Å; R678-A682 PolarHBondContact O-N 2.89Å
679	D	94.1	Very high	94.3	Very high	75 Å²	75	103.7 Å²	103.7	40%	0.401	50%	0.501	S	S	.	.	H	α-helix	trans	-70.6	-35.6	-180	-65	-12.2	0	0	0	111.1	K675 E676 E677 A682 S683	K675-D679 WeakPolarHBondContact O-CB 3.33Å; K675-D679 PolarHBondContact O-N 3.18Å; E676-D679 PolarHBondContact O-N 3.16Å; E677-D679 VanDerWaalsContact C-N 3.28Å; E677-D679 PolarHBondContact O-N 2.98Å; D679-A682 PolarHBondContact O-N 3.42Å; D679-S683 PolarHBondContact O-N 3.49Å
680	K	94.7	Very high	94.2	Very high	129 Å²	129	101 Å²	101	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-62.5	-51.5	169.9	-73.9	171.7	-174.7	172	0	112.1	E676 E677 A682 S683 E684	E676-K680 WeakPolarHBondContact O-CG 3.46Å; E676-K680 PolarHBondContact O-N 2.98Å; E677-K680 WeakPolarHBondContact O-CB 3.42Å; E677-K680 PolarHBondContact O-N 3.26Å; K680-A682 VanDerWaalsContact C-N 3.26Å; K680-A682 PolarHBondContact O-N 2.84Å; K680-S683 WeakPolarHBondContact O-CA 3.41Å; K680-S683 WeakPolarHBondContact O-CB 3.48Å; K680-S683 PolarHBondContact O-N 2.95Å; K680-S683 PolarHBondContact O-OG 2.93Å; K680-E684 PolarHBondContact O-N 3.02Å
681	L	94	Very high	94.1	Very high	94 Å²	94	98.5 Å²	98.5	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-60.8	-37	177.4	-71	173.2	0	0	0	111.8	E677 S683 E684 R685	E677-L681 HydrophobicContact CG-CD1 4.22Å; E677-L681 WeakPolarHBondContact O-CG 3.44Å; E677-L681 PolarHBondContact O-N 3.38Å; L681-S683 VanDerWaalsContact C-N 3.32Å; L681-S683 PolarHBondContact O-N 3.42Å; L681-E684 PolarHBondContact O-N 3.25Å; L681-R685 WeakPolarHBondContact O-CB 3.4Å; L681-R685 PolarHBondContact O-N 3.42Å
682	A	93	Very high	94.2	Very high	29 Å²	29	99.8 Å²	99.8	24%	0.24	49%	0.487	C	S	.	.	H	α-helix	trans	-63.3	-38.6	174.3	0	0	0	0	0	112	R678 D679 K680 R685 N686	R678-A682 VanDerWaalsContact O-CB 3.24Å; R678-A682 WeakPolarHBondContact O-CB 3.31Å; R678-A682 PolarHBondContact O-N 2.89Å; D679-A682 PolarHBondContact O-N 3.42Å; K680-A682 VanDerWaalsContact C-N 3.26Å; K680-A682 PolarHBondContact O-N 2.84Å; A682-R685 PolarHBondContact O-NE 3.47Å; A682-N686 PolarHBondContact O-N 2.97Å; A682-N686 PolarHBondContact O-ND2 2.61Å; A682-N686 PolarHBondContact O-OD1 3.45Å
683	S	94.8	Very high	94.1	Very high	69 Å²	69	101.2 Å²	101.2	48%	0.483	49%	0.491	S	S	.	.	H	α-helix	trans	-68.2	-41.2	175.8	76.5	0	0	0	0	112.7	D679 K680 L681 N686 L687	D679-S683 PolarHBondContact O-N 3.49Å; K680-S683 WeakPolarHBondContact O-CA 3.41Å; K680-S683 WeakPolarHBondContact O-CB 3.48Å; K680-S683 PolarHBondContact O-N 2.95Å; K680-S683 PolarHBondContact O-OG 2.93Å; L681-S683 VanDerWaalsContact C-N 3.32Å; L681-S683 PolarHBondContact O-N 3.42Å; S683-N686 PolarHBondContact O-N 3Å; S683-L687 PolarHBondContact O-N 3.46Å
684	E	96.6	Very high	94	Very high	111 Å²	111	102.4 Å²	102.4	52%	0.519	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-45.6	174.6	-71.3	178.4	-179	0	0	111.3	K680 L681 N686 L687 L688	K680-E684 PolarHBondContact O-N 3.02Å; L681-E684 PolarHBondContact O-N 3.25Å; E684-N686 VanDerWaalsContact C-N 3.27Å; E684-N686 PolarHBondContact O-N 2.85Å; E684-L687 WeakPolarHBondContact O-CB 3.47Å; E684-L687 PolarHBondContact O-N 2.91Å; E684-L687 VanDerWaalsContact O-N 3.11Å; E684-L688 WeakPolarHBondContact O-CD1 3.39Å; E684-L688 PolarHBondContact O-N 3.33Å
685	R	94.4	Very high	93.8	Very high	141 Å²	141	100.7 Å²	100.7	53%	0.532	49%	0.49	S	S	.	.	H	α-helix	trans	-59.6	-38.5	175.7	174.8	-82.5	-42.6	-131.4	0.5	111.8	L681 A682 L688 C689	L681-R685 WeakPolarHBondContact O-CB 3.4Å; L681-R685 PolarHBondContact O-N 3.42Å; A682-R685 PolarHBondContact O-NE 3.47Å; R685-L688 PolarHBondContact O-N 3.48Å; R685-C689 PolarHBondContact O-N 3.3Å; R685-C689 PolarHBondContact O-SG 2.81Å
686	N	93	Very high	93.6	Very high	88 Å²	88	98.8 Å²	98.8	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-66.5	-41	174.9	-69.4	-8.9	0	0	0	111.7	A682 S683 E684 C689 E690	A682-N686 PolarHBondContact O-N 2.97Å; A682-N686 PolarHBondContact O-ND2 2.61Å; A682-N686 PolarHBondContact O-OD1 3.45Å; S683-N686 PolarHBondContact O-N 3Å; E684-N686 VanDerWaalsContact C-N 3.27Å; E684-N686 PolarHBondContact O-N 2.85Å; N686-C689 WeakPolarHBondContact O-CB 3.47Å; N686-C689 PolarHBondContact O-N 3.2Å; N686-E690 PolarHBondContact O-N 3.19Å
687	L	94.1	Very high	93.3	Very high	103 Å²	103	98.2 Å²	98.2	54%	0.539	49%	0.487	S	S	.	.	H	α-helix	trans	-61	-45.3	175.3	-162	94.4	0	0	0	111.5	S683 E684 C689 E690 D691	S683-L687 PolarHBondContact O-N 3.46Å; E684-L687 WeakPolarHBondContact O-CB 3.47Å; E684-L687 PolarHBondContact O-N 2.91Å; E684-L687 VanDerWaalsContact O-N 3.11Å; L687-C689 VanDerWaalsContact C-N 3.33Å; L687-C689 PolarHBondContact O-N 3.28Å; L687-E690 WeakPolarHBondContact O-CB 3.47Å; L687-E690 PolarHBondContact O-N 2.9Å; L687-D691 PolarHBondContact O-N 3Å
688	L	94	Very high	93.1	Very high	117 Å²	117	98.1 Å²	98.1	61%	0.613	48%	0.483	S	S	*	.	H	α-helix	trans	-62.9	-36.9	175.5	-91.4	127.3	0	0	0	112.6	E684 R685 L692	E684-L688 WeakPolarHBondContact O-CD1 3.39Å; E684-L688 PolarHBondContact O-N 3.33Å; R685-L688 PolarHBondContact O-N 3.48Å; L688-L692 WeakPolarHBondContact O-CB 3.33Å; L688-L692 PolarHBondContact O-N 3.41Å
689	C	94.2	Very high	93	Very high	61 Å²	61	97.5 Å²	97.5	41%	0.412	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-43.1	172.8	-73.5	0	0	0	0	111.5	R685 N686 L687 L692 E693	R685-C689 PolarHBondContact O-N 3.3Å; R685-C689 PolarHBondContact O-SG 2.81Å; N686-C689 WeakPolarHBondContact O-CB 3.47Å; N686-C689 PolarHBondContact O-N 3.2Å; L687-C689 VanDerWaalsContact C-N 3.33Å; L687-C689 PolarHBondContact O-N 3.28Å; C689-L692 WeakPolarHBondContact O-CB 3.22Å; C689-L692 PolarHBondContact O-N 3.08Å; C689-E693 WeakPolarHBondContact O-CG 3.47Å; C689-E693 PolarHBondContact O-N 2.95Å
690	E	93.9	Very high	92.7	Very high	87 Å²	87	98.9 Å²	98.9	41%	0.407	49%	0.485	S	S	.	.	H	α-helix	trans	-62.8	-44.8	176	-170	-177.5	165.1	0	0	111.7	N686 L687 L692 E693 R694	N686-E690 PolarHBondContact O-N 3.19Å; L687-E690 WeakPolarHBondContact O-CB 3.47Å; L687-E690 PolarHBondContact O-N 2.9Å; E690-L692 VanDerWaalsContact C-N 3.31Å; E690-L692 PolarHBondContact O-N 3.24Å; E690-E693 PolarHBondContact O-N 2.78Å; E690-R694 WeakPolarHBondContact O-CG 3.44Å; E690-R694 PolarHBondContact O-N 3.1Å; E690-R694 IonicContact OE1-CZ 2.87Å; E690-R694 IonicContact OE1-NE 3.18Å; E690-R694 IonicContact OE1-NH2 2.89Å; E690-R694 PolarHBondContact OE1-NH2 3.46Å
691	D	92.8	Very high	92.6	Very high	77 Å²	77	95.1 Å²	95.1	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-61	-39.7	175.9	-77	-16.5	0	0	0	111.9	L687 R694 L695	L687-D691 PolarHBondContact O-N 3Å; D691-R694 PolarHBondContact O-N 3.45Å; D691-L695 WeakPolarHBondContact O-CG 3.39Å; D691-L695 PolarHBondContact O-N 2.87Å
692	L	93.5	Very high	92.3	Very high	104 Å²	104	95.5 Å²	95.5	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-43.6	175.3	-170.7	81.7	0	0	0	111.3	L688 C689 E690 L695 L696	L688-L692 WeakPolarHBondContact O-CB 3.33Å; L688-L692 PolarHBondContact O-N 3.41Å; C689-L692 WeakPolarHBondContact O-CB 3.22Å; C689-L692 PolarHBondContact O-N 3.08Å; E690-L692 VanDerWaalsContact C-N 3.31Å; E690-L692 PolarHBondContact O-N 3.24Å; L692-L695 PolarHBondContact O-N 3.21Å; L692-L696 HydrophobicContact CG-CD1 4.29Å; L692-L696 WeakPolarHBondContact O-CB 3.16Å; L692-L696 VanDerWaalsContact O-CG 3.3Å; L692-L696 WeakPolarHBondContact O-CG 2.95Å; L692-L696 PolarHBondContact O-N 3.23Å
693	E	92.8	Very high	91.9	Very high	130 Å²	130	97.3 Å²	97.3	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-63.2	-41.5	176.2	-73.9	-179.8	179	0	0	111.8	C689 E690 L695 L696 T697	C689-E693 WeakPolarHBondContact O-CG 3.47Å; C689-E693 PolarHBondContact O-N 2.95Å; E690-E693 PolarHBondContact O-N 2.78Å; E693-L695 PolarHBondContact O-N 3.14Å; E693-L696 PolarHBondContact O-N 2.7Å; E693-T697 WeakPolarHBondContact O-CG2 3.02Å; E693-T697 PolarHBondContact O-N 3.4Å; E693-T697 PolarHBondContact O-OG1 3.37Å
694	R	91.9	Very high	91.6	Very high	120 Å²	120	101.4 Å²	101.4	45%	0.453	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-40.6	172.7	-71	-177.3	-171.7	-165.6	9.7	112.3	E690 D691 T697 R698	E690-R694 WeakPolarHBondContact O-CG 3.44Å; E690-R694 PolarHBondContact O-N 3.1Å; E690-R694 IonicContact OE1-CZ 2.87Å; E690-R694 IonicContact OE1-NE 3.18Å; E690-R694 IonicContact OE1-NH2 2.89Å; E690-R694 PolarHBondContact OE1-NH2 3.46Å; D691-R694 PolarHBondContact O-N 3.45Å; R694-T697 WeakPolarHBondContact CA-OG1 3.26Å; R694-T697 PolarHBondContact O-OG1 2.97Å; R694-R698 WeakPolarHBondContact O-CB 3.46Å; R694-R698 PolarHBondContact O-N 3.45Å
695	L	89.7	Confident	91.2	Very high	115 Å²	115	99.2 Å²	99.2	60%	0.602	49%	0.485	S	S	*	.	H	α-helix	trans	-66.7	-40.8	175.4	-78	169.1	0	0	0	112.3	D691 L692 E693 R698 R699	D691-L695 WeakPolarHBondContact O-CG 3.39Å; D691-L695 PolarHBondContact O-N 2.87Å; L692-L695 PolarHBondContact O-N 3.21Å; E693-L695 PolarHBondContact O-N 3.14Å; L695-R698 PolarHBondContact O-N 2.85Å; L695-R699 WeakPolarHBondContact O-CB 3.28Å; L695-R699 PolarHBondContact O-N 3.25Å
696	L	89.5	Confident	90.6	Very high	75 Å²	75	100.9 Å²	100.9	39%	0.393	49%	0.491	S	S	.	.	H	α-helix	trans	-66.1	-41.9	178.4	-74.5	172.7	0	0	0	111.8	L692 E693 R699 Q700	L692-L696 HydrophobicContact CG-CD1 4.29Å; L692-L696 WeakPolarHBondContact O-CB 3.16Å; L692-L696 VanDerWaalsContact O-CG 3.3Å; L692-L696 WeakPolarHBondContact O-CG 2.95Å; L692-L696 PolarHBondContact O-N 3.23Å; E693-L696 PolarHBondContact O-N 2.7Å; L696-R699 WeakPolarHBondContact O-CB 3.38Å; L696-R699 PolarHBondContact O-N 2.92Å; L696-Q700 WeakPolarHBondContact O-CG 3.38Å; L696-Q700 PolarHBondContact O-N 2.94Å
697	T	90.2	Very high	90.3	Very high	81 Å²	81	102.1 Å²	102.1	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-64.6	-42.5	174.2	50.1	0	0	0	0	111.5	E693 R694 R699 Q700 S701	E693-T697 WeakPolarHBondContact O-CG2 3.02Å; E693-T697 PolarHBondContact O-N 3.4Å; E693-T697 PolarHBondContact O-OG1 3.37Å; R694-T697 WeakPolarHBondContact CA-OG1 3.26Å; R694-T697 PolarHBondContact O-OG1 2.97Å; T697-R699 VanDerWaalsContact C-N 3.35Å; T697-R699 PolarHBondContact O-N 3.19Å; T697-Q700 WeakPolarHBondContact O-CB 3.36Å; T697-Q700 PolarHBondContact O-N 3.41Å; T697-S701 PolarHBondContact O-N 3.33Å; T697-S701 PolarHBondContact O-OG 3.5Å
698	R	90.4	Very high	90.1	Very high	102 Å²	102	102.7 Å²	102.7	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-39	173.9	-171.1	171.6	178.2	106.8	-6.1	112.8	R694 L695 S701 L702 I777 I778	R694-R698 WeakPolarHBondContact O-CB 3.46Å; R694-R698 PolarHBondContact O-N 3.45Å; L695-R698 PolarHBondContact O-N 2.85Å; R698-S701 WeakPolarHBondContact CA-OG 3.5Å; R698-S701 PolarHBondContact O-N 3.06Å; R698-S701 PolarHBondContact O-OG 2.91Å; R698-L702 WeakPolarHBondContact O-CG 3.41Å; R698-L702 PolarHBondContact O-N 3.38Å; R698-I777 PolarHBondContact NH1-O 2.83Å; R698-I778 PolarHBondContact NH1-O 3.26Å
699	R	90.7	Very high	89.6	Confident	140 Å²	140	101 Å²	101	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-45.4	173.8	-174.9	-176.3	67.4	86.4	-2.3	110.9	L695 L696 T697 S701 L702 T703	L695-R699 WeakPolarHBondContact O-CB 3.28Å; L695-R699 PolarHBondContact O-N 3.25Å; L696-R699 WeakPolarHBondContact O-CB 3.38Å; L696-R699 PolarHBondContact O-N 2.92Å; T697-R699 VanDerWaalsContact C-N 3.35Å; T697-R699 PolarHBondContact O-N 3.19Å; R699-S701 PolarHBondContact O-N 3.41Å; R699-L702 PolarHBondContact O-N 3.44Å; R699-T703 PolarHBondContact O-N 3.24Å; R699-T703 PolarHBondContact O-OG1 3.49Å; R699-T703 VanDerWaalsContact O-OG1 3.13Å
700	Q	88.6	Confident	88.9	Confident	104 Å²	104	101 Å²	101	49%	0.486	48%	0.479	S	S	.	.	H	α-helix	trans	-62.7	-40.3	177.1	-70.9	173.2	-3.2	0	0	112.1	L696 T697 T703 K704	L696-Q700 WeakPolarHBondContact O-CG 3.38Å; L696-Q700 PolarHBondContact O-N 2.94Å; T697-Q700 WeakPolarHBondContact O-CB 3.36Å; T697-Q700 PolarHBondContact O-N 3.41Å; Q700-T703 PolarHBondContact O-N 3.37Å; Q700-K704 WeakPolarHBondContact O-CG 3.5Å; Q700-K704 PolarHBondContact O-N 2.92Å
701	S	92.4	Very high	88.4	Confident	50 Å²	50	99.4 Å²	99.4	35%	0.35	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-37.1	175.2	57	0	0	0	0	112.8	T697 R698 R699 K704 L705	T697-S701 PolarHBondContact O-N 3.33Å; T697-S701 PolarHBondContact O-OG 3.5Å; R698-S701 WeakPolarHBondContact CA-OG 3.5Å; R698-S701 PolarHBondContact O-N 3.06Å; R698-S701 PolarHBondContact O-OG 2.91Å; R699-S701 PolarHBondContact O-N 3.41Å; S701-K704 PolarHBondContact O-N 3.38Å; S701-L705 PolarHBondContact O-N 3.36Å
702	L	87.5	Confident	87.8	Confident	102 Å²	102	98.5 Å²	98.5	53%	0.534	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-38.5	174.4	-77.7	170.2	0	0	0	112.1	R698 R699 L705 R706	R698-L702 WeakPolarHBondContact O-CG 3.41Å; R698-L702 PolarHBondContact O-N 3.38Å; R699-L702 PolarHBondContact O-N 3.44Å; L702-L705 PolarHBondContact O-N 3.49Å; L702-R706 WeakPolarHBondContact O-CB 3.38Å; L702-R706 PolarHBondContact O-N 3.48Å
703	T	84.2	Confident	86.8	Confident	67 Å²	67	98.3 Å²	98.3	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-61.2	-46.1	172.6	-57.1	0	0	0	0	110.7	R699 Q700 L705 R706 E707	R699-T703 PolarHBondContact O-N 3.24Å; R699-T703 PolarHBondContact O-OG1 3.49Å; R699-T703 VanDerWaalsContact O-OG1 3.13Å; Q700-T703 PolarHBondContact O-N 3.37Å; T703-L705 VanDerWaalsContact C-N 3.33Å; T703-L705 PolarHBondContact O-N 3Å; T703-R706 WeakPolarHBondContact O-CB 3.4Å; T703-R706 PolarHBondContact O-N 2.94Å; T703-R706 VanDerWaalsContact O-N 3.17Å; T703-E707 WeakPolarHBondContact O-CG 3.27Å; T703-E707 PolarHBondContact O-N 3.32Å
704	K	90	Very high	85.9	Confident	154 Å²	154	97.9 Å²	97.9	67%	0.67	47%	0.469	S	S	*	.	H	α-helix	trans	-59.4	-41.8	175.2	-70	175.9	-178.4	179.9	0	112.5	Q700 S701 E707 F708	Q700-K704 WeakPolarHBondContact O-CG 3.5Å; Q700-K704 PolarHBondContact O-N 2.92Å; S701-K704 PolarHBondContact O-N 3.38Å; K704-E707 PolarHBondContact O-N 3.34Å; K704-F708 WeakPolarHBondContact O-CB 3.44Å; K704-F708 PolarHBondContact O-N 3.44Å
705	L	87.1	Confident	85.2	Confident	66 Å²	66	97.9 Å²	97.9	35%	0.346	47%	0.474	S	S	.	.	H	α-helix	trans	-64	-42	175.7	-173.5	111.6	0	0	0	111.5	S701 L702 T703 E707 F708 I709 V774	S701-L705 PolarHBondContact O-N 3.36Å; L702-L705 PolarHBondContact O-N 3.49Å; T703-L705 VanDerWaalsContact C-N 3.33Å; T703-L705 PolarHBondContact O-N 3Å; L705-E707 PolarHBondContact O-N 3.21Å; L705-F708 PolarHBondContact O-N 3.35Å; L705-I709 HydrophobicContact CD2-CD1 3.73Å; L705-I709 HydrophobicContact CG-CD1 4.16Å; L705-I709 WeakPolarHBondContact O-CG1 3.45Å; L705-I709 PolarHBondContact O-N 2.82Å; L705-V774 HydrophobicContact CD1-CG2 4.39Å
706	R	82.8	Confident	84.2	Confident	175 Å²	175	97.1 Å²	97.1	66%	0.66	47%	0.47	S	S	*	.	H	α-helix	trans	-59.8	-46.5	175.7	-177.1	-179	176.5	176.4	-1.5	111.1	L702 T703 F708 I709 I710	L702-R706 WeakPolarHBondContact O-CB 3.38Å; L702-R706 PolarHBondContact O-N 3.48Å; T703-R706 WeakPolarHBondContact O-CB 3.4Å; T703-R706 PolarHBondContact O-N 2.94Å; T703-R706 VanDerWaalsContact O-N 3.17Å; R706-F708 VanDerWaalsContact C-N 3.29Å; R706-F708 PolarHBondContact O-N 2.98Å; R706-I709 PolarHBondContact O-N 3.47Å; R706-I710 HydrophobicContact CG-CD1 4.05Å; R706-I710 VanDerWaalsContact O-CG1 3.29Å; R706-I710 WeakPolarHBondContact O-CG1 3.35Å; R706-I710 PolarHBondContact O-N 2.84Å
707	E	85.4	Confident	82.9	Confident	114 Å²	114	100 Å²	100	53%	0.533	48%	0.481	S	S	.	.	H	α-helix	trans	-59.9	-40.7	175	-67.7	-53.4	138.5	0	0	111.7	T703 K704 L705 I710 S711	T703-E707 WeakPolarHBondContact O-CG 3.27Å; T703-E707 PolarHBondContact O-N 3.32Å; K704-E707 PolarHBondContact O-N 3.34Å; L705-E707 PolarHBondContact O-N 3.21Å; E707-I710 PolarHBondContact O-N 2.93Å; E707-S711 PolarHBondContact O-N 3.42Å
708	F	90.1	Very high	81.7	Confident	116 Å²	116	99.8 Å²	99.8	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-67.3	-36.6	176.3	-172.2	-103	0	0	0	113.3	K704 L705 R706 S711 L712	K704-F708 WeakPolarHBondContact O-CB 3.44Å; K704-F708 PolarHBondContact O-N 3.44Å; L705-F708 PolarHBondContact O-N 3.35Å; R706-F708 VanDerWaalsContact C-N 3.29Å; R706-F708 PolarHBondContact O-N 2.98Å; F708-S711 PolarHBondContact O-N 2.87Å; F708-S711 PolarHBondContact O-OG 3.39Å; F708-L712 HydrophobicContact CD1-CD1 3.8Å; F708-L712 HydrophobicContact CD1-CG 4.29Å; F708-L712 HydrophobicContact CE1-CD1 3.39Å; F708-L712 HydrophobicContact CE1-CG 3.93Å; F708-L712 HydrophobicContact CZ-CD1 4.06Å; F708-L712 HydrophobicContact CZ-CD2 4.44Å; F708-L712 HydrophobicContact CZ-CG 4.17Å; F708-L712 WeakPolarHBondContact O-CB 3.33Å; F708-L712 WeakPolarHBondContact O-CG 3.45Å; F708-L712 PolarHBondContact O-N 3.24Å
709	I	83.1	Confident	80.3	Confident	80 Å²	80	99.9 Å²	99.9	41%	0.41	49%	0.491	S	S	.	.	H	α-helix	trans	-66.7	-42.2	173.5	-70	168.1	0	0	0	110.2	L705 R706 S711 L712 L713	L705-I709 HydrophobicContact CD2-CD1 3.73Å; L705-I709 HydrophobicContact CG-CD1 4.16Å; L705-I709 WeakPolarHBondContact O-CG1 3.45Å; L705-I709 PolarHBondContact O-N 2.82Å; R706-I709 PolarHBondContact O-N 3.47Å; I709-S711 VanDerWaalsContact C-N 3.31Å; I709-S711 PolarHBondContact O-N 3.17Å; I709-L712 PolarHBondContact O-N 2.92Å; I709-L713 HydrophobicContact CG2-CD1 3.9Å; I709-L713 HydrophobicContact CG2-CG 4.29Å; I709-L713 WeakPolarHBondContact O-CB 3.43Å; I709-L713 VanDerWaalsContact O-CG 3.28Å; I709-L713 WeakPolarHBondContact O-CG 3.45Å; I709-L713 PolarHBondContact O-N 3.45Å
710	I	80.7	Confident	78.5	Confident	63 Å²	63	96 Å²	96	32%	0.323	49%	0.485	S	S	.	.	H	α-helix	trans	-60.7	-43.6	176.2	-68.6	165.9	0	0	0	110.1	R706 E707 L713 Q714	R706-I710 HydrophobicContact CG-CD1 4.05Å; R706-I710 VanDerWaalsContact O-CG1 3.29Å; R706-I710 WeakPolarHBondContact O-CG1 3.35Å; R706-I710 PolarHBondContact O-N 2.84Å; E707-I710 PolarHBondContact O-N 2.93Å; I710-L713 PolarHBondContact O-N 2.9Å; I710-Q714 PolarHBondContact O-N 3.5Å
711	S	83.6	Confident	76.8	Confident	52 Å²	52	95.9 Å²	95.9	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-66.5	-40.1	177.9	77.4	0	0	0	0	112.6	E707 F708 I709 Q714 Q715	E707-S711 PolarHBondContact O-N 3.42Å; F708-S711 PolarHBondContact O-N 2.87Å; F708-S711 PolarHBondContact O-OG 3.39Å; I709-S711 VanDerWaalsContact C-N 3.31Å; I709-S711 PolarHBondContact O-N 3.17Å; S711-Q714 PolarHBondContact O-N 3.43Å; S711-Q715 WeakPolarHBondContact O-CB 3.49Å; S711-Q715 PolarHBondContact O-N 3.43Å
712	L	79.4	Confident	74.9	Confident	58 Å²	58	95.7 Å²	95.7	30%	0.304	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-42.6	172.7	-80.6	176.4	0	0	0	112.1	F708 I709 Q715 I716	F708-L712 HydrophobicContact CD1-CD1 3.8Å; F708-L712 HydrophobicContact CD1-CG 4.29Å; F708-L712 HydrophobicContact CE1-CD1 3.39Å; F708-L712 HydrophobicContact CE1-CG 3.93Å; F708-L712 HydrophobicContact CZ-CD1 4.06Å; F708-L712 HydrophobicContact CZ-CD2 4.44Å; F708-L712 HydrophobicContact CZ-CG 4.17Å; F708-L712 WeakPolarHBondContact O-CB 3.33Å; F708-L712 WeakPolarHBondContact O-CG 3.45Å; F708-L712 PolarHBondContact O-N 3.24Å; I709-L712 PolarHBondContact O-N 2.92Å; L712-Q715 PolarHBondContact O-N 2.85Å; L712-I716 VanDerWaalsContact O-CG1 3.31Å; L712-I716 WeakPolarHBondContact O-CG1 3.41Å; L712-I716 PolarHBondContact O-N 3.4Å
713	L	72.7	Confident	73.2	Confident	101 Å²	101	96.9 Å²	96.9	53%	0.529	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-44.1	176.4	-74.8	171	0	0	0	110.8	I709 I710 Q715 I716 Q717	I709-L713 HydrophobicContact CG2-CD1 3.9Å; I709-L713 HydrophobicContact CG2-CG 4.29Å; I709-L713 WeakPolarHBondContact O-CB 3.43Å; I709-L713 VanDerWaalsContact O-CG 3.28Å; I709-L713 WeakPolarHBondContact O-CG 3.45Å; I709-L713 PolarHBondContact O-N 3.45Å; I710-L713 PolarHBondContact O-N 2.9Å; L713-Q715 VanDerWaalsContact C-N 3.32Å; L713-Q715 PolarHBondContact O-N 2.95Å; L713-I716 PolarHBondContact O-N 3.06Å; L713-Q717 WeakPolarHBondContact O-CB 3.27Å; L713-Q717 PolarHBondContact O-N 3.22Å
714	Q	73	Confident	71.5	Confident	120 Å²	120	100.4 Å²	100.4	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-61	-40	173.2	-79.8	175.1	-17.5	0	0	112.1	I710 S711 Q717 S718	I710-Q714 PolarHBondContact O-N 3.5Å; S711-Q714 PolarHBondContact O-N 3.43Å; Q714-Q717 PolarHBondContact O-N 3.49Å; Q714-S718 WeakPolarHBondContact O-CB 3.39Å; Q714-S718 PolarHBondContact O-N 3.42Å; Q714-S718 PolarHBondContact O-OG 3.47Å
715	Q	77.4	Confident	69.5	Low	120 Å²	120	97.6 Å²	97.6	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-68.5	-40.5	178.1	-163.3	177.5	27	0	0	112.2	S711 L712 L713 S718 N719	S711-Q715 WeakPolarHBondContact O-CB 3.49Å; S711-Q715 PolarHBondContact O-N 3.43Å; L712-Q715 PolarHBondContact O-N 2.85Å; L713-Q715 VanDerWaalsContact C-N 3.32Å; L713-Q715 PolarHBondContact O-N 2.95Å; Q715-S718 PolarHBondContact O-N 3.45Å; Q715-N719 WeakPolarHBondContact O-CB 3.25Å; Q715-N719 PolarHBondContact O-N 3.29Å
716	I	68.5	Low	67.8	Low	100 Å²	100	101.1 Å²	101.1	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-43.4	174.1	-68.6	166.2	0	0	0	110	L712 L713 S718 N719 S720	L712-I716 VanDerWaalsContact O-CG1 3.31Å; L712-I716 WeakPolarHBondContact O-CG1 3.41Å; L712-I716 PolarHBondContact O-N 3.4Å; L713-I716 PolarHBondContact O-N 3.06Å; I716-S718 VanDerWaalsContact C-N 3.27Å; I716-S718 PolarHBondContact O-N 3.48Å; I716-N719 PolarHBondContact O-N 2.9Å; I716-S720 WeakPolarHBondContact O-CB 3.25Å; I716-S720 PolarHBondContact O-N 3.01Å; I716-S720 PolarHBondContact O-OG 3.3Å
717	Q	63.9	Low	65.9	Low	134 Å²	134	97 Å²	97	63%	0.626	50%	0.498	S	S	*	.	H	α-helix	trans	-62.1	-38.5	178.4	-152.7	168.6	11.1	0	0	111.1	L713 Q714 N721	L713-Q717 WeakPolarHBondContact O-CB 3.27Å; L713-Q717 PolarHBondContact O-N 3.22Å; Q714-Q717 PolarHBondContact O-N 3.49Å; Q717-N721 VanDerWaalsContact O-CG 3.32Å; Q717-N721 PolarHBondContact O-N 3.47Å; Q717-N721 PolarHBondContact O-ND2 3.47Å
718	S	63.3	Low	64.1	Low	77 Å²	77	94 Å²	94	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-66.4	-44.1	173.3	-54.2	0	0	0	0	112.6	Q714 Q715 I716 N721 A722	Q714-S718 WeakPolarHBondContact O-CB 3.39Å; Q714-S718 PolarHBondContact O-N 3.42Å; Q714-S718 PolarHBondContact O-OG 3.47Å; Q715-S718 PolarHBondContact O-N 3.45Å; I716-S718 VanDerWaalsContact C-N 3.27Å; I716-S718 PolarHBondContact O-N 3.48Å; S718-N721 PolarHBondContact O-N 3.25Å; S718-A722 PolarHBondContact O-N 3.49Å
719	N	61.5	Low	61.9	Low	104 Å²	104	94.6 Å²	94.6	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-72.7	-30.9	178.3	-95.1	-18.4	0	0	0	113.4	Q715 I716 N721 A722 H723	Q715-N719 WeakPolarHBondContact O-CB 3.25Å; Q715-N719 PolarHBondContact O-N 3.29Å; I716-N719 PolarHBondContact O-N 2.9Å; N719-N721 VanDerWaalsContact C-N 3.27Å; N719-N721 PolarHBondContact O-N 3.22Å; N719-A722 CarbonylContact O-C 3.6Å; N719-A722 PolarHBondContact O-N 3.33Å; N719-A722 VanDerWaalsContact O-N 3.1Å; N719-H723 PolarHBondContact O-N 3.48Å
720	S	53.3	Low	60	Low	59 Å²	59	95 Å²	95	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-43.1	174.6	-55.1	0	0	0	0	109.6	I716 A722 H723 F724	I716-S720 WeakPolarHBondContact O-CB 3.25Å; I716-S720 PolarHBondContact O-N 3.01Å; I716-S720 PolarHBondContact O-OG 3.3Å; S720-A722 VanDerWaalsContact C-N 3.31Å; S720-A722 PolarHBondContact O-N 3.11Å; S720-H723 PolarHBondContact O-N 3.5Å; S720-F724 WeakPolarHBondContact O-CB 3.37Å; S720-F724 PolarHBondContact O-N 3.26Å
721	N	52.9	Low	58.2	Low	102 Å²	102	98.9 Å²	98.9	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-38.7	173.6	-64.2	-16.7	0	0	0	111.3	Q717 S718 N719 N725	Q717-N721 VanDerWaalsContact O-CG 3.32Å; Q717-N721 PolarHBondContact O-N 3.47Å; Q717-N721 PolarHBondContact O-ND2 3.47Å; S718-N721 PolarHBondContact O-N 3.25Å; N719-N721 VanDerWaalsContact C-N 3.27Å; N719-N721 PolarHBondContact O-N 3.22Å; N721-N725 VanDerWaalsContact O-CB 3.23Å; N721-N725 WeakPolarHBondContact O-CB 3.49Å; N721-N725 PolarHBondContact O-N 3.39Å; N721-N725 PolarHBondContact O-ND2 2.99Å; N721-N725 VanDerWaalsContact O-ND2 3.16Å; N721-N725 PolarHBondContact O-OD1 3.44Å
722	A	53.1	Low	56.3	Low	45 Å²	45	102.4 Å²	102.4	37%	0.372	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-40.5	177	0	0	0	0	0	113.7	S718 N719 S720 N725 K726	S718-A722 PolarHBondContact O-N 3.49Å; N719-A722 CarbonylContact O-C 3.6Å; N719-A722 PolarHBondContact O-N 3.33Å; N719-A722 VanDerWaalsContact O-N 3.1Å; S720-A722 VanDerWaalsContact C-N 3.31Å; S720-A722 PolarHBondContact O-N 3.11Å; A722-N725 PolarHBondContact O-N 3.35Å; A722-K726 WeakPolarHBondContact O-CB 3.19Å; A722-K726 PolarHBondContact O-N 3.36Å
723	H	52.1	Low	54.5	Low	128 Å²	128	105.6 Å²	105.6	59%	0.593	55%	0.55	S	S	*	*	H	α-helix	trans	-74	-36.8	177.8	-164.9	-76.6	0	0	0	111.3	N719 S720 N725 K726 L727	N719-H723 PolarHBondContact O-N 3.48Å; S720-H723 PolarHBondContact O-N 3.5Å; H723-N725 VanDerWaalsContact C-N 3.32Å; H723-K726 PolarHBondContact O-N 3Å; H723-L727 VanDerWaalsContact O-CB 3.3Å; H723-L727 WeakPolarHBondContact O-CB 3.38Å; H723-L727 PolarHBondContact O-N 3.48Å
724	F	47.2	Very low	52.9	Low	140 Å²	140	107.5 Å²	107.5	61%	0.614	56%	0.561	S	S	*	*	H	α-helix	trans	-60.9	-44.6	170.4	-166.1	-93.5	0	0	0	110.2	S720 K726 L727 C728	S720-F724 WeakPolarHBondContact O-CB 3.37Å; S720-F724 PolarHBondContact O-N 3.26Å; F724-K726 PolarHBondContact O-N 3.24Å; F724-L727 PolarHBondContact O-N 2.92Å; F724-C728 WeakPolarHBondContact O-CB 3.32Å; F724-C728 PolarHBondContact O-N 3.41Å; F724-C728 PolarHBondContact O-SG 2.86Å
725	N	49.2	Very low	50.9	Low	95 Å²	95	110.1 Å²	110.1	51%	0.508	57%	0.571	S	S	.	*	H	α-helix	trans	-63.5	-39.8	174.4	-72	-14.6	0	0	0	112.9	N721 A722 H723 C728 Q729	N721-N725 VanDerWaalsContact O-CB 3.23Å; N721-N725 WeakPolarHBondContact O-CB 3.49Å; N721-N725 PolarHBondContact O-N 3.39Å; N721-N725 PolarHBondContact O-ND2 2.99Å; N721-N725 VanDerWaalsContact O-ND2 3.16Å; N721-N725 PolarHBondContact O-OD1 3.44Å; A722-N725 PolarHBondContact O-N 3.35Å; H723-N725 VanDerWaalsContact C-N 3.32Å; N725-C728 PolarHBondContact O-N 3.46Å; N725-Q729 WeakPolarHBondContact O-CG 3.18Å; N725-Q729 PolarHBondContact O-N 3.23Å
726	K	50.2	Low	48.9	Very low	141 Å²	141	111.2 Å²	111.2	61%	0.613	58%	0.581	S	S	*	*	H	α-helix	trans	-69.5	-36.7	174.7	-88.2	-175.7	176.1	178.6	0	112.9	A722 H723 F724 C728 Q729 C730	A722-K726 WeakPolarHBondContact O-CB 3.19Å; A722-K726 PolarHBondContact O-N 3.36Å; H723-K726 PolarHBondContact O-N 3Å; F724-K726 PolarHBondContact O-N 3.24Å; K726-C728 VanDerWaalsContact C-N 3.34Å; K726-Q729 PolarHBondContact O-N 2.84Å; K726-C730 PolarHBondContact O-N 3.27Å; K726-C730 PolarHBondContact O-SG 2.81Å; K726-C730 VanDerWaalsContact O-SG 3.38Å
727	L	42.5	Very low	47.2	Very low	89 Å²	89	114.9 Å²	114.9	47%	0.466	59%	0.593	S	S	.	*	H	α-helix	trans	-64.8	-42.8	175.5	-156.1	83.7	0	0	0	110	H723 F724 Q729 C730 Q731	H723-L727 VanDerWaalsContact O-CB 3.3Å; H723-L727 WeakPolarHBondContact O-CB 3.38Å; H723-L727 PolarHBondContact O-N 3.48Å; F724-L727 PolarHBondContact O-N 2.92Å; L727-Q729 VanDerWaalsContact C-N 3.32Å; L727-Q729 PolarHBondContact O-N 2.83Å; L727-C730 PolarHBondContact O-N 2.98Å; L727-Q731 PolarHBondContact O-N 2.92Å
728	C	47.5	Very low	45.9	Very low	49 Å²	49	116 Å²	116	33%	0.331	60%	0.603	S	S	.	*	H	α-helix	trans	-62.3	-37.4	171.7	-70	0	0	0	0	112.2	F724 N725 K726 N732	F724-C728 WeakPolarHBondContact O-CB 3.32Å; F724-C728 PolarHBondContact O-N 3.41Å; F724-C728 PolarHBondContact O-SG 2.86Å; N725-C728 PolarHBondContact O-N 3.46Å; K726-C728 VanDerWaalsContact C-N 3.34Å; C728-N732 WeakPolarHBondContact O-CB 3.4Å; C728-N732 PolarHBondContact O-N 2.75Å; C728-N732 VanDerWaalsContact O-N 3.12Å
729	Q	44.8	Very low	44.4	Very low	129 Å²	129	117.9 Å²	117.9	60%	0.603	61%	0.608	S	S	*	*	H	α-helix	trans	-70.9	-36.4	175.1	-77.8	177.3	-0.5	0	0	113.2	N725 K726 L727 N732 N733	N725-Q729 WeakPolarHBondContact O-CG 3.18Å; N725-Q729 PolarHBondContact O-N 3.23Å; K726-Q729 PolarHBondContact O-N 2.84Å; L727-Q729 VanDerWaalsContact C-N 3.32Å; L727-Q729 PolarHBondContact O-N 2.83Å; Q729-N732 PolarHBondContact O-N 3.43Å; Q729-N733 PolarHBondContact O-N 2.89Å
730	C	43.3	Very low	43.3	Very low	88 Å²	88	120.2 Å²	120.2	60%	0.595	62%	0.62	S	S	*	*	H	α-helix	trans	-72.4	-30.1	176	-70.5	0	0	0	0	112.5	K726 L727 N732	K726-C730 PolarHBondContact O-N 3.27Å; K726-C730 PolarHBondContact O-SG 2.81Å; K726-C730 VanDerWaalsContact O-SG 3.38Å; L727-C730 PolarHBondContact O-N 2.98Å; C730-N732 VanDerWaalsContact C-N 3.34Å
731	Q	43.7	Very low	42.6	Very low	145 Å²	145	124 Å²	124	68%	0.678	64%	0.636	S	S	*	*	H	α-helix	trans	-74.8	-24.1	172.1	-77.8	176.8	-49	0	0	112.9	L727	L727-Q731 PolarHBondContact O-N 2.92Å
732	N	42.7	Very low	41.9	Very low	127 Å²	127	126.7 Å²	126.7	68%	0.679	65%	0.648	S	S	*	*	H	α-helix	trans	-83.7	-7.5	176.5	-79.2	-1	0	0	0	114.3	C728 Q729 C730 N734	C728-N732 WeakPolarHBondContact O-CB 3.4Å; C728-N732 PolarHBondContact O-N 2.75Å; C728-N732 VanDerWaalsContact O-N 3.12Å; Q729-N732 PolarHBondContact O-N 3.43Å; C730-N732 VanDerWaalsContact C-N 3.34Å; N732-N734 VanDerWaalsContact C-N 3.3Å; N732-N734 PolarHBondContact O-N 3.35Å; N732-N734 VanDerWaalsContact O-N 3.09Å
733	N	40.9	Very low	41.5	Very low	124 Å²	124	129.9 Å²	129.9	66%	0.663	66%	0.659	S	S	*	*	S	Bend	trans	-84.5	81.8	168.2	-73.8	-13.1	0	0	0	109.4	Q729 F735	Q729-N733 PolarHBondContact O-N 2.89Å; N733-F735 PolarHBondContact O-N 2.75Å; N733-F735 VanDerWaalsContact O-N 3.09Å
734	N	40.1	Very low	41	Very low	141 Å²	141	129 Å²	129	75%	0.754	66%	0.659	S	S	*	*			trans	7.7	87.1	159.1	-74.2	-16.6	0	0	0	115.7	N732 N736	N732-N734 VanDerWaalsContact C-N 3.3Å; N732-N734 PolarHBondContact O-N 3.35Å; N732-N734 VanDerWaalsContact O-N 3.09Å; N734-N736 PolarHBondContact O-N 3.13Å; N734-N736 VanDerWaalsContact O-N 3.08Å
735	F	31.3	Very low	41.1	Very low	176 Å²	176	125.5 Å²	125.5	77%	0.772	65%	0.651	S	S	*	*			trans	-72.3	87.4	150	-96.6	-88.3	0	0	0	107.7	N733 F737	N733-F735 PolarHBondContact O-N 2.75Å; N733-F735 VanDerWaalsContact O-N 3.09Å; F735-F737 PolarHBondContact O-N 2.85Å
736	N	35.3	Very low	40.9	Very low	142 Å²	142	125.9 Å²	125.9	76%	0.759	65%	0.653	S	S	*	*			trans	-64.4	103	160.5	-92.7	-10.4	0	0	0	107.5	N734 N738	N734-N736 PolarHBondContact O-N 3.13Å; N734-N736 VanDerWaalsContact O-N 3.08Å; N736-N738 PolarHBondContact O-N 3.47Å
737	F	32.3	Very low	40.5	Very low	178 Å²	178	124.3 Å²	124.3	78%	0.781	65%	0.651	S	S	*	*			trans	-58	100	159.5	-104.6	-96.3	0	0	0	107.6	F735	F735-F737 PolarHBondContact O-N 2.85Å
738	N	36.2	Very low	40.5	Very low	157 Å²	157	124.3 Å²	124.3	84%	0.84	65%	0.651	S	S	*	*			trans	-110.4	102.1	157.9	-136.3	12.5	0	0	0	105.7	N736	N736-N738 PolarHBondContact O-N 3.47Å
739	D	32.4	Very low	40.4	Very low	117 Å²	117	128.6 Å²	128.6	63%	0.626	66%	0.664	S	S	*	*			trans	-54.3	149	175.1	-71.9	-48.5	0	0	0	110.7
740	N	38.5	Very low	40.2	Very low	153 Å²	153	128.5 Å²	128.5	82%	0.818	67%	0.667	S	S	*	*	S	Bend	trans	95.1	47.4	170	-43.1	-41.5	0	0	0	117.7
741	N	38.1	Very low	40.3	Very low	139 Å²	139	128.4 Å²	128.4	74%	0.743	66%	0.66	S	S	*	*				-161.8	111.8	127.9	-115.8	-13.8	0	0	0	109.6	D743	N741-D743 PolarHBondContact O-N 3.29Å
742	I	39	Very low	40.3	Very low	158 Å²	158	126.7 Å²	126.7	81%	0.81	66%	0.655	S	S	*	*			trans	-70.9	70.2	171.1	-58.9	166.6	0	0	0	106.5	N744	I742-N744 PolarHBondContact O-N 2.94Å; I742-N744 VanDerWaalsContact O-N 3.16Å
743	D	43.5	Very low	40.3	Very low	112 Å²	112	124.4 Å²	124.4	60%	0.599	65%	0.649	S	S	*	*			trans	-76.5	105.1	171.1	-101.7	-24.5	0	0	0	106.8	N741 S745 L746	N741-D743 PolarHBondContact O-N 3.29Å; D743-S745 PolarHBondContact O-N 2.86Å; D743-L746 PolarHBondContact O-N 3.46Å
744	N	41.7	Very low	40.3	Very low	110 Å²	110	124.7 Å²	124.7	59%	0.588	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	2.1	171	-72.6	-50.2	0	0	0	114.6	I742 N748	I742-N744 PolarHBondContact O-N 2.94Å; I742-N744 VanDerWaalsContact O-N 3.16Å; N744-N748 WeakPolarHBondContact O-CB 3.41Å; N744-N748 PolarHBondContact O-N 3.27Å; N744-N748 PolarHBondContact O-ND2 3.44Å
745	S	49.8	Very low	40.2	Very low	65 Å²	65	122.3 Å²	122.3	46%	0.455	64%	0.638	S	S	.	*	H	α-helix	trans	-64.2	-38.7	168.1	171	0	0	0	0	113.5	D743 N748 K749	D743-S745 PolarHBondContact O-N 2.86Å; S745-N748 CarbonylContact O-C 3.58Å; S745-N748 PolarHBondContact O-N 3.02Å; S745-K749 PolarHBondContact O-N 2.79Å
746	L	45.1	Very low	40.6	Very low	104 Å²	104	118.4 Å²	118.4	55%	0.545	63%	0.625	S	S	.	*	H	α-helix	trans	-76.6	-37.1	-178.3	-76.1	178.3	0	0	0	112.9	D743 N748 K749 L750	D743-L746 PolarHBondContact O-N 3.46Å; L746-N748 VanDerWaalsContact C-N 3.27Å; L746-N748 PolarHBondContact O-N 3.26Å; L746-K749 PolarHBondContact O-N 2.82Å; L746-K749 VanDerWaalsContact O-N 3.14Å; L746-L750 PolarHBondContact O-N 3.19Å
747	L	41.7	Very low	41	Very low	107 Å²	107	115.3 Å²	115.3	56%	0.56	61%	0.611	S	S	*	*	H	α-helix	trans	-63.2	-39.4	171	-169.1	66	0	0	0	110.2	L750 I751	L747-L750 PolarHBondContact O-N 3.37Å; L747-I751 HydrophobicContact CG-CD1 4.08Å; L747-I751 WeakPolarHBondContact O-CB 3.42Å; L747-I751 VanDerWaalsContact O-CG1 3.23Å; L747-I751 WeakPolarHBondContact O-CG1 3.43Å; L747-I751 PolarHBondContact O-N 3.4Å
748	N	42.1	Very low	41.6	Very low	90 Å²	90	112 Å²	112	48%	0.481	60%	0.601	S	S	.	*	H	α-helix	trans	-67	-33.5	171.9	-81.8	-23.1	0	0	0	113.1	N744 S745 L746 I751 L752	N744-N748 WeakPolarHBondContact O-CB 3.41Å; N744-N748 PolarHBondContact O-N 3.27Å; N744-N748 PolarHBondContact O-ND2 3.44Å; S745-N748 CarbonylContact O-C 3.58Å; S745-N748 PolarHBondContact O-N 3.02Å; L746-N748 VanDerWaalsContact C-N 3.27Å; L746-N748 PolarHBondContact O-N 3.26Å; N748-I751 PolarHBondContact O-N 2.8Å; N748-L752 WeakPolarHBondContact O-CB 3.32Å; N748-L752 VanDerWaalsContact O-CD1 3.31Å; N748-L752 WeakPolarHBondContact O-CD1 3.34Å; N748-L752 VanDerWaalsContact O-CG 3.25Å; N748-L752 WeakPolarHBondContact O-CG 3.42Å; N748-L752 PolarHBondContact O-N 3.27Å
749	K	45.3	Very low	41.9	Very low	138 Å²	138	109.1 Å²	109.1	60%	0.6	59%	0.586	S	S	*	*	H	α-helix	trans	-71.2	-32	172.8	-91.7	-178.6	177.1	176.1	0	113	S745 L746 S753	S745-K749 PolarHBondContact O-N 2.79Å; L746-K749 PolarHBondContact O-N 2.82Å; L746-K749 VanDerWaalsContact O-N 3.14Å; K749-S753 WeakPolarHBondContact O-CB 3.36Å; K749-S753 PolarHBondContact O-N 2.73Å
750	L	42.3	Very low	42.3	Very low	128 Å²	128	108.4 Å²	108.4	67%	0.67	58%	0.583	S	S	*	*	H	α-helix	trans	-70.2	-40.1	171.2	-106	142.1	0	0	0	111.1	L746 L747 S753 N754	L746-L750 PolarHBondContact O-N 3.19Å; L747-L750 PolarHBondContact O-N 3.37Å; L750-S753 PolarHBondContact O-N 3.07Å; L750-N754 WeakPolarHBondContact O-CB 3.4Å; L750-N754 PolarHBondContact O-N 3.46Å
751	I	44.8	Very low	42.6	Very low	85 Å²	85	105.6 Å²	105.6	44%	0.436	57%	0.567	S	S	.	*	H	α-helix	trans	-69	-37.7	173.9	-65.5	167.3	0	0	0	111	L747 N748 N754 N755	L747-I751 HydrophobicContact CG-CD1 4.08Å; L747-I751 WeakPolarHBondContact O-CB 3.42Å; L747-I751 VanDerWaalsContact O-CG1 3.23Å; L747-I751 WeakPolarHBondContact O-CG1 3.43Å; L747-I751 PolarHBondContact O-N 3.4Å; N748-I751 PolarHBondContact O-N 2.8Å; I751-N754 CarbonylContact O-C 3.28Å; I751-N754 WeakPolarHBondContact O-CB 3.34Å; I751-N754 PolarHBondContact O-N 2.94Å; I751-N755 PolarHBondContact O-N 2.87Å
752	L	44	Very low	43	Very low	109 Å²	109	103.3 Å²	103.3	57%	0.571	55%	0.554	S	S	*	*	H	α-helix	trans	-72.8	-32.7	175.2	-79.6	155.1	0	0	0	112.3	N748 N754 N755	N748-L752 WeakPolarHBondContact O-CB 3.32Å; N748-L752 VanDerWaalsContact O-CD1 3.31Å; N748-L752 WeakPolarHBondContact O-CD1 3.34Å; N748-L752 VanDerWaalsContact O-CG 3.25Å; N748-L752 WeakPolarHBondContact O-CG 3.42Å; N748-L752 PolarHBondContact O-N 3.27Å; L752-N754 VanDerWaalsContact C-N 3.26Å; L752-N755 WeakPolarHBondContact O-CA 3.41Å; L752-N755 WeakPolarHBondContact O-CB 3.47Å; L752-N755 PolarHBondContact O-N 3.49Å
753	S	42.7	Very low	43.5	Very low	80 Å²	80	100 Å²	100	56%	0.559	54%	0.538	S	S	*	.	H	α-helix	trans	-68.3	-31.1	170.1	-166.3	0	0	0	0	110.9	K749 L750 N755 N756	K749-S753 WeakPolarHBondContact O-CB 3.36Å; K749-S753 PolarHBondContact O-N 2.73Å; L750-S753 PolarHBondContact O-N 3.07Å; S753-N755 PolarHBondContact O-N 3.01Å; S753-N756 PolarHBondContact O-N 3.02Å
754	N	39.2	Very low	43.7	Very low	130 Å²	130	99.3 Å²	99.3	70%	0.695	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.6	170.1	-136.6	17.2	0	0	0	113.4	L750 I751 L752 N756	L750-N754 WeakPolarHBondContact O-CB 3.4Å; L750-N754 PolarHBondContact O-N 3.46Å; I751-N754 CarbonylContact O-C 3.28Å; I751-N754 WeakPolarHBondContact O-CB 3.34Å; I751-N754 PolarHBondContact O-N 2.94Å; L752-N754 VanDerWaalsContact C-N 3.26Å; N754-N756 VanDerWaalsContact C-N 3.26Å
755	N	39.8	Very low	44.3	Very low	91 Å²	91	98.8 Å²	98.8	49%	0.487	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	11.5	168.7	-69.6	-22.4	0	0	0	113.2	I751 L752 S753 T757	I751-N755 PolarHBondContact O-N 2.87Å; L752-N755 WeakPolarHBondContact O-CA 3.41Å; L752-N755 WeakPolarHBondContact O-CB 3.47Å; L752-N755 PolarHBondContact O-N 3.49Å; S753-N755 PolarHBondContact O-N 3.01Å; N755-T757 PolarHBondContact O-N 3.2Å; N755-T757 PolarHBondContact O-OG1 3.02Å
756	N	39.6	Very low	44.4	Very low	93 Å²	93	103.7 Å²	103.7	50%	0.497	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	39.5	155	-82.9	-30.2	0	0	0	111.7	S753 N754 N758 N759	S753-N756 PolarHBondContact O-N 3.02Å; N754-N756 VanDerWaalsContact C-N 3.26Å; N756-N758 PolarHBondContact O-N 3.43Å; N756-N759 PolarHBondContact O-N 2.92Å
757	T	43.1	Very low	44.8	Very low	77 Å²	77	103.4 Å²	103.4	47%	0.472	54%	0.538	S	S	.	.	H	α-helix	trans	-51.6	-22.2	164	31.8	0	0	0	0	111.4	N755 N760 L761	N755-T757 PolarHBondContact O-N 3.2Å; N755-T757 PolarHBondContact O-OG1 3.02Å; T757-N760 PolarHBondContact O-N 3.49Å; T757-L761 VanDerWaalsContact O-CB 3.29Å; T757-L761 WeakPolarHBondContact O-CB 3.27Å; T757-L761 PolarHBondContact O-N 3.04Å
758	N	43.6	Very low	45.7	Very low	108 Å²	108	101.8 Å²	101.8	58%	0.578	54%	0.535	S	S	*	.	H	α-helix	trans	-64.4	-37.2	172.9	-75.5	-12.2	0	0	0	114.1	N756 L761 I762	N756-N758 PolarHBondContact O-N 3.43Å; N758-L761 PolarHBondContact O-N 3.45Å; N758-I762 WeakPolarHBondContact O-CD1 3.43Å; N758-I762 WeakPolarHBondContact O-CG1 3.19Å; N758-I762 PolarHBondContact O-N 3.44Å
759	N	42.9	Very low	46.8	Very low	98 Å²	98	102.4 Å²	102.4	52%	0.524	54%	0.538	S	S	.	.	H	α-helix	trans	-74.3	-35.5	178.3	-78.6	-13	0	0	0	111.7	N756 I762 N763	N756-N759 PolarHBondContact O-N 2.92Å; N759-I762 PolarHBondContact O-N 2.73Å; N759-N763 PolarHBondContact O-N 3.44Å
760	N	41.8	Very low	47.5	Very low	102 Å²	102	99.6 Å²	99.6	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-70.8	-31.9	170.7	-77.3	-15.5	0	0	0	111.9	T757 N763 N764	T757-N760 PolarHBondContact O-N 3.49Å; N760-N763 PolarHBondContact O-N 2.85Å; N760-N764 WeakPolarHBondContact O-CB 3.46Å; N760-N764 PolarHBondContact O-N 3.06Å; N760-N764 PolarHBondContact O-ND2 3.37Å
761	L	43.5	Very low	48.4	Very low	94 Å²	94	99.8 Å²	99.8	49%	0.492	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-39.8	171.5	-126.6	82.3	0	0	0	111.1	T757 N758 N764 N765	T757-L761 VanDerWaalsContact O-CB 3.29Å; T757-L761 WeakPolarHBondContact O-CB 3.27Å; T757-L761 PolarHBondContact O-N 3.04Å; N758-L761 PolarHBondContact O-N 3.45Å; L761-N764 PolarHBondContact O-N 3.44Å; L761-N765 WeakPolarHBondContact O-CA 3.47Å; L761-N765 WeakPolarHBondContact O-CB 3.5Å; L761-N765 PolarHBondContact O-N 2.97Å; L761-N765 PolarHBondContact O-ND2 2.86Å
762	I	48.4	Very low	49.3	Very low	90 Å²	90	100.4 Å²	100.4	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-43.3	176.1	-68.8	163	0	0	0	110	N758 N759 N765 R766	N758-I762 WeakPolarHBondContact O-CD1 3.43Å; N758-I762 WeakPolarHBondContact O-CG1 3.19Å; N758-I762 PolarHBondContact O-N 3.44Å; N759-I762 PolarHBondContact O-N 2.73Å; I762-N765 PolarHBondContact O-N 3.49Å; I762-R766 WeakPolarHBondContact O-CB 3.42Å; I762-R766 VanDerWaalsContact O-CG 3.27Å; I762-R766 WeakPolarHBondContact O-CG 3.24Å; I762-R766 PolarHBondContact O-N 2.86Å
763	N	47.5	Very low	50.1	Low	89 Å²	89	100.7 Å²	100.7	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-41.3	176	-83.7	-12.7	0	0	0	112.5	N759 N760 R766 I767	N759-N763 PolarHBondContact O-N 3.44Å; N760-N763 PolarHBondContact O-N 2.85Å; N763-R766 PolarHBondContact O-N 3.24Å; N763-I767 WeakPolarHBondContact O-CB 3.48Å; N763-I767 VanDerWaalsContact O-CG1 3.26Å; N763-I767 WeakPolarHBondContact O-CG1 3.44Å; N763-I767 PolarHBondContact O-N 3.47Å
764	N	49.1	Very low	51.1	Low	98 Å²	98	99.2 Å²	99.2	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-67.9	-36.3	175.7	-72.9	-14.5	0	0	0	111.8	N760 L761 I767 S768	N760-N764 WeakPolarHBondContact O-CB 3.46Å; N760-N764 PolarHBondContact O-N 3.06Å; N760-N764 PolarHBondContact O-ND2 3.37Å; L761-N764 PolarHBondContact O-N 3.44Å; N764-I767 PolarHBondContact O-N 3.39Å; N764-S768 WeakPolarHBondContact O-CB 3.37Å; N764-S768 PolarHBondContact O-N 3.4Å
765	N	54.6	Low	52.4	Low	98 Å²	98	99.3 Å²	99.3	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-39.4	172.6	-75.3	-16.9	0	0	0	110.7	L761 I762 S768 N769	L761-N765 WeakPolarHBondContact O-CA 3.47Å; L761-N765 WeakPolarHBondContact O-CB 3.5Å; L761-N765 PolarHBondContact O-N 2.97Å; L761-N765 PolarHBondContact O-ND2 2.86Å; I762-N765 PolarHBondContact O-N 3.49Å; N765-S768 PolarHBondContact O-N 3.13Å; N765-N769 WeakPolarHBondContact O-CB 3.49Å; N765-N769 PolarHBondContact O-N 2.93Å
766	R	51.8	Low	53.6	Low	169 Å²	169	99.2 Å²	99.2	64%	0.638	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-45	173.3	-74.7	178.2	82.5	146.3	5	111.3	I762 N763 N769 I770	I762-R766 WeakPolarHBondContact O-CB 3.42Å; I762-R766 VanDerWaalsContact O-CG 3.27Å; I762-R766 WeakPolarHBondContact O-CG 3.24Å; I762-R766 PolarHBondContact O-N 2.86Å; N763-R766 PolarHBondContact O-N 3.24Å; R766-N769 PolarHBondContact O-N 2.95Å; R766-I770 WeakPolarHBondContact O-CB 3.48Å; R766-I770 WeakPolarHBondContact O-CD1 3.44Å; R766-I770 WeakPolarHBondContact O-CG1 3.29Å; R766-I770 PolarHBondContact O-N 3.29Å
767	I	52.5	Low	54.7	Low	98 Å²	98	99.2 Å²	99.2	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-44	176.7	-69	164.5	0	0	0	110.6	N763 N764 N769 I770 H771	N763-I767 WeakPolarHBondContact O-CB 3.48Å; N763-I767 VanDerWaalsContact O-CG1 3.26Å; N763-I767 WeakPolarHBondContact O-CG1 3.44Å; N763-I767 PolarHBondContact O-N 3.47Å; N764-I767 PolarHBondContact O-N 3.39Å; I767-N769 PolarHBondContact O-N 3.24Å; I767-I770 PolarHBondContact O-N 3.4Å; I767-H771 WeakPolarHBondContact O-CB 3.47Å; I767-H771 PolarHBondContact O-N 2.77Å
768	S	61.4	Low	55.6	Low	72 Å²	72	100.4 Å²	100.4	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-65.8	-38	177.7	-166.7	0	0	0	0	111.8	N764 N765 H771 Q772	N764-S768 WeakPolarHBondContact O-CB 3.37Å; N764-S768 PolarHBondContact O-N 3.4Å; N765-S768 PolarHBondContact O-N 3.13Å; S768-H771 PolarHBondContact O-N 2.65Å; S768-Q772 WeakPolarHBondContact O-CB 3.14Å; S768-Q772 PolarHBondContact O-N 2.88Å
769	N	64.7	Low	56.1	Low	103 Å²	103	104 Å²	104	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-71.2	-35.8	176.9	-151.3	-8.9	0	0	0	111.1	N765 R766 I767 Q772 Q773	N765-N769 WeakPolarHBondContact O-CB 3.49Å; N765-N769 PolarHBondContact O-N 2.93Å; R766-N769 PolarHBondContact O-N 2.95Å; I767-N769 PolarHBondContact O-N 3.24Å; N769-Q772 PolarHBondContact O-N 3.11Å; N769-Q773 WeakPolarHBondContact O-CB 3.31Å; N769-Q773 WeakPolarHBondContact O-CG 3.4Å; N769-Q773 PolarHBondContact O-N 3.41Å
770	I	60.5	Low	56.1	Low	80 Å²	80	103.2 Å²	103.2	41%	0.41	51%	0.514	S	S	.	.	H	α-helix	trans	-65.2	-44.2	170.4	-69.2	162.4	0	0	0	110.4	R766 I767 Q772 Q773 V774	R766-I770 WeakPolarHBondContact O-CB 3.48Å; R766-I770 WeakPolarHBondContact O-CD1 3.44Å; R766-I770 WeakPolarHBondContact O-CG1 3.29Å; R766-I770 PolarHBondContact O-N 3.29Å; I767-I770 PolarHBondContact O-N 3.4Å; I770-Q772 VanDerWaalsContact C-N 3.3Å; I770-Q772 PolarHBondContact O-N 3.45Å; I770-Q773 PolarHBondContact O-N 2.97Å; I770-V774 HydrophobicContact CG2-CG2 4.39Å; I770-V774 WeakPolarHBondContact O-CB 3.4Å; I770-V774 VanDerWaalsContact O-CG2 3.25Å; I770-V774 WeakPolarHBondContact O-CG2 3.49Å; I770-V774 PolarHBondContact O-N 3.49Å
771	H	60.3	Low	56.2	Low	132 Å²	132	106 Å²	106	61%	0.611	54%	0.537	S	S	*	.	H	α-helix	trans	-63.1	-39	177.3	-119.6	-49.4	0	0	0	111.6	I767 S768 V774 Y775	I767-H771 WeakPolarHBondContact O-CB 3.47Å; I767-H771 PolarHBondContact O-N 2.77Å; S768-H771 PolarHBondContact O-N 2.65Å; H771-V774 PolarHBondContact O-N 3.01Å; H771-Y775 VanDerWaalsContact O-CB 3.29Å; H771-Y775 WeakPolarHBondContact O-CB 3.2Å; H771-Y775 PolarHBondContact O-N 3.36Å
772	Q	64.7	Low	56.9	Low	97 Å²	97	106.6 Å²	106.6	45%	0.453	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-45.7	175.4	-162.6	64.1	39.4	0	0	111.4	S768 N769 I770 V774 Y775 D776	S768-Q772 WeakPolarHBondContact O-CB 3.14Å; S768-Q772 PolarHBondContact O-N 2.88Å; N769-Q772 PolarHBondContact O-N 3.11Å; I770-Q772 VanDerWaalsContact C-N 3.3Å; I770-Q772 PolarHBondContact O-N 3.45Å; Q772-V774 VanDerWaalsContact C-N 3.33Å; Q772-V774 PolarHBondContact O-N 3.38Å; Q772-Y775 PolarHBondContact O-N 3.24Å; Q772-Y775 VanDerWaalsContact O-N 3.13Å; Q772-D776 PolarHBondContact NE2-OD1 3.47Å; Q772-D776 WeakPolarHBondContact O-CB 3.35Å; Q772-D776 PolarHBondContact O-N 2.68Å
773	Q	61.3	Low	57.3	Low	116 Å²	116	107.4 Å²	107.4	54%	0.542	54%	0.543	S	S	.	.	H	α-helix	trans	-59.5	-42.2	174.2	-79.3	-179.8	-6.5	0	0	112.3	N769 I770 D776 I777	N769-Q773 WeakPolarHBondContact O-CB 3.31Å; N769-Q773 WeakPolarHBondContact O-CG 3.4Å; N769-Q773 PolarHBondContact O-N 3.41Å; I770-Q773 PolarHBondContact O-N 2.97Å; Q773-D776 PolarHBondContact O-N 2.83Å; Q773-I777 WeakPolarHBondContact O-CB 3.15Å; Q773-I777 WeakPolarHBondContact O-CD1 3.47Å; Q773-I777 WeakPolarHBondContact O-CG1 3.46Å; Q773-I777 PolarHBondContact O-N 2.78Å
774	V	62.6	Low	57.8	Low	48 Å²	48	108.4 Å²	108.4	29%	0.291	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-42.4	175.1	170.5	0	0	0	0	110.6	L705 I770 H771 Q772 I777 I778	L705-V774 HydrophobicContact CD1-CG2 4.39Å; I770-V774 HydrophobicContact CG2-CG2 4.39Å; I770-V774 WeakPolarHBondContact O-CB 3.4Å; I770-V774 VanDerWaalsContact O-CG2 3.25Å; I770-V774 WeakPolarHBondContact O-CG2 3.49Å; I770-V774 PolarHBondContact O-N 3.49Å; H771-V774 PolarHBondContact O-N 3.01Å; Q772-V774 VanDerWaalsContact C-N 3.33Å; Q772-V774 PolarHBondContact O-N 3.38Å; V774-I777 PolarHBondContact O-N 2.88Å; V774-I778 HydrophobicContact CG1-CD1 3.75Å; V774-I778 WeakPolarHBondContact O-CB 3.46Å; V774-I778 WeakPolarHBondContact O-CD1 3.47Å; V774-I778 WeakPolarHBondContact O-CG1 3.34Å; V774-I778 PolarHBondContact O-N 2.81Å
775	Y	66.2	Low	58.4	Low	133 Å²	133	109.1 Å²	109.1	52%	0.522	55%	0.548	S	S	.	.	H	α-helix	trans	-65.5	-40.6	178.6	-158.8	-90.3	0	0	0	112	H771 Q772 I778 R779	H771-Y775 VanDerWaalsContact O-CB 3.29Å; H771-Y775 WeakPolarHBondContact O-CB 3.2Å; H771-Y775 PolarHBondContact O-N 3.36Å; Q772-Y775 PolarHBondContact O-N 3.24Å; Q772-Y775 VanDerWaalsContact O-N 3.13Å; Y775-I778 PolarHBondContact O-N 3.02Å; Y775-R779 VanDerWaalsContact O-CB 3.31Å; Y775-R779 WeakPolarHBondContact O-CB 3.25Å; Y775-R779 PolarHBondContact O-N 3.23Å
776	D	65.7	Low	58.6	Low	88 Å²	88	109.8 Å²	109.8	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-68.3	-39.1	178	-66.1	-17.5	0	0	0	111.5	Q772 Q773 I778 R779 S780	Q772-D776 PolarHBondContact NE2-OD1 3.47Å; Q772-D776 WeakPolarHBondContact O-CB 3.35Å; Q772-D776 PolarHBondContact O-N 2.68Å; Q773-D776 PolarHBondContact O-N 2.83Å; D776-I778 VanDerWaalsContact C-N 3.35Å; D776-R779 PolarHBondContact O-N 2.68Å; D776-S780 PolarHBondContact O-N 2.8Å
777	I	62.8	Low	59	Low	93 Å²	93	105.8 Å²	105.8	48%	0.477	54%	0.544	S	S	.	.	H	α-helix	trans	-65.6	-38.2	173.5	-68.3	164.2	0	0	0	111.3	R698 Q773 V774	R698-I777 PolarHBondContact NH1-O 2.83Å; Q773-I777 WeakPolarHBondContact O-CB 3.15Å; Q773-I777 WeakPolarHBondContact O-CD1 3.47Å; Q773-I777 WeakPolarHBondContact O-CG1 3.46Å; Q773-I777 PolarHBondContact O-N 2.78Å; V774-I777 PolarHBondContact O-N 2.88Å
778	I	60.9	Low	59.5	Low	102 Å²	102	106.4 Å²	106.4	52%	0.523	55%	0.547	S	S	.	.	H	α-helix	trans	-69.8	-37.6	178.8	-70.2	167.9	0	0	0	111	R698 V774 Y775 D776	R698-I778 PolarHBondContact NH1-O 3.26Å; V774-I778 HydrophobicContact CG1-CD1 3.75Å; V774-I778 WeakPolarHBondContact O-CB 3.46Å; V774-I778 WeakPolarHBondContact O-CD1 3.47Å; V774-I778 WeakPolarHBondContact O-CG1 3.34Å; V774-I778 PolarHBondContact O-N 2.81Å; Y775-I778 PolarHBondContact O-N 3.02Å; D776-I778 VanDerWaalsContact C-N 3.35Å
779	R	54.5	Low	59.4	Low	183 Å²	183	109 Å²	109	69%	0.691	55%	0.55	S	S	*	*	H	α-helix	trans	-91.6	-13.2	-173.5	-168.5	169.5	177.6	167.7	-1.2	114.7	Y775 D776 P781	Y775-R779 VanDerWaalsContact O-CB 3.31Å; Y775-R779 WeakPolarHBondContact O-CB 3.25Å; Y775-R779 PolarHBondContact O-N 3.23Å; D776-R779 PolarHBondContact O-N 2.68Å; R779-P781 WeakPolarHBondContact O-CD 3.32Å
780	S	43.1	Very low	58.9	Low	83 Å²	83	109.5 Å²	109.5	58%	0.58	55%	0.55	S	S	*	*			trans	-61.3	122.4	172.6	-167.1	0	0	0	0	109.5	D776	D776-S780 PolarHBondContact O-N 2.8Å
781	P	44.6	Very low	58.8	Low	159 Å²	159	112.2 Å²	112.2	100%	1.032	56%	0.563	S	S	*	*			trans	-68.4	0	-170	26.4	-33.4	0	0	0	114.6	R779	R779-P781 WeakPolarHBondContact O-CD 3.32Å

Retrieved 781 of 781 residues in 492.4 ms (Link to these results)

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