A0A077ZEQ1_TRITR Loading...

AF4/FMR2 family member lilli

Has a role in transcriptional regulation. Acts in parallel with the Ras/MAPK and the PI3K/PKB pathways in the control of cell identity and cellular growth. Essential for regulation of the cytoskeleton and cell growth but not for cell proliferation or growth rate. Required specifically for the microtubule-based basal transport of lipid droplets. Plays a partially redundant function downstream of Raf in cell fate specification in the developing eye. Pair-rule protein that regulates embryonic cellularization, gastrulation and segmentation.

AlphaFold DB , UniProt , Accession A0A077ZEQ1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 729 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	35.8	Very low	244 Å²	244	155.9 Å²	155.9	100%	1.202	86%	0.86	S	S	*	*				0	124.4	0	-75.2	170.5	168.9	0	0	106.5
2	T	30.7	Very low	36.5	Very low	132 Å²	132	153.7 Å²	153.7	81%	0.81	85%	0.854	S	S	*	*			trans	-138.2	121.7	-169.8	-44.7	0	0	0	0	107.9
3	I	37.8	Very low	37.6	Very low	171 Å²	171	149.4 Å²	149.4	88%	0.877	85%	0.851	S	S	*	*			trans	-109.2	117.9	177.2	-61.9	177.4	0	0	0	107.1
4	Q	28.7	Very low	38.4	Very low	182 Å²	182	147.1 Å²	147.1	85%	0.85	83%	0.833	S	S	*	*			trans	-140.3	113.6	174.5	-151.8	-179.8	13.4	0	0	108.2
5	S	37.8	Very low	39.2	Very low	120 Å²	120	140.4 Å²	140.4	84%	0.839	80%	0.798	S	S	*	*			trans	-174.6	142.3	176.5	-75.9	0	0	0	0	107.3
6	S	36.9	Very low	40	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	79%	0.792	S	S	*	*			cis	-150.7	144.7	-13.1	-179.9	0	0	0	0	107.6
7	D	35.5	Very low	40.9	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	77%	0.772	S	S	*	*			trans	-66.2	153	167.6	-68.5	-68	0	0	0	111.2
8	Y	35.5	Very low	41.5	Very low	236 Å²	236	132.6 Å²	132.6	93%	0.925	75%	0.745	S	S	*	*			trans	-134.6	127.2	149.8	-124.8	-89.6	0	0	0	108.4
9	A	38.5	Very low	42.3	Very low	93 Å²	93	133.6 Å²	133.6	77%	0.769	74%	0.736	S	S	*	*			trans	-97.8	136.6	-162	0	0	0	0	0	113.6
10	G	39.6	Very low	43.2	Very low	69 Å²	69	129.5 Å²	129.5	71%	0.711	71%	0.713	S	S	*	*			trans	-145.3	86.5	166.3	0	0	0	0	0	109.8	T12	G10-T12 PolarHBondContact O-N 3.2Å; G10-T12 VanDerWaalsContact O-N 3.16Å
11	K	37.8	Very low	43.6	Very low	210 Å²	210	128 Å²	128	91%	0.913	70%	0.703	S	S	*	*			trans	-81.7	90.4	-177	-72.4	-174.7	178	-179.7	0	111.2
12	T	44.5	Very low	44.6	Very low	129 Å²	129	122.1 Å²	122.1	79%	0.791	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-78.6	143.3	157.7	46.3	0	0	0	0	110	G10	G10-T12 PolarHBondContact O-N 3.2Å; G10-T12 VanDerWaalsContact O-N 3.16Å
13	A	51.3	Low	46.1	Very low	98 Å²	98	118 Å²	118	81%	0.81	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-68.9	142.3	176.5	0	0	0	0	0	110.6
14	I	49.1	Very low	46.9	Very low	118 Å²	118	112.9 Å²	112.9	61%	0.605	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-92.7	125.7	176.3	-59.5	168.4	0	0	0	107.7	P238	I14-P238 HydrophobicContact CG2-CG 4.15Å
15	P	49.6	Very low	48.2	Very low	46 Å²	46	107.1 Å²	107.1	30%	0.299	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-67.1	152	176.9	27.3	-34.4	0	0	0	111.7	N17 Y23	P15-N17 PolarHBondContact O-N 3.42Å; P15-Y23 HydrophobicContact CG-CD1 4.41Å; P15-Y23 HydrophobicContact CG-CD2 3.51Å; P15-Y23 HydrophobicContact CG-CE2 4.02Å; P15-Y23 HydrophobicContact CG-CG 3.73Å
16	E	51.8	Low	49.1	Very low	153 Å²	153	104.3 Å²	104.3	72%	0.715	58%	0.575	S	S	*	*	S	Bend	trans	-68	-18.2	-176.1	-65	-169.9	118.2	0	0	113.9	L66	E16-L66 HydrophobicContact CB-CD1 4.43Å
17	N	55.6	Low	50.2	Low	83 Å²	83	103.1 Å²	103.1	44%	0.444	56%	0.556	S	S	.	*			trans	-109.9	113.7	178.9	-175.2	7.1	0	0	0	111.4	P15 W19 D20	P15-N17 PolarHBondContact O-N 3.42Å; N17-W19 PolarHBondContact O-N 2.92Å; N17-W19 WeakPolarHBondContact OD1-CB 3.32Å; N17-W19 PolarHBondContact OD1-N 2.67Å; N17-D20 WeakPolarHBondContact O-CB 3.47Å; N17-D20 PolarHBondContact O-N 3.4Å
18	P	51.9	Low	50.9	Low	44 Å²	44	99.8 Å²	99.8	29%	0.286	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-5.8	177.5	31.1	-36	0	0	0	114.1	I239	P18-I239 HydrophobicContact CB-CG1 4.18Å
19	W	55.7	Low	51.6	Low	153 Å²	153	91.4 Å²	91.4	58%	0.58	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	9.9	176.9	-53.5	107.6	0	0	0	113.5	N17 I21 I239	N17-W19 PolarHBondContact O-N 2.92Å; N17-W19 WeakPolarHBondContact OD1-CB 3.32Å; N17-W19 PolarHBondContact OD1-N 2.67Å; W19-I21 PolarHBondContact O-N 3.43Å; W19-I239 HydrophobicContact CH2-CD1 4.24Å; W19-I239 HydrophobicContact CZ3-CD1 4.36Å
20	D	60.5	Low	52.2	Low	51 Å²	51	91.3 Å²	91.3	27%	0.273	51%	0.506	S	S	.	.			trans	-57.3	120.7	171.8	175.8	-1.9	0	0	0	110.5	N17 D22 Y23 L24	N17-D20 WeakPolarHBondContact O-CB 3.47Å; N17-D20 PolarHBondContact O-N 3.4Å; D20-D22 PolarHBondContact OD1-N 2.85Å; D20-Y23 PolarHBondContact O-N 3.38Å; D20-Y23 PolarHBondContact OD1-N 3.24Å; D20-L24 WeakPolarHBondContact O-CG 3.46Å; D20-L24 PolarHBondContact O-N 3.2Å
21	I	53	Low	52.6	Low	99 Å²	99	95.3 Å²	95.3	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-68.1	-40	-176.7	-66.4	174.7	0	0	0	110.4	W19 Y23 L24 I25	W19-I21 PolarHBondContact O-N 3.43Å; I21-Y23 VanDerWaalsContact C-N 3.34Å; I21-L24 PolarHBondContact O-N 3.21Å; I21-I25 HydrophobicContact CG2-CD1 3.69Å; I21-I25 HydrophobicContact CG2-CG1 4.34Å; I21-I25 WeakPolarHBondContact O-CB 3.45Å; I21-I25 VanDerWaalsContact O-CG1 3.31Å; I21-I25 WeakPolarHBondContact O-CG1 3.43Å; I21-I25 PolarHBondContact O-N 2.88Å
22	D	54.3	Low	52.7	Low	120 Å²	120	91 Å²	91	64%	0.642	50%	0.5	S	S	*	.	H	α-helix	trans	-70	-35.3	179.2	-70.3	-31	0	0	0	110.8	D20 I25 S26	D20-D22 PolarHBondContact OD1-N 2.85Å; D22-I25 PolarHBondContact O-N 2.98Å; D22-S26 WeakPolarHBondContact O-CB 3.16Å; D22-S26 PolarHBondContact O-N 3.23Å
23	Y	62.9	Low	52.5	Low	46 Å²	46	88.4 Å²	88.4	18%	0.18	50%	0.499	C	S	.	.	H	α-helix	trans	-62.4	-42.7	170.3	-176.9	-104.9	0	0	0	112.4	P15 D20 I21 K27 P236	P15-Y23 HydrophobicContact CG-CD1 4.41Å; P15-Y23 HydrophobicContact CG-CD2 3.51Å; P15-Y23 HydrophobicContact CG-CE2 4.02Å; P15-Y23 HydrophobicContact CG-CG 3.73Å; D20-Y23 PolarHBondContact O-N 3.38Å; D20-Y23 PolarHBondContact OD1-N 3.24Å; I21-Y23 VanDerWaalsContact C-N 3.34Å; Y23-K27 HydrophobicContact CE1-CD 3.81Å; Y23-K27 HydrophobicContact CE2-CD 4.47Å; Y23-K27 WeakPolarHBondContact O-CB 3.49Å; Y23-K27 PolarHBondContact O-N 3.11Å; Y23-K27 PolarHBondContact OH-NZ 3.25Å; Y23-P236 HydrophobicContact CE1-CB 4.14Å; Y23-P236 HydrophobicContact CE1-CG 4.12Å
24	L	54.1	Low	51.8	Low	62 Å²	62	89.3 Å²	89.3	33%	0.325	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-40.3	178.1	-73.5	165.7	0	0	0	112.2	D20 I21 T28 P236	D20-L24 WeakPolarHBondContact O-CG 3.46Å; D20-L24 PolarHBondContact O-N 3.2Å; I21-L24 PolarHBondContact O-N 3.21Å; L24-T28 WeakPolarHBondContact O-CB 3.49Å; L24-T28 WeakPolarHBondContact O-CG2 3.28Å; L24-T28 PolarHBondContact O-N 3.04Å; L24-T28 PolarHBondContact O-OG1 3.23Å; L24-P236 HydrophobicContact CD2-CG 4Å
25	I	55.6	Low	51.4	Low	61 Å²	61	89.7 Å²	89.7	31%	0.313	51%	0.509	S	S	.	.	H	α-helix	trans	-66.8	-53.6	175.6	-70.6	171.9	0	0	0	110.4	I21 D22 K27 T28 L29	I21-I25 HydrophobicContact CG2-CD1 3.69Å; I21-I25 HydrophobicContact CG2-CG1 4.34Å; I21-I25 WeakPolarHBondContact O-CB 3.45Å; I21-I25 VanDerWaalsContact O-CG1 3.31Å; I21-I25 WeakPolarHBondContact O-CG1 3.43Å; I21-I25 PolarHBondContact O-N 2.88Å; D22-I25 PolarHBondContact O-N 2.98Å; I25-K27 VanDerWaalsContact C-N 3.3Å; I25-K27 PolarHBondContact O-N 3.41Å; I25-T28 PolarHBondContact O-N 2.92Å; I25-T28 VanDerWaalsContact O-N 3.12Å; I25-T28 PolarHBondContact O-OG1 3.47Å; I25-L29 HydrophobicContact CG2-CD1 3.65Å; I25-L29 WeakPolarHBondContact O-CG 3.34Å; I25-L29 PolarHBondContact O-N 3.29Å
26	S	58.4	Low	51.1	Low	62 Å²	62	90.9 Å²	90.9	43%	0.434	53%	0.53	S	S	.	.	H	α-helix	trans	-57.5	-41.8	179.9	-176.8	0	0	0	0	112.1	D22 L29 S30	D22-S26 WeakPolarHBondContact O-CB 3.16Å; D22-S26 PolarHBondContact O-N 3.23Å; S26-L29 PolarHBondContact O-N 3.12Å; S26-S30 VanDerWaalsContact O-CB 3.24Å; S26-S30 WeakPolarHBondContact O-CB 3.28Å; S26-S30 PolarHBondContact O-N 3.49Å; S26-S30 PolarHBondContact O-OG 3.02Å
27	K	59.6	Low	50.4	Low	84 Å²	84	91.6 Å²	91.6	37%	0.365	54%	0.539	S	S	.	.	H	α-helix	trans	-76	-22.2	179.4	-166	171.5	-170.8	174.2	0	114.5	Y23 I25	Y23-K27 HydrophobicContact CE1-CD 3.81Å; Y23-K27 HydrophobicContact CE2-CD 4.47Å; Y23-K27 WeakPolarHBondContact O-CB 3.49Å; Y23-K27 PolarHBondContact O-N 3.11Å; Y23-K27 PolarHBondContact OH-NZ 3.25Å; I25-K27 VanDerWaalsContact C-N 3.3Å; I25-K27 PolarHBondContact O-N 3.41Å
28	T	50.6	Low	49.8	Very low	78 Å²	78	92.6 Å²	92.6	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-79.4	-35.6	171.2	44.3	0	0	0	0	111.8	L24 I25	L24-T28 WeakPolarHBondContact O-CB 3.49Å; L24-T28 WeakPolarHBondContact O-CG2 3.28Å; L24-T28 PolarHBondContact O-N 3.04Å; L24-T28 PolarHBondContact O-OG1 3.23Å; I25-T28 PolarHBondContact O-N 2.92Å; I25-T28 VanDerWaalsContact O-N 3.12Å; I25-T28 PolarHBondContact O-OG1 3.47Å
29	L	50	Low	49.2	Very low	61 Å²	61	99.4 Å²	99.4	32%	0.319	59%	0.587	S	S	.	*	H	α-helix	trans	-84.8	-28.5	-176.8	-63.6	170.6	0	0	0	114.4	I25 S26 K31 G637 V639	I25-L29 HydrophobicContact CG2-CD1 3.65Å; I25-L29 WeakPolarHBondContact O-CG 3.34Å; I25-L29 PolarHBondContact O-N 3.29Å; S26-L29 PolarHBondContact O-N 3.12Å; L29-K31 PolarHBondContact O-N 3.43Å; L29-G637 WeakPolarHBondContact CD1-O 3.04Å; L29-V639 HydrophobicContact CD1-CB 4.46Å; L29-V639 HydrophobicContact CD1-CG2 3.7Å; L29-V639 HydrophobicContact CD2-CG2 3.69Å; L29-V639 HydrophobicContact CG-CG2 4.38Å
30	S	51.4	Low	48.6	Very low	91 Å²	91	96.8 Å²	96.8	64%	0.636	59%	0.592	S	S	*	*	S	Bend	trans	-73.2	33.3	-179.7	-59.2	0	0	0	0	114.9	S26	S26-S30 VanDerWaalsContact O-CB 3.24Å; S26-S30 WeakPolarHBondContact O-CB 3.28Å; S26-S30 PolarHBondContact O-N 3.49Å; S26-S30 PolarHBondContact O-OG 3.02Å
31	K	46.7	Very low	47.7	Very low	153 Å²	153	102.2 Å²	102.2	67%	0.665	62%	0.621	S	S	*	*			trans	-141.6	51.2	-174.2	-148.9	175.9	-173.5	179.8	0	115.1	L29	L29-K31 PolarHBondContact O-N 3.43Å
32	S	40.7	Very low	47	Very low	120 Å²	120	101.3 Å²	101.3	84%	0.839	64%	0.636	S	S	*	*			trans	-117.1	78.5	168.2	43.1	0	0	0	0	110.7
33	G	39.7	Very low	46.4	Very low	74 Å²	74	99.2 Å²	99.2	76%	0.763	64%	0.642	S	S	*	*			trans	-149.7	114.7	175.5	0	0	0	0	0	110.7
34	S	37.7	Very low	45.6	Very low	116 Å²	116	108.9 Å²	108.9	81%	0.811	68%	0.679	S	S	*	*			trans	-92.9	137.4	178.6	-167.8	0	0	0	0	110.5
35	P	39.7	Very low	45.3	Very low	126 Å²	126	111.7 Å²	111.7	82%	0.818	70%	0.704	S	S	*	*			trans	-76.4	150.5	173.4	32.5	-34.2	0	0	0	111.4
36	G	44.3	Very low	44.8	Very low	72 Å²	72	120.2 Å²	120.2	74%	0.742	73%	0.732	S	S	*	*			trans	-157.6	135.8	176.4	0	0	0	0	0	111.8
37	D	37	Very low	43.9	Very low	168 Å²	168	120.8 Å²	120.8	90%	0.898	75%	0.747	S	S	*	*			trans	-62.7	148	-160.4	-53	-70.4	0	0	0	118.3
38	A	41.1	Very low	43.4	Very low	104 Å²	104	125.7 Å²	125.7	86%	0.86	77%	0.772	S	S	*	*			trans	-154.2	148.5	153.6	0	0	0	0	0	110.9
39	Q	40.1	Very low	43.1	Very low	187 Å²	187	127 Å²	127	87%	0.874	78%	0.782	S	S	*	*			trans	-116.4	156.7	-170.6	-71.6	-173.5	-23.4	0	0	115.5
40	S	42.5	Very low	42.4	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	80%	0.803	S	S	*	*			trans	93.9	134.3	143	82.7	0	0	0	0	121.3
41	N	41.9	Very low	42.1	Very low	165 Å²	165	131 Å²	131	88%	0.882	81%	0.811	S	S	*	*			trans	55.7	139.7	147.5	-53.8	-25.3	0	0	0	121.1
42	G	39.3	Very low	41.6	Very low	80 Å²	80	130 Å²	130	83%	0.825	82%	0.818	S	S	*	*			cis	161.3	140.3	-9	0	0	0	0	0	114.4
43	G	41.3	Very low	41.8	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	81%	0.814	S	S	*	*			trans	110.4	111.7	172.6	0	0	0	0	0	114.4
44	R	45.8	Very low	41.9	Very low	250 Å²	250	134.3 Å²	134.3	94%	0.943	81%	0.814	S	S	*	*				73.5	99.5	67.5	-79.5	-166	168.1	-156.5	-1.1	116.6
45	S	46.9	Very low	41.9	Very low	121 Å²	121	135.8 Å²	135.8	85%	0.846	81%	0.809	S	S	*	*				167.6	163.5	122.4	-77.5	0	0	0	0	112.8
46	R	46	Very low	41.7	Very low	239 Å²	239	138.8 Å²	138.8	90%	0.902	81%	0.812	S	S	*	*			cis	-170.2	108.1	-36.7	178.4	-175.4	172.2	-163.3	-3.7	111.1
47	G	40.5	Very low	41.4	Very low	74 Å²	74	142 Å²	142	76%	0.763	81%	0.811	S	S	*	*			trans	84.2	172.8	161.3	0	0	0	0	0	117.1
48	Q	48.8	Very low	41.2	Very low	187 Å²	187	142.3 Å²	142.3	87%	0.874	81%	0.807	S	S	*	*			cis	-160.3	-171.5	-19.1	-142	-168.9	-30.9	0	0	109.7
49	P	43.7	Very low	40.9	Very low	106 Å²	106	145.5 Å²	145.5	69%	0.688	81%	0.808	S	S	*	*				-113.3	175.9	-108.6	42.2	-28.7	0	0	0	117.4
50	S	35.6	Very low	40.7	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	80%	0.8	S	S	*	*			trans	-68.2	171	169.7	-35	0	0	0	0	114.1
51	P	43.8	Very low	40.1	Very low	125 Å²	125	144.9 Å²	144.9	81%	0.812	81%	0.811	S	S	*	*				-148.1	171.1	99.5	39.7	-23.4	0	0	0	117.9
52	T	38	Very low	39.5	Very low	132 Å²	132	141 Å²	141	81%	0.81	80%	0.802	S	S	*	*			trans	-44	147	176.3	53.3	0	0	0	0	120.2
53	S	44.2	Very low	39.2	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	80%	0.801	S	S	*	*				179.9	130.5	109.3	61.6	0	0	0	0	116.3
54	K	42.3	Very low	38.8	Very low	177 Å²	177	144.7 Å²	144.7	77%	0.77	80%	0.797	S	S	*	*			trans	46.6	139.3	139.8	-77.2	174.8	142.1	-123.8	0	124.8
55	E	36.2	Very low	38.3	Very low	148 Å²	148	144.3 Å²	144.3	69%	0.692	80%	0.795	S	S	*	*			trans	75.8	88.7	140.2	-70.5	169.9	96.2	0	0	122.1
56	Q	35.9	Very low	37.9	Very low	189 Å²	189	142.5 Å²	142.5	88%	0.883	78%	0.776	S	S	*	*			trans	-160.1	132.3	138.4	-99.7	166.3	15.7	0	0	105.3
57	I	39.1	Very low	38.1	Very low	140 Å²	140	136.1 Å²	136.1	72%	0.718	76%	0.759	S	S	*	*			cis	80.5	108.7	33.9	-56.3	-176.6	0	0	0	113.5
58	E	32.6	Very low	38.2	Very low	174 Å²	174	138.3 Å²	138.3	81%	0.813	75%	0.75	S	S	*	*			trans	69.1	159.9	168.6	-67.1	-174.1	145.2	0	0	119.8
59	L	35.3	Very low	38.5	Very low	170 Å²	170	134.6 Å²	134.6	89%	0.89	73%	0.732	S	S	*	*			trans	63.5	133.7	-166.1	-66.4	90.1	0	0	0	115.9
60	S	34	Very low	39.2	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	72%	0.723	S	S	*	*			cis	-153.1	142.1	-13.5	53.5	0	0	0	0	111.2	A62	S60-A62 PolarHBondContact O-N 3.17Å
61	N	30.2	Very low	39.7	Very low	169 Å²	169	132.8 Å²	132.8	90%	0.904	71%	0.709	S	S	*	*			trans	-80.2	115.6	176.2	-78.6	-50.5	0	0	0	110.6
62	A	30.5	Very low	40.3	Very low	83 Å²	83	130.7 Å²	130.7	69%	0.686	69%	0.687	S	S	*	*			trans	-138	37.3	178.2	0	0	0	0	0	113.2	S60 C64	S60-A62 PolarHBondContact O-N 3.17Å; A62-C64 PolarHBondContact O-N 3.26Å
63	T	33.1	Very low	41.4	Very low	130 Å²	130	129.1 Å²	129.1	80%	0.798	67%	0.67	S	S	*	*			trans	-75.9	104	175.3	-48.5	0	0	0	0	110.5	R65	T63-R65 PolarHBondContact O-N 3.32Å
64	C	32.1	Very low	41.7	Very low	104 Å²	104	127.6 Å²	127.6	70%	0.703	66%	0.659	S	S	*	*			trans	-57.1	109.1	179.4	-65.7	0	0	0	0	112.1	A62 L66	A62-C64 PolarHBondContact O-N 3.26Å; C64-L66 PolarHBondContact O-N 3.48Å
65	R	35.1	Very low	41.9	Very low	243 Å²	243	123 Å²	123	92%	0.917	64%	0.642	S	S	*	*			trans	-82.5	89.8	164.7	-76.8	-173.8	171.3	-171.8	-2	109.1	T63 N67	T63-R65 PolarHBondContact O-N 3.32Å; R65-N67 PolarHBondContact O-N 3.49Å
66	L	39.8	Very low	43	Very low	82 Å²	82	118.9 Å²	118.9	43%	0.429	63%	0.625	S	S	.	*			trans	-54.5	121.5	163.7	-83.4	169.7	0	0	0	108.8	E16 C64 M70	E16-L66 HydrophobicContact CB-CD1 4.43Å; C64-L66 PolarHBondContact O-N 3.48Å; L66-M70 HydrophobicContact CD2-CE 3.68Å; L66-M70 HydrophobicContact CD2-SD 4.08Å
67	N	50	Low	44.5	Very low	105 Å²	105	114.9 Å²	114.9	56%	0.561	61%	0.609	S	S	*	*			trans	-78.7	147	-172.8	-152.9	-6.7	0	0	0	109.6	R65 E69 M70 V71	R65-N67 PolarHBondContact O-N 3.49Å; N67-E69 PolarHBondContact O-N 3.47Å; N67-E69 VanDerWaalsContact O-N 3.1Å; N67-M70 HydrophobicContact CB-CG 4.33Å; N67-M70 HydrophobicContact CB-SD 4.41Å; N67-M70 WeakPolarHBondContact O-CB 3.43Å; N67-M70 PolarHBondContact O-N 3.14Å; N67-V71 PolarHBondContact O-N 3.47Å
68	H	42.4	Very low	45.1	Very low	120 Å²	120	114.6 Å²	114.6	56%	0.556	61%	0.609	S	S	*	*	H	α-helix	trans	-55.4	-33.8	179.4	177.2	-78.5	0	0	0	111.7	M70 V71 K72	H68-M70 VanDerWaalsContact C-N 3.34Å; H68-M70 PolarHBondContact O-N 3.35Å; H68-V71 PolarHBondContact O-N 2.84Å; H68-K72 WeakPolarHBondContact O-CB 3.15Å; H68-K72 PolarHBondContact O-N 3.04Å
69	E	55.6	Low	46	Very low	109 Å²	109	114.4 Å²	114.4	51%	0.509	61%	0.605	S	S	.	*	H	α-helix	trans	-64.8	-32.6	176	-135.4	64.6	-168.1	0	0	113.4	N67 Q73	N67-E69 PolarHBondContact O-N 3.47Å; N67-E69 VanDerWaalsContact O-N 3.1Å; E69-Q73 WeakPolarHBondContact O-CB 3.4Å; E69-Q73 PolarHBondContact O-N 3.12Å
70	M	58.1	Low	46.8	Very low	102 Å²	102	114.4 Å²	114.4	50%	0.502	60%	0.601	S	S	.	*	H	α-helix	trans	-73.3	-45	176.5	-66.5	175.3	68	0	0	111.3	L66 N67 H68 K72 Q73 C74	L66-M70 HydrophobicContact CD2-CE 3.68Å; L66-M70 HydrophobicContact CD2-SD 4.08Å; N67-M70 HydrophobicContact CB-CG 4.33Å; N67-M70 HydrophobicContact CB-SD 4.41Å; N67-M70 WeakPolarHBondContact O-CB 3.43Å; N67-M70 PolarHBondContact O-N 3.14Å; H68-M70 VanDerWaalsContact C-N 3.34Å; H68-M70 PolarHBondContact O-N 3.35Å; M70-K72 PolarHBondContact O-N 3.11Å; M70-Q73 PolarHBondContact O-N 2.86Å; M70-Q73 VanDerWaalsContact O-N 3.15Å; M70-C74 PolarHBondContact O-N 3.48Å; M70-C74 PolarHBondContact O-SG 3.2Å; M70-C74 VanDerWaalsContact O-SG 3.37Å
71	V	45.2	Very low	47.4	Very low	77 Å²	77	118.4 Å²	118.4	47%	0.467	61%	0.608	S	S	.	*	H	α-helix	trans	-61.3	-38.3	175.3	-178.8	0	0	0	0	110.4	N67 H68 I75	N67-V71 PolarHBondContact O-N 3.47Å; H68-V71 PolarHBondContact O-N 2.84Å; V71-I75 HydrophobicContact CG1-CD1 4.15Å; V71-I75 WeakPolarHBondContact O-CD1 3.48Å; V71-I75 VanDerWaalsContact O-CG1 3.26Å; V71-I75 WeakPolarHBondContact O-CG1 3.38Å; V71-I75 PolarHBondContact O-N 3.29Å
72	K	56.4	Low	48.2	Very low	81 Å²	81	119.9 Å²	119.9	35%	0.352	61%	0.61	S	S	.	*	H	α-helix	trans	-64.8	-46.5	172.3	-176.6	-174.4	169.3	-65	0	111.9	H68 M70 I75 D76	H68-K72 WeakPolarHBondContact O-CB 3.15Å; H68-K72 PolarHBondContact O-N 3.04Å; M70-K72 PolarHBondContact O-N 3.11Å; K72-I75 PolarHBondContact O-N 2.82Å; K72-I75 VanDerWaalsContact O-N 3.09Å; K72-D76 IonicContact NZ-OD1 2.56Å; K72-D76 IonicContact NZ-OD2 2.62Å; K72-D76 PolarHBondContact NZ-OD2 2.95Å; K72-D76 PolarHBondContact O-N 3.43Å
73	Q	60.5	Low	48.8	Very low	98 Å²	98	119.2 Å²	119.2	46%	0.458	61%	0.611	S	S	.	*	H	α-helix	trans	-59.4	-48.9	179.9	-170.1	63.5	53.1	0	0	111	E69 M70 I75 D76 D77	E69-Q73 WeakPolarHBondContact O-CB 3.4Å; E69-Q73 PolarHBondContact O-N 3.12Å; M70-Q73 PolarHBondContact O-N 2.86Å; M70-Q73 VanDerWaalsContact O-N 3.15Å; Q73-I75 PolarHBondContact O-N 3.45Å; Q73-I75 VanDerWaalsContact O-N 3.15Å; Q73-D76 PolarHBondContact O-N 2.93Å; Q73-D76 VanDerWaalsContact O-N 3.11Å; Q73-D77 PolarHBondContact NE2-OD1 2.92Å; Q73-D77 WeakPolarHBondContact O-CB 3.37Å; Q73-D77 PolarHBondContact O-N 3.37Å
74	C	50.5	Low	49.5	Very low	76 Å²	76	120.9 Å²	120.9	51%	0.514	62%	0.615	S	S	.	*	H	α-helix	trans	-62.7	-22	176.4	-61.3	0	0	0	0	114	M70 L78	M70-C74 PolarHBondContact O-N 3.48Å; M70-C74 PolarHBondContact O-SG 3.2Å; M70-C74 VanDerWaalsContact O-SG 3.37Å; C74-L78 VanDerWaalsContact O-CD1 3.29Å; C74-L78 WeakPolarHBondContact O-CD1 3.34Å; C74-L78 VanDerWaalsContact O-CG 3.23Å; C74-L78 WeakPolarHBondContact O-CG 3.45Å
75	I	47.7	Very low	49.9	Very low	82 Å²	82	125.3 Å²	125.3	42%	0.421	62%	0.617	S	S	.	*	H	α-helix	trans	-81.9	-42.9	172.6	-70.7	167.1	0	0	0	110.7	V71 K72 Q73 D77 L78 F79	V71-I75 HydrophobicContact CG1-CD1 4.15Å; V71-I75 WeakPolarHBondContact O-CD1 3.48Å; V71-I75 VanDerWaalsContact O-CG1 3.26Å; V71-I75 WeakPolarHBondContact O-CG1 3.38Å; V71-I75 PolarHBondContact O-N 3.29Å; K72-I75 PolarHBondContact O-N 2.82Å; K72-I75 VanDerWaalsContact O-N 3.09Å; Q73-I75 PolarHBondContact O-N 3.45Å; Q73-I75 VanDerWaalsContact O-N 3.15Å; I75-D77 VanDerWaalsContact C-N 3.35Å; I75-L78 PolarHBondContact O-N 3.32Å; I75-F79 HydrophobicContact CG2-CD2 4.23Å; I75-F79 HydrophobicContact CG2-CE2 4.39Å; I75-F79 VanDerWaalsContact O-CD2 3.3Å; I75-F79 WeakPolarHBondContact O-CD2 3.41Å
76	D	60	Low	50.5	Low	61 Å²	61	118.8 Å²	118.8	33%	0.326	62%	0.615	S	S	.	*	H	α-helix	trans	-63.1	-42.7	176.1	-64.8	-17.8	0	0	0	110.7	K72 Q73 L78 F79 E80	K72-D76 IonicContact NZ-OD1 2.56Å; K72-D76 IonicContact NZ-OD2 2.62Å; K72-D76 PolarHBondContact NZ-OD2 2.95Å; K72-D76 PolarHBondContact O-N 3.43Å; Q73-D76 PolarHBondContact O-N 2.93Å; Q73-D76 VanDerWaalsContact O-N 3.11Å; D76-L78 PolarHBondContact O-N 3.49Å; D76-F79 PolarHBondContact O-N 3.39Å; D76-E80 PolarHBondContact O-N 3.08Å; D76-E80 VanDerWaalsContact O-N 3.1Å
77	D	66.1	Low	50.6	Low	104 Å²	104	122.9 Å²	122.9	56%	0.556	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-20.5	176.1	-62.8	-21.6	0	0	0	113.1	Q73 I75	Q73-D77 PolarHBondContact NE2-OD1 2.92Å; Q73-D77 WeakPolarHBondContact O-CB 3.37Å; Q73-D77 PolarHBondContact O-N 3.37Å; I75-D77 VanDerWaalsContact C-N 3.35Å
78	L	51.2	Low	50.7	Low	135 Å²	135	123.5 Å²	123.5	71%	0.707	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-5.5	175.6	-82.2	170.8	0	0	0	113.7	C74 I75 D76	C74-L78 VanDerWaalsContact O-CD1 3.29Å; C74-L78 WeakPolarHBondContact O-CD1 3.34Å; C74-L78 VanDerWaalsContact O-CG 3.23Å; C74-L78 WeakPolarHBondContact O-CG 3.45Å; I75-L78 PolarHBondContact O-N 3.32Å; D76-L78 PolarHBondContact O-N 3.49Å
79	F	51.7	Low	50.7	Low	169 Å²	169	124.6 Å²	124.6	74%	0.741	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	-5	-173.3	-72.9	-65	0	0	0	116.1	I75 D76 E81	I75-F79 HydrophobicContact CG2-CD2 4.23Å; I75-F79 HydrophobicContact CG2-CE2 4.39Å; I75-F79 VanDerWaalsContact O-CD2 3.3Å; I75-F79 WeakPolarHBondContact O-CD2 3.41Å; D76-F79 PolarHBondContact O-N 3.39Å; F79-E81 PolarHBondContact O-N 3.02Å
80	E	53.5	Low	50.3	Low	171 Å²	171	130.2 Å²	130.2	80%	0.799	67%	0.671	S	S	*	*			trans	-77.6	107.2	166.3	-70.2	-90.9	139.2	0	0	109.6	D76	D76-E80 PolarHBondContact O-N 3.08Å; D76-E80 VanDerWaalsContact O-N 3.1Å
81	E	46.6	Very low	49.6	Very low	186 Å²	186	132.1 Å²	132.1	87%	0.869	68%	0.683	S	S	*	*			trans	-63.3	145.4	169.3	-75.4	-172.5	137	0	0	111.2	F79 G83	F79-E81 PolarHBondContact O-N 3.02Å; E81-G83 VanDerWaalsContact C-N 3.27Å; E81-G83 PolarHBondContact O-N 3.32Å
82	E	45.5	Very low	49.2	Very low	199 Å²	199	136 Å²	136	93%	0.93	70%	0.701	S	S	*	*			trans	-73.5	75.5	-173.6	-162.9	162.6	-149.3	0	0	112	D84	E82-D84 VanDerWaalsContact C-N 3.34Å; E82-D84 PolarHBondContact O-N 3.05Å
83	G	44.5	Very low	49.1	Very low	70 Å²	70	138.2 Å²	138.2	72%	0.722	73%	0.727	S	S	*	*			trans	-70.3	80.4	-176.8	0	0	0	0	0	113.5	E81	E81-G83 VanDerWaalsContact C-N 3.27Å; E81-G83 PolarHBondContact O-N 3.32Å
84	D	47.9	Very low	47.9	Very low	165 Å²	165	138.6 Å²	138.6	88%	0.882	75%	0.746	S	S	*	*			trans	-55.4	140.9	-173	-155.3	-7.3	0	0	0	113.8	E82	E82-D84 VanDerWaalsContact C-N 3.34Å; E82-D84 PolarHBondContact O-N 3.05Å
85	R	40.6	Very low	47.6	Very low	196 Å²	196	140.4 Å²	140.4	74%	0.74	76%	0.76	S	S	*	*			trans	-133	60.2	-155.3	-153.7	-167.2	-149.9	-177	15.7	115.6	K87	R85-K87 PolarHBondContact O-N 3.23Å; R85-K87 VanDerWaalsContact O-N 3.16Å
86	A	46.8	Very low	47.4	Very low	107 Å²	107	143.8 Å²	143.8	88%	0.884	78%	0.779	S	S	*	*			trans	-60.2	115.7	167.1	0	0	0	0	0	111.7
87	K	43	Very low	46.8	Very low	167 Å²	167	149 Å²	149	73%	0.726	81%	0.806	S	S	*	*			trans	-123.8	116.1	166.8	-80.9	-168.7	173.6	-167.3	0	110.2	R85	R85-K87 PolarHBondContact O-N 3.23Å; R85-K87 VanDerWaalsContact O-N 3.16Å
88	S	52.1	Low	45.7	Very low	119 Å²	119	153.2 Å²	153.2	83%	0.832	82%	0.822	S	S	*	*			trans	-116.8	133.1	158.8	49.6	0	0	0	0	109
89	N	42	Very low	45.3	Very low	142 Å²	142	150.2 Å²	150.2	76%	0.759	82%	0.824	S	S	*	*			trans	-85.6	150.2	172	-48.5	-53.2	0	0	0	108.7
90	Y	46.5	Very low	45	Very low	228 Å²	228	147.7 Å²	147.7	89%	0.894	83%	0.827	S	S	*	*				-155.3	163.6	129.2	-122.4	-88.1	0	0	0	109.9
91	N	44.1	Very low	44.5	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	83%	0.826	S	S	*	*			trans	-96.1	165.4	-155.4	-63.1	-46.1	0	0	0	115.9
92	D	37.3	Very low	44.4	Very low	159 Å²	159	144.5 Å²	144.5	85%	0.85	82%	0.821	S	S	*	*			trans	-47.2	140.1	165.2	-72.6	-70.6	0	0	0	114.1
93	S	52.7	Low	44.4	Very low	128 Å²	128	145.4 Å²	145.4	90%	0.895	82%	0.816	S	S	*	*			trans	-161.4	136	136.5	-80.6	0	0	0	0	109.4
94	A	35.9	Very low	44.6	Very low	105 Å²	105	147.7 Å²	147.7	87%	0.868	82%	0.821	S	S	*	*			trans	-132.4	131.7	-178.3	0	0	0	0	0	110.9
95	S	45.5	Very low	44.9	Very low	114 Å²	114	143.2 Å²	143.2	80%	0.797	81%	0.814	S	S	*	*			trans	-160	125.6	166.6	57.1	0	0	0	0	112
96	D	41.5	Very low	45.4	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	82%	0.815	S	S	*	*			trans	-15.7	144.2	160.5	-44	-47.1	0	0	0	119
97	L	49.2	Very low	45.8	Very low	172 Å²	172	142.1 Å²	142.1	90%	0.901	82%	0.815	S	S	*	*				-165.7	164.6	114.2	-104.4	163.2	0	0	0	113.3
98	E	42.2	Very low	46.7	Very low	191 Å²	191	140 Å²	140	89%	0.893	82%	0.821	S	S	*	*			trans	-94.9	168.6	-169.9	-54.3	176.2	111.8	0	0	113.8
99	G	43.4	Very low	47	Very low	73 Å²	73	138.5 Å²	138.5	75%	0.753	81%	0.81	S	S	*	*			trans	172	98.3	163.3	0	0	0	0	0	117.7
100	S	43.7	Very low	47.8	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	81%	0.812	S	S	*	*			trans	23.7	128.1	152.1	-59	0	0	0	0	122
101	V	44	Very low	48.2	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	80%	0.803	S	S	*	*			cis	90.2	107.7	45.6	169.7	0	0	0	0	115
102	Q	45.3	Very low	48.5	Very low	161 Å²	161	132.4 Å²	132.4	75%	0.752	80%	0.797	S	S	*	*				178.4	130.3	127.9	-99.8	177.5	43.7	0	0	115.8
103	R	43.7	Very low	48.9	Very low	218 Å²	218	129.1 Å²	129.1	82%	0.823	79%	0.787	S	S	*	*				52.6	150.1	128.5	-69.1	179.1	179.3	-171.5	-1.9	122
104	S	50.5	Low	48.8	Very low	118 Å²	118	131.4 Å²	131.4	83%	0.825	78%	0.781	S	S	*	*			cis	-174	159.4	-5	43.9	0	0	0	0	113.5
105	G	52.3	Low	49	Very low	72 Å²	72	134.5 Å²	134.5	74%	0.742	78%	0.777	S	S	*	*			trans	125.1	110.8	167.5	0	0	0	0	0	112.9
106	A	52	Low	48.7	Very low	93 Å²	93	138.5 Å²	138.5	77%	0.769	78%	0.78	S	S	*	*				86.9	132.1	80.6	0	0	0	0	0	112.3
107	E	55.4	Low	48.9	Very low	187 Å²	187	136.5 Å²	136.5	87%	0.874	78%	0.776	S	S	*	*			cis	-162.9	163.6	2.9	-113.3	173.4	128.9	0	0	111.1
108	S	60.7	Low	48.4	Very low	122 Å²	122	134.4 Å²	134.4	85%	0.853	77%	0.77	S	S	*	*			trans	66.3	141	156.3	-164.7	0	0	0	0	120.2
109	S	60.1	Low	48.7	Very low	87 Å²	87	133.2 Å²	133.2	61%	0.608	77%	0.768	S	S	*	*			cis	-164.3	164.7	-22.9	-165.9	0	0	0	0	110.7
110	D	57.9	Low	48.6	Very low	147 Å²	147	137.6 Å²	137.6	79%	0.786	77%	0.766	S	S	*	*			trans	59.7	138.9	158.5	-59.6	-55.8	0	0	0	121.6
111	D	55.4	Low	48.6	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	77%	0.768	S	S	*	*			cis	-163.4	169.2	-12.2	-178.1	34.7	0	0	0	112
112	T	49.7	Very low	48.6	Very low	104 Å²	104	145 Å²	145	64%	0.638	77%	0.767	S	S	*	*			trans	64.4	84.6	154	27.9	0	0	0	0	123.8
113	S	46.7	Very low	48.4	Very low	90 Å²	90	147.1 Å²	147.1	63%	0.629	77%	0.774	S	S	*	*				97.4	129.6	107.8	-91.7	0	0	0	0	124.9
114	K	49.9	Very low	48.5	Very low	177 Å²	177	140.5 Å²	140.5	77%	0.77	77%	0.774	S	S	*	*			trans	76.6	94.6	146	-63	161.5	-169.5	173.5	0	118
115	Q	40.8	Very low	48.2	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	77%	0.773	S	S	*	*				75.7	118.3	77	-71.5	178.6	-17.6	0	0	114.5
116	F	38.1	Very low	47.8	Very low	197 Å²	197	150.2 Å²	150.2	86%	0.864	78%	0.781	S	S	*	*			cis	85.8	151.9	46.2	-73.2	-51.3	0	0	0	114.2
117	P	46.2	Very low	47.6	Very low	111 Å²	111	149.7 Å²	149.7	72%	0.721	78%	0.784	S	S	*	*			cis	-143.4	-173.4	-39.9	41.9	-24.4	0	0	0	115.4
118	V	39	Very low	47	Very low	128 Å²	128	150 Å²	150	78%	0.776	78%	0.783	S	S	*	*			trans	-68.5	146.6	174.6	173.1	0	0	0	0	114.6
119	I	48.5	Very low	46.3	Very low	167 Å²	167	155.8 Å²	155.8	86%	0.856	79%	0.786	S	S	*	*			trans	-114.8	156.7	165.5	-66.8	-179.3	0	0	0	111.2
120	K	41.7	Very low	45.4	Very low	165 Å²	165	157.3 Å²	157.3	72%	0.717	79%	0.787	S	S	*	*			trans	-116.8	166.9	-159.7	-58.2	171.5	175.1	168.5	0	114.4
121	R	42.5	Very low	44.6	Very low	223 Å²	223	156.6 Å²	156.6	84%	0.842	78%	0.783	S	S	*	*			trans	75.5	158	151.4	-72.2	157.7	176.8	-176.4	-2.5	117.4
122	K	43.8	Very low	44.1	Very low	177 Å²	177	157.6 Å²	157.6	77%	0.77	79%	0.788	S	S	*	*			cis	-173.7	133.2	-20.1	168.4	178.6	174.6	-173.7	0	112.4
123	K	40.7	Very low	43.7	Very low	205 Å²	205	157.6 Å²	157.6	89%	0.891	80%	0.798	S	S	*	*			trans	34.8	127	158.1	-70	-172.3	173.5	-177.5	0	122.1
124	G	45.7	Very low	43.5	Very low	79 Å²	79	156.4 Å²	156.4	81%	0.814	80%	0.8	S	S	*	*			trans	136.8	158.4	136	0	0	0	0	0	116.5
125	K	46	Very low	43	Very low	188 Å²	188	154.3 Å²	154.3	82%	0.817	81%	0.805	S	S	*	*			cis	-168.7	127.9	-17.8	-170.5	180	-174.6	-177.8	0	110.4
126	K	43.2	Very low	43	Very low	206 Å²	206	152.1 Å²	152.1	90%	0.896	81%	0.808	S	S	*	*			trans	54.7	124.3	165.9	-73.7	-175.6	173.5	-172.3	0	119.5
127	G	48.4	Very low	42.9	Very low	82 Å²	82	151.8 Å²	151.8	85%	0.845	81%	0.809	S	S	*	*			trans	-162.7	136.4	155.7	0	0	0	0	0	109.5
128	K	41.8	Very low	42.5	Very low	194 Å²	194	155 Å²	155	84%	0.843	82%	0.819	S	S	*	*			trans	-154.8	117.9	-173.8	-179.8	-172.5	178.8	-175.8	0	112.1
129	R	45.6	Very low	42.3	Very low	243 Å²	243	159.4 Å²	159.4	92%	0.917	82%	0.822	S	S	*	*			trans	-160.5	160.6	147.8	-121.5	170.3	177.3	157	-1.9	111.9
130	N	41.6	Very low	41.7	Very low	119 Å²	119	158 Å²	158	64%	0.636	83%	0.826	S	S	*	*			trans	-80	-171	-172.2	-42.1	-11.9	0	0	0	110.3
131	D	41	Very low	41.4	Very low	131 Å²	131	155 Å²	155	70%	0.701	82%	0.821	S	S	*	*			cis	-165	169.8	32.9	-119.8	-41.9	0	0	0	115.1
132	L	45.1	Very low	41.2	Very low	154 Å²	154	152.9 Å²	152.9	81%	0.806	83%	0.826	S	S	*	*			trans	68.4	126.4	152.3	-78	159.6	0	0	0	124
133	A	41.7	Very low	41.2	Very low	104 Å²	104	151.6 Å²	151.6	86%	0.86	83%	0.825	S	S	*	*			trans	60	151.1	153.6	0	0	0	0	0	119.5
134	G	42.6	Very low	41.2	Very low	65 Å²	65	149.4 Å²	149.4	67%	0.67	82%	0.824	S	S	*	*			cis	-165.9	160.7	-6.2	0	0	0	0	0	109.7
135	P	38.3	Very low	41	Very low	133 Å²	133	149.3 Å²	149.3	86%	0.864	82%	0.822	S	S	*	*			trans	-79.8	148.3	-165	31.6	-36	0	0	0	114.3
136	S	40.8	Very low	41.1	Very low	124 Å²	124	146.3 Å²	146.3	87%	0.867	82%	0.822	S	S	*	*			trans	-150.9	156	166.3	-83	0	0	0	0	111.8
137	Q	37	Very low	41.4	Very low	190 Å²	190	145.9 Å²	145.9	89%	0.888	83%	0.826	S	S	*	*			trans	-74.9	140	-167.2	-57.9	167	5.2	0	0	112
138	L	36.8	Very low	40.9	Very low	178 Å²	178	146.6 Å²	146.6	93%	0.932	82%	0.823	S	S	*	*			trans	-127.4	135.2	159.1	-82.3	175.5	0	0	0	110.9
139	R	36.5	Very low	41.2	Very low	221 Å²	221	142.2 Å²	142.2	83%	0.834	82%	0.824	S	S	*	*			trans	-119.3	101.2	-164.8	-179.6	-172.2	-169.9	-178	4.1	107.9	T141	R139-T141 PolarHBondContact O-N 3.13Å
140	C	35.7	Very low	41	Very low	137 Å²	137	139 Å²	139	93%	0.926	82%	0.819	S	S	*	*			trans	-74.7	87	-178.6	-67.9	0	0	0	0	111.7
141	T	35.7	Very low	41	Very low	101 Å²	101	141 Å²	141	62%	0.62	83%	0.828	S	S	*	*			trans	-80.6	114.1	156.8	47.3	0	0	0	0	108.9	R139	R139-T141 PolarHBondContact O-N 3.13Å
142	L	38	Very low	41.2	Very low	180 Å²	180	138.1 Å²	138.1	94%	0.942	83%	0.829	S	S	*	*			trans	-87	144.4	159.4	-141.1	77.8	0	0	0	108.3
143	I	42.3	Very low	40.9	Very low	149 Å²	149	138.6 Å²	138.6	76%	0.764	83%	0.833	S	S	*	*			trans	-112	133.4	-166.4	-67.4	171	0	0	0	109.8
144	D	40.4	Very low	41.1	Very low	160 Å²	160	138.6 Å²	138.6	86%	0.856	83%	0.826	S	S	*	*			trans	-70.2	134.8	169.3	-69.5	-60.2	0	0	0	111
145	G	42.9	Very low	41	Very low	76 Å²	76	143.6 Å²	143.6	78%	0.784	83%	0.832	S	S	*	*			trans	-116.8	110.9	176	0	0	0	0	0	111.5
146	P	47.2	Very low	41	Very low	125 Å²	125	143.3 Å²	143.3	81%	0.812	83%	0.832	S	S	*	*			trans	-82.4	132.9	174.2	32.1	-32	0	0	0	111.1
147	M	49.7	Very low	40.8	Very low	197 Å²	197	144.1 Å²	144.1	97%	0.97	83%	0.826	S	S	*	*			trans	-89.6	113.4	162.2	-90.1	-72.9	-176.7	0	0	108.9
148	A	39.2	Very low	40.8	Very low	97 Å²	97	143.5 Å²	143.5	80%	0.802	83%	0.828	S	S	*	*			trans	-104.8	137	165.6	0	0	0	0	0	108.9
149	A	47.6	Very low	41.2	Very low	103 Å²	103	144.6 Å²	144.6	85%	0.851	83%	0.825	S	S	*	*			trans	-130	153.6	171.7	0	0	0	0	0	108.7
150	E	40.4	Very low	41.2	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	82%	0.822	S	S	*	*			trans	-97.1	148.3	-151	-69.1	-177.2	124.3	0	0	116
151	I	43.1	Very low	42	Very low	161 Å²	161	140.3 Å²	140.3	83%	0.826	82%	0.815	S	S	*	*			trans	57.2	123.8	140.7	-62.2	164.1	0	0	0	118.4
152	G	43.3	Very low	42.2	Very low	70 Å²	70	143.4 Å²	143.4	72%	0.722	83%	0.827	S	S	*	*			trans	-173.9	39	174.7	0	0	0	0	0	116.1	S154	G152-S154 PolarHBondContact O-N 3.04Å
153	D	40.1	Very low	42.3	Very low	165 Å²	165	138.2 Å²	138.2	88%	0.882	82%	0.818	S	S	*	*			trans	-65.7	126.9	179.9	-88.4	-46.1	0	0	0	113.1
154	S	45	Very low	42.2	Very low	104 Å²	104	140.5 Å²	140.5	73%	0.727	82%	0.823	S	S	*	*			trans	-152.6	108.7	161.4	47.1	0	0	0	0	111.9	G152	G152-S154 PolarHBondContact O-N 3.04Å
155	H	40.7	Very low	42.3	Very low	169 Å²	169	139 Å²	139	78%	0.782	82%	0.82	S	S	*	*			trans	-85.4	122.4	178.1	-111.1	-86	0	0	0	111.4
156	C	38.9	Very low	42.3	Very low	127 Å²	127	139.5 Å²	139.5	86%	0.858	82%	0.824	S	S	*	*			trans	-105.7	78.9	175.1	-66.1	0	0	0	0	111.8
157	N	35.8	Very low	42	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	82%	0.822	S	S	*	*			trans	-87	113.2	169.3	-83.2	-48.7	0	0	0	110.4
158	L	38.4	Very low	41.6	Very low	177 Å²	177	139.2 Å²	139.2	93%	0.927	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-100.6	137.4	172.2	-142.7	75.6	0	0	0	111.3
159	K	43.4	Very low	41.6	Very low	200 Å²	200	139.9 Å²	139.9	87%	0.87	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-83.9	143.5	-170.6	-87.2	175.8	172.2	173	0	113.7
160	I	36.9	Very low	41.3	Very low	150 Å²	150	140.9 Å²	140.9	77%	0.769	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-85.1	136	160.7	-59.8	165.2	0	0	0	109.5
161	P	53.8	Low	41.2	Very low	119 Å²	119	137.9 Å²	137.9	77%	0.773	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-103.2	133.3	155	34.2	-26.1	0	0	0	111.4
162	N	39.1	Very low	41.1	Very low	165 Å²	165	135.2 Å²	135.2	88%	0.882	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.7	148.9	175.1	-72.2	-29.1	0	0	0	111.8
163	G	40.5	Very low	40.9	Very low	72 Å²	72	137 Å²	137	74%	0.742	81%	0.813	S	S	*	*			trans	-172	110.7	171.4	0	0	0	0	0	116.6
164	F	39.9	Very low	40.8	Very low	197 Å²	197	135.3 Å²	135.3	86%	0.864	81%	0.811	S	S	*	*			trans	54.9	94.6	151.9	-81.7	-98.4	0	0	0	121.6
165	T	43.2	Very low	40.6	Very low	129 Å²	129	137.1 Å²	137.1	79%	0.791	82%	0.818	S	S	*	*				23	126.4	121.2	59.1	0	0	0	0	120.1
166	G	42.3	Very low	40.4	Very low	85 Å²	85	136.3 Å²	136.3	88%	0.876	81%	0.812	S	S	*	*			trans	-174.1	92.4	163.1	0	0	0	0	0	113.7
167	S	40.1	Very low	40.1	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	82%	0.816	S	S	*	*			trans	-87.7	134.6	-177.8	60.4	0	0	0	0	113.9
168	K	42.9	Very low	40.1	Very low	208 Å²	208	137.2 Å²	137.2	90%	0.904	81%	0.813	S	S	*	*				-175.7	160.7	124	-102.1	163.3	-174.6	178.8	0	113.3
169	S	38.5	Very low	40.1	Very low	110 Å²	110	136.6 Å²	136.6	77%	0.769	81%	0.805	S	S	*	*			trans	-99.3	143.9	-174.3	53.6	0	0	0	0	113.5
170	S	40.5	Very low	39.6	Very low	125 Å²	125	133 Å²	133	87%	0.874	80%	0.795	S	S	*	*			trans	-170.4	165.1	133.6	48.2	0	0	0	0	111.7
171	S	39.8	Very low	39.3	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	80%	0.803	S	S	*	*			trans	-87.3	147.2	-174.2	54.1	0	0	0	0	114
172	S	41.2	Very low	38.6	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	80%	0.799	S	S	*	*				176.9	143.5	113.7	55.3	0	0	0	0	113.8
173	S	38.3	Very low	38.5	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	80%	0.8	S	S	*	*			trans	62.6	141.1	155.2	-58.6	0	0	0	0	120.3
174	P	37.8	Very low	38.3	Very low	131 Å²	131	139.5 Å²	139.5	85%	0.851	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-81.6	134.2	176.7	33	-33.6	0	0	0	112.1
175	V	40.3	Very low	38.2	Very low	142 Å²	142	136.3 Å²	136.3	86%	0.861	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-89.5	141.9	168.9	177.7	0	0	0	0	109.5
176	K	36.5	Very low	38.1	Very low	152 Å²	152	133.3 Å²	133.3	66%	0.661	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-63.2	138	178.6	-65.8	170.7	154.5	-161.7	0	112.1	E178	K176-E178 HydrophobicContact CB-CB 4.4Å; K176-E178 WeakPolarHBondContact CD-OE2 3.22Å; K176-E178 WeakPolarHBondContact CE-OE2 3.46Å; K176-E178 IonicContact NZ-OE1 3.52Å; K176-E178 IonicContact NZ-OE2 2.67Å; K176-E178 PolarHBondContact NZ-OE2 3.11Å
177	C	33	Very low	37.7	Very low	138 Å²	138	139.9 Å²	139.9	93%	0.932	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-96.5	118.5	144.3	-71.6	0	0	0	0	107.7
178	E	35.4	Very low	37.7	Very low	149 Å²	149	139.3 Å²	139.3	70%	0.696	77%	0.766	S	S	*	*			trans	-134.8	85.1	-175.6	-176.8	163.3	-145.1	0	0	108.8	K176	K176-E178 HydrophobicContact CB-CB 4.4Å; K176-E178 WeakPolarHBondContact CD-OE2 3.22Å; K176-E178 WeakPolarHBondContact CE-OE2 3.46Å; K176-E178 IonicContact NZ-OE1 3.52Å; K176-E178 IonicContact NZ-OE2 2.67Å; K176-E178 PolarHBondContact NZ-OE2 3.11Å
179	E	38.4	Very low	37.4	Very low	165 Å²	165	133.2 Å²	133.2	77%	0.771	75%	0.749	S	S	*	*			trans	-146.2	150	179	-142.2	-169	124.2	0	0	112.2
180	N	33.8	Very low	37.6	Very low	124 Å²	124	133 Å²	133	66%	0.663	74%	0.739	S	S	*	*			trans	61.6	48.5	168.3	-59.9	-51.3	0	0	0	117.7	T182	N180-T182 PolarHBondContact O-N 3.1Å
181	R	30.5	Very low	37.5	Very low	247 Å²	247	131 Å²	131	93%	0.932	72%	0.722	S	S	*	*			trans	-90.1	58.2	169.1	-163.3	-178	-173.9	172.2	2.3	112.6
182	T	38.6	Very low	37.4	Very low	113 Å²	113	128.3 Å²	128.3	69%	0.693	71%	0.706	S	S	*	*			trans	-140.9	50.8	-172.6	41.6	0	0	0	0	113.4	N180	N180-T182 PolarHBondContact O-N 3.1Å
183	K	38.1	Very low	37.3	Very low	205 Å²	205	126.7 Å²	126.7	89%	0.891	70%	0.695	S	S	*	*			trans	-138.8	20.5	178	-75.8	-165.2	174	-177.5	0	115.7
184	A	36	Very low	37.3	Very low	77 Å²	77	126 Å²	126	64%	0.636	68%	0.682	S	S	*	*	S	Bend	trans	-96.2	-40.5	178.9	0	0	0	0	0	113.3	A186	A184-A186 PolarHBondContact O-N 3.31Å
185	D	37.1	Very low	37.2	Very low	131 Å²	131	124.8 Å²	124.8	70%	0.701	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	4	-160.2	-45.6	-77.6	0	0	0	114.9	T188	D185-T188 PolarHBondContact O-OG1 3.32Å; D185-T188 VanDerWaalsContact O-OG1 3.12Å
186	A	40.6	Very low	37.3	Very low	66 Å²	66	124.6 Å²	124.6	55%	0.545	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.8	-34	179.6	0	0	0	0	0	113.1	A184 T188 S189	A184-A186 PolarHBondContact O-N 3.31Å; A186-T188 VanDerWaalsContact C-N 3.34Å; A186-T188 PolarHBondContact O-N 3.48Å; A186-S189 PolarHBondContact O-N 3.13Å
187	W	34.9	Very low	37.6	Very low	223 Å²	223	123.1 Å²	123.1	85%	0.845	66%	0.658	S	S	*	*	H	α-helix	trans	-78	-17	-172.9	-79.5	26.6	0	0	0	113.9	V191	W187-V191 WeakPolarHBondContact O-CG2 3.33Å
188	T	39.3	Very low	37.9	Very low	97 Å²	97	123.4 Å²	123.4	60%	0.595	64%	0.641	S	S	*	*	H	α-helix	trans	-76.9	-22.3	175.3	37.5	0	0	0	0	113.5	D185 A186 A192	D185-T188 PolarHBondContact O-OG1 3.32Å; D185-T188 VanDerWaalsContact O-OG1 3.12Å; A186-T188 VanDerWaalsContact C-N 3.34Å; A186-T188 PolarHBondContact O-N 3.48Å; T188-A192 PolarHBondContact O-N 3.45Å
189	S	36.3	Very low	38	Very low	79 Å²	79	118.8 Å²	118.8	55%	0.552	63%	0.625	S	S	*	*	H	α-helix	trans	-72	-46.6	179.4	-167.8	0	0	0	0	111.9	A186 V191 A192 S193	A186-S189 PolarHBondContact O-N 3.13Å; S189-V191 PolarHBondContact O-N 2.77Å; S189-A192 WeakPolarHBondContact O-CB 3.38Å; S189-A192 PolarHBondContact O-N 3.44Å; S189-S193 PolarHBondContact O-N 3.28Å
190	D	44.3	Very low	38	Very low	106 Å²	106	116.1 Å²	116.1	57%	0.567	62%	0.623	S	S	*	*	H	α-helix	trans	-67.1	-38.4	-179.9	-68.9	-15.4	0	0	0	111.5	A192 S193 I194	D190-A192 VanDerWaalsContact C-N 3.28Å; D190-A192 PolarHBondContact O-N 3.04Å; D190-S193 PolarHBondContact O-N 3.13Å; D190-S193 VanDerWaalsContact O-N 3.17Å; D190-I194 WeakPolarHBondContact O-CB 3.47Å; D190-I194 WeakPolarHBondContact O-CD1 3.5Å; D190-I194 VanDerWaalsContact O-CG1 3.22Å; D190-I194 WeakPolarHBondContact O-CG1 3.47Å; D190-I194 PolarHBondContact O-N 2.99Å
191	V	38	Very low	38.2	Very low	84 Å²	84	112.8 Å²	112.8	51%	0.509	61%	0.605	S	S	.	*	H	α-helix	trans	-60.7	-37.9	173.8	174.1	0	0	0	0	111.4	W187 S189 L195	W187-V191 WeakPolarHBondContact O-CG2 3.33Å; S189-V191 PolarHBondContact O-N 2.77Å; V191-L195 HydrophobicContact CG1-CD1 3.93Å; V191-L195 HydrophobicContact CG1-CG 4.5Å; V191-L195 WeakPolarHBondContact O-CB 3.33Å; V191-L195 WeakPolarHBondContact O-CD1 3.33Å; V191-L195 WeakPolarHBondContact O-CG 3.28Å; V191-L195 PolarHBondContact O-N 2.81Å
192	A	37.8	Very low	38.6	Very low	54 Å²	54	105.4 Å²	105.4	45%	0.446	58%	0.584	S	S	.	*	H	α-helix	trans	-68.5	-38.9	174.8	0	0	0	0	0	112.5	T188 S189 D190 L195 M196	T188-A192 PolarHBondContact O-N 3.45Å; S189-A192 WeakPolarHBondContact O-CB 3.38Å; S189-A192 PolarHBondContact O-N 3.44Å; D190-A192 VanDerWaalsContact C-N 3.28Å; D190-A192 PolarHBondContact O-N 3.04Å; A192-L195 PolarHBondContact O-N 3.26Å; A192-M196 WeakPolarHBondContact O-CG 3.5Å; A192-M196 PolarHBondContact O-N 2.95Å
193	S	38.5	Very low	38.5	Very low	71 Å²	71	105.3 Å²	105.3	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-66.8	-44.3	175.8	-160.5	0	0	0	0	111.9	S189 D190 L195 M196 D197	S189-S193 PolarHBondContact O-N 3.28Å; D190-S193 PolarHBondContact O-N 3.13Å; D190-S193 VanDerWaalsContact O-N 3.17Å; S193-L195 VanDerWaalsContact C-N 3.34Å; S193-L195 PolarHBondContact O-N 3.33Å; S193-M196 WeakPolarHBondContact O-CB 3.45Å; S193-M196 PolarHBondContact O-N 3.1Å; S193-M196 VanDerWaalsContact O-N 3.08Å; S193-D197 PolarHBondContact O-N 2.88Å
194	I	38.2	Very low	38.6	Very low	92 Å²	92	99.2 Å²	99.2	47%	0.472	56%	0.562	S	S	.	*	H	α-helix	trans	-61.8	-42.5	176.4	-69	163.8	0	0	0	110.4	D190 M196 D197 Y198	D190-I194 WeakPolarHBondContact O-CB 3.47Å; D190-I194 WeakPolarHBondContact O-CD1 3.5Å; D190-I194 VanDerWaalsContact O-CG1 3.22Å; D190-I194 WeakPolarHBondContact O-CG1 3.47Å; D190-I194 PolarHBondContact O-N 2.99Å; I194-M196 VanDerWaalsContact C-N 3.28Å; I194-M196 PolarHBondContact O-N 3.08Å; I194-D197 PolarHBondContact O-N 2.86Å; I194-Y198 HydrophobicContact CG2-CD2 3.75Å; I194-Y198 HydrophobicContact CG2-CE2 3.7Å; I194-Y198 VanDerWaalsContact O-CD2 3.23Å; I194-Y198 WeakPolarHBondContact O-CD2 3.49Å; I194-Y198 PolarHBondContact O-N 3.34Å
195	L	34.9	Very low	38.3	Very low	105 Å²	105	100.1 Å²	100.1	55%	0.55	56%	0.555	S	S	.	*	H	α-helix	trans	-66	-27.2	174.5	-74.8	169.2	0	0	0	113.3	V191 A192 S193 S199	V191-L195 HydrophobicContact CG1-CD1 3.93Å; V191-L195 HydrophobicContact CG1-CG 4.5Å; V191-L195 WeakPolarHBondContact O-CB 3.33Å; V191-L195 WeakPolarHBondContact O-CD1 3.33Å; V191-L195 WeakPolarHBondContact O-CG 3.28Å; V191-L195 PolarHBondContact O-N 2.81Å; A192-L195 PolarHBondContact O-N 3.26Å; S193-L195 VanDerWaalsContact C-N 3.34Å; S193-L195 PolarHBondContact O-N 3.33Å; L195-S199 PolarHBondContact O-N 3.26Å; L195-S199 PolarHBondContact O-OG 3.18Å
196	M	43.5	Very low	38.1	Very low	139 Å²	139	97 Å²	97	69%	0.685	54%	0.544	S	S	*	.	H	α-helix	trans	-72	-40.7	172.1	-76.1	-69.1	176.4	0	0	112	A192 S193 I194 S199	A192-M196 WeakPolarHBondContact O-CG 3.5Å; A192-M196 PolarHBondContact O-N 2.95Å; S193-M196 WeakPolarHBondContact O-CB 3.45Å; S193-M196 PolarHBondContact O-N 3.1Å; S193-M196 VanDerWaalsContact O-N 3.08Å; I194-M196 VanDerWaalsContact C-N 3.28Å; I194-M196 PolarHBondContact O-N 3.08Å; M196-S199 WeakPolarHBondContact O-CB 3.49Å; M196-S199 PolarHBondContact O-N 3.34Å
197	D	43.1	Very low	37.7	Very low	121 Å²	121	98.9 Å²	98.9	65%	0.647	55%	0.551	S	S	*	*	H	α-helix	trans	-64.2	-41.3	172.7	-73.3	-36.1	0	0	0	111.5	S193 I194 S199 C200	S193-D197 PolarHBondContact O-N 2.88Å; I194-D197 PolarHBondContact O-N 2.86Å; D197-S199 PolarHBondContact O-N 3.11Å; D197-C200 PolarHBondContact O-N 2.72Å
198	Y	38.1	Very low	37.7	Very low	143 Å²	143	95 Å²	95	56%	0.561	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-65.3	-14.7	170.6	-80.8	-67.1	0	0	0	114	I194 C200 L201 L202	I194-Y198 HydrophobicContact CG2-CD2 3.75Å; I194-Y198 HydrophobicContact CG2-CE2 3.7Å; I194-Y198 VanDerWaalsContact O-CD2 3.23Å; I194-Y198 WeakPolarHBondContact O-CD2 3.49Å; I194-Y198 PolarHBondContact O-N 3.34Å; Y198-C200 PolarHBondContact O-N 3.41Å; Y198-L201 HydrophobicContact CD1-CD1 3.87Å; Y198-L201 HydrophobicContact CE1-CD1 4.08Å; Y198-L201 WeakPolarHBondContact O-CA 3.32Å; Y198-L201 PolarHBondContact O-N 3.29Å; Y198-L202 PolarHBondContact O-N 3.24Å
199	S	37.7	Very low	37.6	Very low	53 Å²	53	101.3 Å²	101.3	37%	0.371	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-67.8	-21.7	177	-64.9	0	0	0	0	112.7	L195 M196 D197 L201	L195-S199 PolarHBondContact O-N 3.26Å; L195-S199 PolarHBondContact O-OG 3.18Å; M196-S199 WeakPolarHBondContact O-CB 3.49Å; M196-S199 PolarHBondContact O-N 3.34Å; D197-S199 PolarHBondContact O-N 3.11Å; S199-L201 PolarHBondContact O-N 3.08Å
200	C	39.4	Very low	37.6	Very low	108 Å²	108	103.5 Å²	103.5	73%	0.73	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-69.3	-18.8	168.6	-67.2	0	0	0	0	113.5	D197 Y198	D197-C200 PolarHBondContact O-N 2.72Å; Y198-C200 PolarHBondContact O-N 3.41Å
201	L	37.9	Very low	37.2	Very low	54 Å²	54	106.9 Å²	106.9	28%	0.283	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-103.2	-3.8	-179.3	-62	175.8	0	0	0	113.4	Y198 S199 P203 L204	Y198-L201 HydrophobicContact CD1-CD1 3.87Å; Y198-L201 HydrophobicContact CE1-CD1 4.08Å; Y198-L201 WeakPolarHBondContact O-CA 3.32Å; Y198-L201 PolarHBondContact O-N 3.29Å; S199-L201 PolarHBondContact O-N 3.08Å; L201-P203 VanDerWaalsContact C-N 3.27Å; L201-P203 VanDerWaalsContact O-N 3.17Å; L201-L204 HydrophobicContact CD2-CD1 4.06Å; L201-L204 WeakPolarHBondContact O-CB 3.29Å; L201-L204 PolarHBondContact O-N 3.21Å
202	L	38.1	Very low	37.3	Very low	93 Å²	93	107.8 Å²	107.8	49%	0.487	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-51.2	-32.7	173.8	-76.9	168.6	0	0	0	115	Y198 L204 L205	Y198-L202 PolarHBondContact O-N 3.24Å; L202-L204 PolarHBondContact O-N 3.36Å; L202-L204 VanDerWaalsContact O-N 3.11Å; L202-L205 PolarHBondContact O-N 2.92Å
203	P	37.2	Very low	37.2	Very low	111 Å²	111	110.2 Å²	110.2	72%	0.721	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-62.8	-12.5	173.5	-25.3	36.5	0	0	0	115.4	L201	L201-P203 VanDerWaalsContact C-N 3.27Å; L201-P203 VanDerWaalsContact O-N 3.17Å
204	L	38.7	Very low	37.2	Very low	77 Å²	77	112.6 Å²	112.6	40%	0.403	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-98.9	-10.4	178.5	-59.2	175.1	0	0	0	113.4	L201 L202 Y555	L201-L204 HydrophobicContact CD2-CD1 4.06Å; L201-L204 WeakPolarHBondContact O-CB 3.29Å; L201-L204 PolarHBondContact O-N 3.21Å; L202-L204 PolarHBondContact O-N 3.36Å; L202-L204 VanDerWaalsContact O-N 3.11Å; L204-Y555 HydrophobicContact CD2-CD1 4.39Å; L204-Y555 HydrophobicContact CD2-CE1 3.73Å
205	L	31	Very low	37.2	Very low	95 Å²	95	120.2 Å²	120.2	50%	0.497	64%	0.641	S	S	.	*	S	Bend	trans	-137.4	93.7	-174.7	-67.1	174.6	0	0	0	110	L202 P207	L202-L205 PolarHBondContact O-N 2.92Å; L205-P207 WeakPolarHBondContact O-CD 3.47Å
206	S	31.8	Very low	37.4	Very low	65 Å²	65	123.4 Å²	123.4	46%	0.455	65%	0.653	S	S	.	*			trans	-62.7	120.6	-178.9	-77.3	0	0	0	0	112	I208	S206-I208 PolarHBondContact O-N 3.26Å; S206-I208 VanDerWaalsContact O-N 3.14Å
207	P	33.7	Very low	36.9	Very low	107 Å²	107	127.6 Å²	127.6	70%	0.695	66%	0.662	S	S	*	*			trans	-77.8	103.1	-177.7	30	-34	0	0	0	111.4	L205 R209	L205-P207 WeakPolarHBondContact O-CD 3.47Å; P207-R209 PolarHBondContact O-N 2.62Å; P207-R209 VanDerWaalsContact O-N 3.08Å
208	I	33.7	Very low	36.5	Very low	141 Å²	141	126.8 Å²	126.8	72%	0.723	67%	0.665	S	S	*	*			trans	-63.7	108.4	168.1	-60.6	173.3	0	0	0	108.3	S206 P210	S206-I208 PolarHBondContact O-N 3.26Å; S206-I208 VanDerWaalsContact O-N 3.14Å; I208-P210 VanDerWaalsContact O-CD 3.24Å; I208-P210 WeakPolarHBondContact O-CD 3.19Å
209	R	37.1	Very low	36.4	Very low	230 Å²	230	125.3 Å²	125.3	87%	0.868	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-63.5	119.3	172.4	-80.3	-179.5	170.3	167.3	-3.2	110.5	P207	P207-R209 PolarHBondContact O-N 2.62Å; P207-R209 VanDerWaalsContact O-N 3.08Å
210	P	37.4	Very low	36.7	Very low	125 Å²	125	128.7 Å²	128.7	81%	0.812	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-76.5	126.5	161.9	-4	23.3	0	0	0	108.4	I208	I208-P210 VanDerWaalsContact O-CD 3.24Å; I208-P210 WeakPolarHBondContact O-CD 3.19Å
211	Q	35.6	Very low	36.7	Very low	177 Å²	177	127.7 Å²	127.7	83%	0.827	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-85.2	144.7	164	-68.8	-170.3	0.5	0	0	109.8
212	S	39.1	Very low	36.7	Very low	103 Å²	103	130.1 Å²	130.1	72%	0.72	71%	0.71	S	S	*	*	S	Bend	trans	48.9	91.9	164.2	56.7	0	0	0	0	118.6
213	S	36.9	Very low	36.5	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	73%	0.727	S	S	*	*				58.7	141.5	127.9	57.7	0	0	0	0	122.8
214	T	37.1	Very low	36.5	Very low	122 Å²	122	133.5 Å²	133.5	75%	0.748	73%	0.727	S	S	*	*			trans	58.6	98.1	158.3	49.6	0	0	0	0	118.6
215	W	38.2	Very low	36.4	Very low	251 Å²	251	134 Å²	134	95%	0.951	74%	0.736	S	S	*	*			trans	-150.7	167.7	132.1	-90.1	108.1	0	0	0	109.9
216	H	40.3	Very low	36.6	Very low	172 Å²	172	139.1 Å²	139.1	80%	0.796	75%	0.748	S	S	*	*			trans	-86.6	159.2	-162	-77.7	-101.7	0	0	0	115.7
217	Y	32.5	Very low	36.8	Very low	227 Å²	227	142 Å²	142	89%	0.89	76%	0.758	S	S	*	*			trans	-58.3	133.6	174.6	-127.3	-103.2	0	0	0	112.6
218	C	35	Very low	37.2	Very low	105 Å²	105	139 Å²	139	71%	0.709	74%	0.737	S	S	*	*			trans	-141.4	105.3	167	-170.6	0	0	0	0	110.4	T220	C218-T220 PolarHBondContact O-N 3.34Å
219	P	36.6	Very low	37.7	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	70.3	-168	35.1	-36.2	0	0	0	112.6
220	T	44.4	Very low	38.1	Very low	123 Å²	123	131.8 Å²	131.8	76%	0.755	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.7	10.7	173.6	-13.7	0	0	0	0	116.1	C218	C218-T220 PolarHBondContact O-N 3.34Å
221	A	38.6	Very low	38.4	Very low	88 Å²	88	129.9 Å²	129.9	73%	0.727	70%	0.699	S	S	*	*			trans	-86.5	122.1	173.7	0	0	0	0	0	110.5
222	P	37.8	Very low	38.8	Very low	104 Å²	104	125.6 Å²	125.6	68%	0.675	68%	0.68	S	S	*	*			trans	-66.4	140.8	170.8	28.7	-33.6	0	0	0	109.7	L224	P222-L224 PolarHBondContact O-N 2.64Å
223	V	34.7	Very low	38.9	Very low	137 Å²	137	126.4 Å²	126.4	83%	0.83	68%	0.683	S	S	*	*			trans	-66.9	98.5	177.2	-178.1	0	0	0	0	109	C225	V223-C225 PolarHBondContact O-N 2.72Å
224	L	36.9	Very low	39.4	Very low	139 Å²	139	127.9 Å²	127.9	73%	0.728	67%	0.673	S	S	*	*			trans	-71.1	108.1	174.4	-108.3	144.1	0	0	0	108.8	P222 R226	P222-L224 PolarHBondContact O-N 2.64Å; L224-R226 PolarHBondContact O-N 3.29Å
225	C	35.8	Very low	39.6	Very low	88 Å²	88	125.1 Å²	125.1	60%	0.595	65%	0.653	S	S	*	*			trans	-62.4	83.6	161.7	-61.5	0	0	0	0	108.8	V223 L227	V223-C225 PolarHBondContact O-N 2.72Å; C225-L227 VanDerWaalsContact C-N 3.28Å; C225-L227 PolarHBondContact O-N 3.35Å
226	R	36.3	Very low	39.9	Very low	201 Å²	201	113.4 Å²	113.4	76%	0.758	61%	0.609	S	S	*	*			trans	-67.4	91.3	169.3	-86.9	-174.5	163	177.2	-5.4	108.1	L224 D228	L224-R226 PolarHBondContact O-N 3.29Å; R226-D228 PolarHBondContact O-N 3.21Å
227	L	35.8	Very low	40.5	Very low	126 Å²	126	109.5 Å²	109.5	66%	0.66	60%	0.602	S	S	*	*			trans	-50.4	106	150.4	-98.7	154.2	0	0	0	106.8	C225 L229	C225-L227 VanDerWaalsContact C-N 3.28Å; C225-L227 PolarHBondContact O-N 3.35Å; L227-L229 PolarHBondContact O-N 3.49Å
228	D	41	Very low	41.2	Very low	45 Å²	45	100.7 Å²	100.7	24%	0.241	57%	0.572	C	S	.	*			trans	-73.1	90	175	-175.2	7.5	0	0	0	108.5	R226 N230 L231	R226-D228 PolarHBondContact O-N 3.21Å; D228-N230 PolarHBondContact O-N 3.26Å; D228-N230 VanDerWaalsContact OD1-CB 3.31Å; D228-N230 WeakPolarHBondContact OD1-CB 3.46Å; D228-N230 PolarHBondContact OD1-N 3.49Å; D228-N230 VanDerWaalsContact OD1-N 3.09Å; D228-N230 PolarHBondContact OD1-ND2 3Å; D228-L231 HydrophobicContact CB-CD1 3.96Å; D228-L231 HydrophobicContact CB-CG 4.02Å; D228-L231 WeakPolarHBondContact O-CB 3.26Å; D228-L231 PolarHBondContact O-N 3.13Å
229	L	44.4	Very low	41.6	Very low	81 Å²	81	97.1 Å²	97.1	42%	0.424	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-57.9	-15.6	179	-74	-175.7	0	0	0	113	L227 L231 I232 L235	L227-L229 PolarHBondContact O-N 3.49Å; L229-L231 VanDerWaalsContact C-N 3.34Å; L229-I232 HydrophobicContact CD2-CD1 4.14Å; L229-I232 PolarHBondContact O-N 2.92Å; L229-L235 HydrophobicContact CB-CD1 3.49Å; L229-L235 VanDerWaalsContact CB-CD1 3.49Å; L229-L235 HydrophobicContact CD1-CD1 4.18Å; L229-L235 HydrophobicContact CD2-CD1 3.94Å; L229-L235 HydrophobicContact CG-CD1 4.05Å; L229-L235 VanDerWaalsContact O-CD1 3.31Å; L229-L235 WeakPolarHBondContact O-CD1 3.47Å
230	N	44.9	Very low	42.4	Very low	138 Å²	138	97.8 Å²	97.8	74%	0.738	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-76.3	-20.1	173.3	-52.6	-77.4	0	0	0	113	D228 I232	D228-N230 PolarHBondContact O-N 3.26Å; D228-N230 VanDerWaalsContact OD1-CB 3.31Å; D228-N230 WeakPolarHBondContact OD1-CB 3.46Å; D228-N230 PolarHBondContact OD1-N 3.49Å; D228-N230 VanDerWaalsContact OD1-N 3.09Å; D228-N230 PolarHBondContact OD1-ND2 3Å; N230-I232 PolarHBondContact O-N 3.48Å
231	L	44.5	Very low	42.9	Very low	85 Å²	85	94.8 Å²	94.8	45%	0.445	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-72	-12.4	170.4	-60.6	175.9	0	0	0	112.3	D228 L229 P233	D228-L231 HydrophobicContact CB-CD1 3.96Å; D228-L231 HydrophobicContact CB-CG 4.02Å; D228-L231 WeakPolarHBondContact O-CB 3.26Å; D228-L231 PolarHBondContact O-N 3.13Å; L229-L231 VanDerWaalsContact C-N 3.34Å; L231-P233 WeakPolarHBondContact O-CD 3.45Å
232	I	45	Very low	43.4	Very low	86 Å²	86	95.6 Å²	95.6	44%	0.441	51%	0.514	S	S	.	.	S	Bend	trans	-94.5	101.6	167.8	-54.4	177.1	0	0	0	107.2	L229 N230 R234 L235	L229-I232 HydrophobicContact CD2-CD1 4.14Å; L229-I232 PolarHBondContact O-N 2.92Å; N230-I232 PolarHBondContact O-N 3.48Å; I232-R234 PolarHBondContact O-N 2.95Å; I232-L235 HydrophobicContact CG2-CG 4.42Å
233	P	39.3	Very low	44	Very low	121 Å²	121	92.2 Å²	92.2	79%	0.786	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-6.3	-159.5	-26	36.6	0	0	0	117.1	L231	L231-P233 WeakPolarHBondContact O-CD 3.45Å
234	R	48.3	Very low	45.3	Very low	135 Å²	135	89.2 Å²	89.2	51%	0.509	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.1	74.2	-176	-63	-172.5	-174.5	166.2	6.1	113	I232	I232-R234 PolarHBondContact O-N 2.95Å
235	L	41.7	Very low	46.4	Very low	63 Å²	63	88.9 Å²	88.9	33%	0.33	47%	0.471	S	S	.	.			trans	-74.3	132.9	164.8	-78.7	156.3	0	0	0	111.2	L229 I232 I239	L229-L235 HydrophobicContact CB-CD1 3.49Å; L229-L235 VanDerWaalsContact CB-CD1 3.49Å; L229-L235 HydrophobicContact CD1-CD1 4.18Å; L229-L235 HydrophobicContact CD2-CD1 3.94Å; L229-L235 HydrophobicContact CG-CD1 4.05Å; L229-L235 VanDerWaalsContact O-CD1 3.31Å; L229-L235 WeakPolarHBondContact O-CD1 3.47Å; I232-L235 HydrophobicContact CG2-CG 4.42Å; L235-I239 HydrophobicContact CD2-CD1 3.87Å; L235-I239 HydrophobicContact CD2-CG2 4.41Å
236	P	44.7	Very low	47.4	Very low	5 Å²	5	89 Å²	89	3%	0.032	47%	0.465	C	S	.	.			trans	-59.2	137.2	171.5	-27	35.7	0	0	0	113	Y23 L24 P238 I239	Y23-P236 HydrophobicContact CE1-CB 4.14Å; Y23-P236 HydrophobicContact CE1-CG 4.12Å; L24-P236 HydrophobicContact CD2-CG 4Å; P236-P238 VanDerWaalsContact C-N 3.27Å; P236-P238 VanDerWaalsContact O-N 3.1Å; P236-I239 WeakPolarHBondContact O-CB 3.4Å; P236-I239 PolarHBondContact O-N 3.47Å
237	S	51.8	Low	47.8	Very low	91 Å²	91	82.5 Å²	82.5	64%	0.636	46%	0.46	S	S	*	.	H	α-helix	trans	-48.4	-34.6	176.6	-42.1	0	0	0	0	115.7	I239 H240 A241	S237-I239 PolarHBondContact O-N 3.47Å; S237-H240 PolarHBondContact O-N 3.21Å; S237-A241 PolarHBondContact O-N 3.27Å
238	P	46.8	Very low	48.6	Very low	42 Å²	42	82.7 Å²	82.7	27%	0.273	46%	0.461	S	S	.	.	H	α-helix	trans	-55.9	-30.4	171.9	-29.3	37.4	0	0	0	114.7	I14 P236 A241 K242	I14-P238 HydrophobicContact CG2-CG 4.15Å; P236-P238 VanDerWaalsContact C-N 3.27Å; P236-P238 VanDerWaalsContact O-N 3.1Å; P238-A241 PolarHBondContact O-N 2.95Å; P238-K242 WeakPolarHBondContact O-CB 3.32Å; P238-K242 PolarHBondContact O-N 2.87Å
239	I	45	Very low	48.6	Very low	30 Å²	30	86.1 Å²	86.1	15%	0.154	48%	0.48	C	S	.	.	H	α-helix	trans	-74.6	-38.7	178.7	-56.1	-177	0	0	0	110.6	P18 W19 L235 P236 S237 K242 A243	P18-I239 HydrophobicContact CB-CG1 4.18Å; W19-I239 HydrophobicContact CH2-CD1 4.24Å; W19-I239 HydrophobicContact CZ3-CD1 4.36Å; L235-I239 HydrophobicContact CD2-CD1 3.87Å; L235-I239 HydrophobicContact CD2-CG2 4.41Å; P236-I239 WeakPolarHBondContact O-CB 3.4Å; P236-I239 PolarHBondContact O-N 3.47Å; S237-I239 PolarHBondContact O-N 3.47Å; I239-K242 PolarHBondContact O-N 3.33Å; I239-A243 WeakPolarHBondContact O-CB 3.32Å; I239-A243 PolarHBondContact O-N 3.44Å
240	H	52.6	Low	48.4	Very low	126 Å²	126	91 Å²	91	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-41.9	171.2	-170.3	-32.6	0	0	0	111.2	S237 K242 A243 V244	S237-H240 PolarHBondContact O-N 3.21Å; H240-K242 VanDerWaalsContact C-N 3.34Å; H240-K242 PolarHBondContact O-N 2.97Å; H240-A243 PolarHBondContact O-N 3.49Å; H240-V244 WeakPolarHBondContact O-CG2 3.48Å; H240-V244 PolarHBondContact O-N 3.12Å; H240-V244 VanDerWaalsContact O-N 3.08Å
241	A	55.6	Low	48	Very low	59 Å²	59	89.6 Å²	89.6	49%	0.488	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-42.9	174.7	0	0	0	0	0	111.5	S237 P238 V244 E245	S237-A241 PolarHBondContact O-N 3.27Å; P238-A241 PolarHBondContact O-N 2.95Å; A241-V244 PolarHBondContact O-N 3.38Å; A241-E245 WeakPolarHBondContact O-CB 3.46Å; A241-E245 PolarHBondContact O-N 3.41Å
242	K	47.8	Very low	47.6	Very low	106 Å²	106	93.7 Å²	93.7	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-38.5	176.2	-144.6	76.9	-161.9	159.5	0	112.5	P238 I239 H240 E245 I246	P238-K242 WeakPolarHBondContact O-CB 3.32Å; P238-K242 PolarHBondContact O-N 2.87Å; I239-K242 PolarHBondContact O-N 3.33Å; H240-K242 VanDerWaalsContact C-N 3.34Å; H240-K242 PolarHBondContact O-N 2.97Å; K242-E245 WeakPolarHBondContact CD-OE2 3.28Å; K242-E245 VanDerWaalsContact CE-OE2 3.27Å; K242-E245 WeakPolarHBondContact CE-OE2 3.33Å; K242-E245 IonicContact NZ-OE1 2.72Å; K242-E245 PolarHBondContact NZ-OE1 3.5Å; K242-E245 IonicContact NZ-OE2 3.48Å; K242-E245 PolarHBondContact NZ-OE2 2.9Å; K242-E245 PolarHBondContact O-N 3.44Å; K242-I246 HydrophobicContact CG-CD1 4.18Å; K242-I246 VanDerWaalsContact O-CD1 3.24Å; K242-I246 WeakPolarHBondContact O-CD1 3.18Å; K242-I246 WeakPolarHBondContact O-CG1 3.49Å; K242-I246 PolarHBondContact O-N 3.25Å
243	A	50.2	Low	47.1	Very low	33 Å²	33	92.8 Å²	92.8	27%	0.273	53%	0.53	S	S	.	.	H	α-helix	trans	-61.9	-43.3	176.2	0	0	0	0	0	112	I239 H240 I246 L248	I239-A243 WeakPolarHBondContact O-CB 3.32Å; I239-A243 PolarHBondContact O-N 3.44Å; H240-A243 PolarHBondContact O-N 3.49Å; A243-I246 PolarHBondContact O-N 2.78Å; A243-L248 HydrophobicContact CB-CD1 4.39Å; A243-L248 PolarHBondContact O-N 2.93Å
244	V	62.3	Low	46.8	Very low	74 Å²	74	95.9 Å²	95.9	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-62.8	-45.6	173.4	172.8	0	0	0	0	110.9	H240 A241 I246 G247 D249	H240-V244 WeakPolarHBondContact O-CG2 3.48Å; H240-V244 PolarHBondContact O-N 3.12Å; H240-V244 VanDerWaalsContact O-N 3.08Å; A241-V244 PolarHBondContact O-N 3.38Å; V244-I246 PolarHBondContact O-N 3.22Å; V244-G247 PolarHBondContact O-N 3.28Å; V244-D249 HydrophobicContact CG2-CB 4.4Å
245	E	60	Low	46.2	Very low	132 Å²	132	96.4 Å²	96.4	62%	0.617	55%	0.553	S	S	*	*	H	α-helix	trans	-59.9	-26.8	177.2	-168.8	-172.1	151.5	0	0	113.7	A241 K242 G247	A241-E245 WeakPolarHBondContact O-CB 3.46Å; A241-E245 PolarHBondContact O-N 3.41Å; K242-E245 WeakPolarHBondContact CD-OE2 3.28Å; K242-E245 VanDerWaalsContact CE-OE2 3.27Å; K242-E245 WeakPolarHBondContact CE-OE2 3.33Å; K242-E245 IonicContact NZ-OE1 2.72Å; K242-E245 PolarHBondContact NZ-OE1 3.5Å; K242-E245 IonicContact NZ-OE2 3.48Å; K242-E245 PolarHBondContact NZ-OE2 2.9Å; K242-E245 PolarHBondContact O-N 3.44Å; E245-G247 VanDerWaalsContact C-N 3.34Å
246	I	58.3	Low	45.8	Very low	90 Å²	90	102.4 Å²	102.4	46%	0.462	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.9	-7.6	179	-62.5	159.1	0	0	0	112.4	K242 A243 V244 K671	K242-I246 HydrophobicContact CG-CD1 4.18Å; K242-I246 VanDerWaalsContact O-CD1 3.24Å; K242-I246 WeakPolarHBondContact O-CD1 3.18Å; K242-I246 WeakPolarHBondContact O-CG1 3.49Å; K242-I246 PolarHBondContact O-N 3.25Å; A243-I246 PolarHBondContact O-N 2.78Å; V244-I246 PolarHBondContact O-N 3.22Å; I246-K671 PolarHBondContact O-NZ 3.05Å
247	G	42.9	Very low	45.7	Very low	64 Å²	64	107.2 Å²	107.2	66%	0.66	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	83.7	52.3	177.3	0	0	0	0	0	113.6	V244 E245	V244-G247 PolarHBondContact O-N 3.28Å; E245-G247 VanDerWaalsContact C-N 3.34Å
248	L	54.1	Low	44.9	Very low	130 Å²	130	112.2 Å²	112.2	68%	0.681	63%	0.629	S	S	*	*			trans	-110.7	13.7	-178.5	-67.3	172.6	0	0	0	114.5	A243	A243-L248 HydrophobicContact CB-CD1 4.39Å; A243-L248 PolarHBondContact O-N 2.93Å
249	D	40.4	Very low	44.6	Very low	118 Å²	118	122 Å²	122	63%	0.631	66%	0.66	S	S	*	*			trans	-135.2	95	-171.2	-144.2	-7.5	0	0	0	112.1	V244	V244-D249 HydrophobicContact CG2-CB 4.4Å
250	E	39.4	Very low	44.3	Very low	183 Å²	183	125.8 Å²	125.8	86%	0.855	69%	0.69	S	S	*	*			trans	-161.5	135.7	179	-101.7	-164	-157.7	0	0	106.6
251	V	38.3	Very low	43.6	Very low	109 Å²	109	127.8 Å²	127.8	66%	0.661	70%	0.699	S	S	*	*			cis	-144.9	144.4	-4.4	176	0	0	0	0	107.6
252	N	34.3	Very low	43.2	Very low	170 Å²	170	131.6 Å²	131.6	91%	0.909	72%	0.717	S	S	*	*			trans	-167.9	119.6	139.5	-106.3	-26	0	0	0	113.7
253	G	35.3	Very low	42.6	Very low	67 Å²	67	135.3 Å²	135.3	69%	0.691	73%	0.733	S	S	*	*			trans	-117.5	155.2	168	0	0	0	0	0	111
254	H	33.3	Very low	42.5	Very low	186 Å²	186	142.1 Å²	142.1	86%	0.861	76%	0.763	S	S	*	*			trans	-58.5	148.5	-175.4	-62.9	-87.4	0	0	0	114.9
255	T	36.4	Very low	41.2	Very low	147 Å²	147	143.7 Å²	143.7	90%	0.902	78%	0.778	S	S	*	*				-171.2	158.9	108.5	19.8	0	0	0	0	112.7
256	E	32.5	Very low	40.2	Very low	189 Å²	189	144 Å²	144	88%	0.883	79%	0.793	S	S	*	*			trans	-97.7	152.7	-175.7	-55.1	177.8	108.9	0	0	113.7
257	A	42.5	Very low	39.3	Very low	105 Å²	105	144.4 Å²	144.4	87%	0.868	80%	0.804	S	S	*	*			trans	-152.2	149	156.4	0	0	0	0	0	111.6
258	K	35.9	Very low	39.1	Very low	196 Å²	196	148.5 Å²	148.5	85%	0.852	81%	0.811	S	S	*	*			trans	-109.9	140.4	-170.9	-64.5	173.7	178.2	173.3	0	113.8
259	R	39.3	Very low	38.8	Very low	247 Å²	247	151.4 Å²	151.4	93%	0.932	82%	0.823	S	S	*	*			trans	154.9	151.9	148.7	-91.8	165.3	175.2	177.3	-1.6	109.7
260	S	39.5	Very low	39	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	83%	0.827	S	S	*	*			cis	-164.2	165.3	-18.7	41	0	0	0	0	109.1
261	E	36.6	Very low	39.2	Very low	168 Å²	168	147.4 Å²	147.4	79%	0.785	83%	0.827	S	S	*	*			trans	-65.9	146.1	-170.6	-60.2	166.6	92.2	0	0	116
262	V	47.5	Very low	39.8	Very low	140 Å²	140	150.7 Å²	150.7	85%	0.848	84%	0.839	S	S	*	*			trans	-138.3	127.6	145	179.1	0	0	0	0	108.4
263	K	36.5	Very low	39.9	Very low	183 Å²	183	152.8 Å²	152.8	80%	0.796	84%	0.835	S	S	*	*			trans	-90.7	139.2	171.4	-73.3	176.5	178.1	172.1	0	110.6
264	L	46.5	Very low	40.6	Very low	176 Å²	176	156.1 Å²	156.1	92%	0.921	85%	0.846	S	S	*	*			trans	-145	141.6	151.5	-97.4	172.5	0	0	0	109.1
265	S	36.1	Very low	41.1	Very low	108 Å²	108	152.1 Å²	152.1	76%	0.755	83%	0.831	S	S	*	*			trans	-135.3	137.6	-179.2	56.4	0	0	0	0	110
266	C	39.6	Very low	41.3	Very low	137 Å²	137	155.4 Å²	155.4	93%	0.926	83%	0.827	S	S	*	*			trans	-137.5	148.7	159.9	-93.3	0	0	0	0	109.1
267	S	37.6	Very low	42.1	Very low	100 Å²	100	153.9 Å²	153.9	70%	0.699	83%	0.83	S	S	*	*			trans	-115.3	170.1	-173	-53	0	0	0	0	111.9
268	D	39.1	Very low	42	Very low	150 Å²	150	153.8 Å²	153.8	80%	0.802	82%	0.823	S	S	*	*			trans	59	117.1	153.1	-56.1	-47.2	0	0	0	120
269	M	48	Very low	42.7	Very low	191 Å²	191	154 Å²	154	94%	0.941	82%	0.824	S	S	*	*				-153	146.4	114.2	-100.4	-59.5	158	0	0	110
270	A	44.3	Very low	42.8	Very low	86 Å²	86	146 Å²	146	71%	0.711	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-99.6	156.2	-171.2	0	0	0	0	0	113.3
271	P	44.8	Very low	43.1	Very low	130 Å²	130	149.7 Å²	149.7	84%	0.844	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-85	147.2	-176.1	33.7	-35.4	0	0	0	113.7
272	L	49.6	Very low	44	Very low	178 Å²	178	147 Å²	147	93%	0.932	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.4	143.9	172.3	-77.9	167.7	0	0	0	112.3
273	R	37.9	Very low	43.8	Very low	215 Å²	215	144.7 Å²	144.7	81%	0.811	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-88.8	155.2	166.1	-70.9	-177.7	175.5	-176.8	0.6	110.9
274	C	48.4	Very low	44.3	Very low	137 Å²	137	141.4 Å²	141.4	93%	0.926	80%	0.803	S	S	*	*			trans	-121.1	143.2	149.3	-77.8	0	0	0	0	109.3
275	D	43.6	Very low	44.3	Very low	102 Å²	102	142.7 Å²	142.7	55%	0.545	80%	0.802	S	S	.	*			trans	-112.5	145.9	-176.5	-110.6	-82.3	0	0	0	111.1
276	R	40.5	Very low	44.6	Very low	216 Å²	216	142.1 Å²	142.1	82%	0.815	80%	0.803	S	S	*	*			trans	43.1	122.1	148.3	-59.8	164.3	-166.3	-140.8	-4.7	120.9
277	V	49.3	Very low	44.8	Very low	156 Å²	156	138.6 Å²	138.6	95%	0.945	79%	0.79	S	S	*	*			trans	-129.8	145.4	130.5	179.8	0	0	0	0	108
278	S	41.3	Very low	45.1	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	80%	0.798	S	S	*	*			trans	-149.4	124.8	-171	58.4	0	0	0	0	114
279	K	50.8	Low	45.1	Very low	202 Å²	202	141 Å²	141	88%	0.878	80%	0.801	S	S	*	*			trans	-171.9	158.6	162.9	-98.2	-166.1	174.9	-175.5	0	107.2
280	S	40.2	Very low	44.8	Very low	79 Å²	79	137.7 Å²	137.7	55%	0.552	80%	0.796	S	S	*	*			cis	169.6	156.1	-31.7	51.3	0	0	0	0	106
281	E	47.4	Very low	44.4	Very low	186 Å²	186	140.3 Å²	140.3	87%	0.869	80%	0.803	S	S	*	*			trans	76.7	149.3	-177.6	-54.4	-177.3	69.9	0	0	115.9
282	S	53.9	Low	44	Very low	111 Å²	111	137.3 Å²	137.3	78%	0.776	80%	0.796	S	S	*	*			cis	-157.7	157.5	-26.8	50.7	0	0	0	0	109.1
283	A	43.3	Very low	43.5	Very low	92 Å²	92	136.9 Å²	136.9	76%	0.76	79%	0.793	S	S	*	*			trans	-111.8	161.1	-179.5	0	0	0	0	0	110.8
284	P	47.9	Very low	43.6	Very low	114 Å²	114	135.5 Å²	135.5	74%	0.74	80%	0.796	S	S	*	*				-152.7	167.1	89.6	40.8	-23.6	0	0	0	117.1
285	K	47.2	Very low	43.5	Very low	204 Å²	204	138.5 Å²	138.5	89%	0.887	79%	0.793	S	S	*	*			trans	31.6	156.4	139.7	-63.5	177.2	178.8	-179.1	0	122
286	A	41.2	Very low	43.3	Very low	95 Å²	95	139.4 Å²	139.4	79%	0.785	80%	0.804	S	S	*	*			cis	174.7	156.8	-23.2	0	0	0	0	0	107.3
287	G	44.5	Very low	43.8	Very low	63 Å²	63	136.1 Å²	136.1	65%	0.649	80%	0.803	S	S	*	*			trans	90.5	153	176.2	0	0	0	0	0	114
288	D	43.9	Very low	43.7	Very low	164 Å²	164	134 Å²	134	88%	0.877	79%	0.792	S	S	*	*			cis	-151.8	168.7	-10.9	-108.6	-35.5	0	0	0	111.7
289	T	39.4	Very low	43.8	Very low	138 Å²	138	134.6 Å²	134.6	85%	0.847	79%	0.793	S	S	*	*			trans	-67.1	140.3	-174.7	50.2	0	0	0	0	114.4
290	S	40.2	Very low	43.4	Very low	121 Å²	121	129.9 Å²	129.9	85%	0.846	79%	0.792	S	S	*	*			trans	-148.3	135.5	151.6	-169.4	0	0	0	0	112.2
291	T	36.2	Very low	43.6	Very low	140 Å²	140	132.3 Å²	132.3	86%	0.859	80%	0.804	S	S	*	*			trans	-92	135.9	176.3	50.1	0	0	0	0	110.7
292	G	36.1	Very low	43.4	Very low	68 Å²	68	127.3 Å²	127.3	70%	0.701	79%	0.794	S	S	*	*			trans	-171.1	100.8	176.2	0	0	0	0	0	117.5
293	I	40.9	Very low	42.9	Very low	169 Å²	169	126.9 Å²	126.9	87%	0.867	78%	0.783	S	S	*	*			trans	61.4	116.4	141.7	-55.8	171	0	0	0	117.4
294	E	40	Very low	42.8	Very low	185 Å²	185	129.4 Å²	129.4	86%	0.864	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-61.1	134.7	166.1	-61.7	-177.3	122.9	0	0	111.3	P296	E294-P296 WeakPolarHBondContact O-CD 3.19Å
295	K	44.7	Very low	42.5	Very low	201 Å²	201	129.7 Å²	129.7	87%	0.874	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-75.4	125.9	170.6	-92.6	-177.7	173.9	176.9	0	110.1
296	P	40.3	Very low	42.6	Very low	120 Å²	120	123.1 Å²	123.1	78%	0.779	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-58.6	147.8	166.5	-21.5	33.4	0	0	0	110.9	E294	E294-P296 WeakPolarHBondContact O-CD 3.19Å
297	L	50.9	Low	43	Very low	148 Å²	148	123.4 Å²	123.4	78%	0.775	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-60.6	147.4	169.1	-79.7	80.9	0	0	0	109.9
298	P	48.1	Very low	43	Very low	112 Å²	112	123.9 Å²	123.9	73%	0.727	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-60.1	142.4	166.4	28.3	-34.2	0	0	0	109.4	A300	P298-A300 PolarHBondContact O-N 3.39Å
299	P	43.2	Very low	43.1	Very low	114 Å²	114	119.1 Å²	119.1	74%	0.74	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-62.7	139.9	175.4	27.6	-34.2	0	0	0	109.7	T301	P299-T301 PolarHBondContact O-N 3.48Å
300	A	42.8	Very low	43.4	Very low	104 Å²	104	116 Å²	116	86%	0.86	69%	0.688	S	S	*	*			trans	-64.1	104.8	171.7	0	0	0	0	0	109	P298 A302	P298-A300 PolarHBondContact O-N 3.39Å; A300-A302 PolarHBondContact O-N 2.83Å
301	T	43.1	Very low	43.9	Very low	129 Å²	129	114.1 Å²	114.1	79%	0.791	67%	0.666	S	S	*	*			trans	-65.5	120.8	176.7	47	0	0	0	0	109.5	P299 D303	P299-T301 PolarHBondContact O-N 3.48Å; T301-D303 PolarHBondContact O-N 3Å
302	A	43.5	Very low	44.7	Very low	82 Å²	82	117.2 Å²	117.2	68%	0.678	66%	0.662	S	S	*	*			trans	-68.6	102	177.7	0	0	0	0	0	110.3	A300 L304	A300-A302 PolarHBondContact O-N 2.83Å; A302-L304 VanDerWaalsContact C-N 3.3Å; A302-L304 HydrophobicContact CB-CD1 4.03Å; A302-L304 HydrophobicContact CB-CG 4.29Å; A302-L304 PolarHBondContact O-N 2.91Å
303	D	42.5	Very low	45.2	Very low	101 Å²	101	116.4 Å²	116.4	54%	0.54	64%	0.641	S	S	.	*			trans	-74.4	80.3	177.4	-171.4	18.1	0	0	0	110.1	T301	T301-D303 PolarHBondContact O-N 3Å
304	L	41.7	Very low	46	Very low	145 Å²	145	113.9 Å²	113.9	76%	0.759	62%	0.623	S	S	*	*			trans	-115.9	44.3	-172	-77.1	174.6	0	0	0	113.1	A302	A302-L304 VanDerWaalsContact C-N 3.3Å; A302-L304 HydrophobicContact CB-CD1 4.03Å; A302-L304 HydrophobicContact CB-CG 4.29Å; A302-L304 PolarHBondContact O-N 2.91Å
305	D	42.5	Very low	46.8	Very low	121 Å²	121	112.3 Å²	112.3	65%	0.647	61%	0.614	S	S	*	*			trans	-108.6	11.6	-175.9	-124	-19.3	0	0	0	114.7	V307 P308	D305-V307 VanDerWaalsContact C-N 3.32Å; D305-V307 PolarHBondContact O-N 2.73Å; D305-P308 VanDerWaalsContact O-CD 3.24Å; D305-P308 WeakPolarHBondContact O-CD 3.24Å
306	D	49.8	Very low	46.7	Very low	66 Å²	66	105.5 Å²	105.5	35%	0.353	59%	0.591	S	S	.	*			trans	-73.2	-15.9	-179.7	-91.1	-51.7	0	0	0	114.4	P308 I309 L310 S493	D306-P308 VanDerWaalsContact C-CD 3.45Å; D306-I309 PolarHBondContact O-N 2.84Å; D306-L310 PolarHBondContact O-N 2.78Å; D306-S493 PolarHBondContact OD1-OG 3.42Å
307	V	48.9	Very low	47	Very low	101 Å²	101	103.8 Å²	103.8	61%	0.612	58%	0.575	S	S	*	*	H	α-helix	trans	-53.6	-44.4	-172.3	-174.3	0	0	0	0	114.5	D305 I309 E311	D305-V307 VanDerWaalsContact C-N 3.32Å; D305-V307 PolarHBondContact O-N 2.73Å; V307-I309 VanDerWaalsContact C-N 3.35Å; V307-I309 PolarHBondContact O-N 3.48Å; V307-E311 PolarHBondContact O-N 2.7Å; V307-E311 VanDerWaalsContact O-N 3.16Å
308	P	44.2	Very low	46.6	Very low	73 Å²	73	98.4 Å²	98.4	47%	0.474	56%	0.556	S	S	.	*	H	α-helix	trans	-67.8	-28.6	-171.7	-21.9	34.7	0	0	0	114.9	D305 D306 R312	D305-P308 VanDerWaalsContact O-CD 3.24Å; D305-P308 WeakPolarHBondContact O-CD 3.24Å; D306-P308 VanDerWaalsContact C-CD 3.45Å; P308-R312 WeakPolarHBondContact O-CG 3.45Å
309	I	45.6	Very low	46.6	Very low	64 Å²	64	96.6 Å²	96.6	33%	0.328	55%	0.546	S	S	.	.	H	α-helix	trans	-83.5	-46.6	-178.8	-61.4	177.8	0	0	0	109.5	D306 V307 E311 R312 M313 R490	D306-I309 PolarHBondContact O-N 2.84Å; V307-I309 VanDerWaalsContact C-N 3.35Å; V307-I309 PolarHBondContact O-N 3.48Å; I309-E311 VanDerWaalsContact C-N 3.27Å; I309-E311 PolarHBondContact O-N 2.94Å; I309-R312 PolarHBondContact O-N 2.72Å; I309-M313 HydrophobicContact CG2-CG 4.49Å; I309-M313 PolarHBondContact O-N 2.69Å; I309-R490 HydrophobicContact CD1-CG 4.24Å
310	L	45.4	Very low	46.7	Very low	73 Å²	73	95.1 Å²	95.1	38%	0.382	53%	0.528	S	S	.	.	H	α-helix	trans	-59.2	-38.2	179.5	-169.4	66.8	0	0	0	111.7	D306 K314	D306-L310 PolarHBondContact O-N 2.78Å; L310-K314 HydrophobicContact CG-CD 4.1Å; L310-K314 WeakPolarHBondContact O-CB 3.32Å; L310-K314 WeakPolarHBondContact O-CG 3.49Å; L310-K314 PolarHBondContact O-N 3.42Å
311	E	52.5	Low	46.9	Very low	81 Å²	81	101.4 Å²	101.4	38%	0.379	53%	0.529	S	S	.	.	H	α-helix	trans	-67.2	-38	173.6	-100.1	-65.4	110.1	0	0	113.6	V307 I309 K315	V307-E311 PolarHBondContact O-N 2.7Å; V307-E311 VanDerWaalsContact O-N 3.16Å; I309-E311 VanDerWaalsContact C-N 3.27Å; I309-E311 PolarHBondContact O-N 2.94Å; E311-K315 WeakPolarHBondContact O-CD 3.39Å; E311-K315 WeakPolarHBondContact O-CG 3.38Å; E311-K315 PolarHBondContact O-N 3.03Å; E311-K315 VanDerWaalsContact O-N 3.15Å; E311-K315 VanDerWaalsContact OE2-CE 3.29Å; E311-K315 WeakPolarHBondContact OE2-CE 3.28Å; E311-K315 IonicContact OE2-NZ 2.65Å; E311-K315 PolarHBondContact OE2-NZ 3.25Å
312	R	51.4	Low	47	Very low	204 Å²	204	105 Å²	105	77%	0.77	53%	0.528	S	S	*	.	H	α-helix	trans	-67	-43.6	175.2	-79.9	178.1	171.2	166.3	-0.3	111.6	P308 I309 K315 S316	P308-R312 WeakPolarHBondContact O-CG 3.45Å; I309-R312 PolarHBondContact O-N 2.72Å; R312-K315 PolarHBondContact O-N 3.47Å; R312-S316 PolarHBondContact O-N 3.12Å
313	M	47.4	Very low	47.2	Very low	52 Å²	52	107.8 Å²	107.8	26%	0.256	53%	0.53	S	S	.	.	H	α-helix	trans	-66.8	-43.6	175.5	-75.3	-82.5	-164.8	0	0	111.7	I309 K315 S316 L317 M494	I309-M313 HydrophobicContact CG2-CG 4.49Å; I309-M313 PolarHBondContact O-N 2.69Å; M313-K315 VanDerWaalsContact C-N 3.26Å; M313-K315 PolarHBondContact O-N 3.44Å; M313-S316 WeakPolarHBondContact O-CB 3.48Å; M313-S316 PolarHBondContact O-N 3.21Å; M313-L317 PolarHBondContact O-N 3.21Å; M313-M494 HydrophobicContact CE-SD 4.44Å
314	K	58.2	Low	47.3	Very low	116 Å²	116	109.2 Å²	109.2	50%	0.504	54%	0.542	S	S	.	.	H	α-helix	trans	-56.9	-36.9	175.2	-81.4	169.9	176.6	170.8	0	112.5	L310 G318	L310-K314 HydrophobicContact CG-CD 4.1Å; L310-K314 WeakPolarHBondContact O-CB 3.32Å; L310-K314 WeakPolarHBondContact O-CG 3.49Å; L310-K314 PolarHBondContact O-N 3.42Å; K314-G318 WeakPolarHBondContact O-CA 3.32Å; K314-G318 PolarHBondContact O-N 3.41Å
315	K	55.4	Low	47.2	Very low	151 Å²	151	111.5 Å²	111.5	66%	0.657	55%	0.546	S	S	*	.	H	α-helix	trans	-68.5	-31	175	-78.1	162.6	174.4	141.6	0	113.6	E311 R312 M313	E311-K315 WeakPolarHBondContact O-CD 3.39Å; E311-K315 WeakPolarHBondContact O-CG 3.38Å; E311-K315 PolarHBondContact O-N 3.03Å; E311-K315 VanDerWaalsContact O-N 3.15Å; E311-K315 VanDerWaalsContact OE2-CE 3.29Å; E311-K315 WeakPolarHBondContact OE2-CE 3.28Å; E311-K315 IonicContact OE2-NZ 2.65Å; E311-K315 PolarHBondContact OE2-NZ 3.25Å; R312-K315 PolarHBondContact O-N 3.47Å; M313-K315 VanDerWaalsContact C-N 3.26Å; M313-K315 PolarHBondContact O-N 3.44Å
316	S	42.9	Very low	46.9	Very low	58 Å²	58	111.7 Å²	111.7	41%	0.406	56%	0.555	S	S	.	*	H	α-helix	trans	-75	-46.6	171.1	179.8	0	0	0	0	112.1	R312 M313 G318	R312-S316 PolarHBondContact O-N 3.12Å; M313-S316 WeakPolarHBondContact O-CB 3.48Å; M313-S316 PolarHBondContact O-N 3.21Å; S316-G318 VanDerWaalsContact C-N 3.31Å; S316-G318 PolarHBondContact O-N 3.46Å
317	L	47.3	Very low	46	Very low	85 Å²	85	113.3 Å²	113.3	45%	0.445	58%	0.578	S	S	.	*	H	α-helix	trans	-71.7	-22.1	-178.9	-69.3	166.6	0	0	0	113.4	M313 S319 F320	M313-L317 PolarHBondContact O-N 3.21Å; L317-S319 PolarHBondContact O-N 3.49Å; L317-S319 VanDerWaalsContact O-N 3.1Å; L317-F320 WeakPolarHBondContact O-CB 3.42Å; L317-F320 PolarHBondContact O-N 2.89Å
318	G	42.2	Very low	45.6	Very low	35 Å²	35	114.8 Å²	114.8	36%	0.361	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.4	-20.8	-178.1	0	0	0	0	0	115.3	K314 S316 F320	K314-G318 WeakPolarHBondContact O-CA 3.32Å; K314-G318 PolarHBondContact O-N 3.41Å; S316-G318 VanDerWaalsContact C-N 3.31Å; S316-G318 PolarHBondContact O-N 3.46Å; G318-F320 VanDerWaalsContact C-N 3.3Å; G318-F320 PolarHBondContact O-N 3.36Å
319	S	48.2	Very low	45.3	Very low	74 Å²	74	117.8 Å²	117.8	52%	0.517	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.3	-31.1	172	-68.4	0	0	0	0	112.8	L317 R321 R322	L317-S319 PolarHBondContact O-N 3.49Å; L317-S319 VanDerWaalsContact O-N 3.1Å; S319-R321 PolarHBondContact O-N 3.45Å; S319-R322 PolarHBondContact O-N 3.5Å
320	F	45.1	Very low	44.8	Very low	83 Å²	83	118.5 Å²	118.5	36%	0.364	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-73.5	-27.8	-174	-75.3	-85.9	0	0	0	114.3	L317 G318 R322 D453	L317-F320 WeakPolarHBondContact O-CB 3.42Å; L317-F320 PolarHBondContact O-N 2.89Å; G318-F320 VanDerWaalsContact C-N 3.3Å; G318-F320 PolarHBondContact O-N 3.36Å; F320-R322 PolarHBondContact O-N 2.97Å; F320-D453 HydrophobicContact CZ-CB 4.15Å; F320-D453 WeakPolarHBondContact CZ-OD1 3.2Å
321	R	47.1	Very low	44.5	Very low	236 Å²	236	122.8 Å²	122.8	89%	0.891	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-74.1	-9.5	175.7	-73.1	-164.8	-179.3	-154.3	2.5	113.6	S319	S319-R321 PolarHBondContact O-N 3.45Å
322	R	46.3	Very low	44	Very low	205 Å²	205	127.5 Å²	127.5	77%	0.774	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-92.7	-9.7	-172.4	-137.1	-179.7	-64.4	-173.6	1.4	115.3	S319 F320	S319-R322 PolarHBondContact O-N 3.5Å; F320-R322 PolarHBondContact O-N 2.97Å
323	I	46.8	Very low	43.9	Very low	140 Å²	140	124.5 Å²	124.5	72%	0.718	68%	0.677	S	S	*	*	S	Bend	trans	-93.3	-17.1	-173.7	-62.7	174.1	0	0	0	112.6	K325	I323-K325 PolarHBondContact O-N 3.1Å
324	V	44.8	Very low	43.4	Very low	131 Å²	131	130.1 Å²	130.1	79%	0.794	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	19.1	-167.5	-164.5	0	0	0	0	113.5
325	K	39.8	Very low	42.9	Very low	193 Å²	193	132.5 Å²	132.5	84%	0.839	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.1	18.2	-171	-141.3	173.8	-176.4	177.5	0	116.9	I323	I323-K325 PolarHBondContact O-N 3.1Å
326	C	35.2	Very low	42.3	Very low	124 Å²	124	133.2 Å²	133.2	84%	0.838	72%	0.723	S	S	*	*	S	Bend	trans	-134.5	57	-175.9	-63.9	0	0	0	0	113.8
327	A	32.4	Very low	42.2	Very low	101 Å²	101	138.6 Å²	138.6	84%	0.835	74%	0.742	S	S	*	*			trans	-154.9	30.7	-179.3	0	0	0	0	0	117.2
328	T	38.9	Very low	41.7	Very low	131 Å²	131	139.8 Å²	139.8	80%	0.804	76%	0.757	S	S	*	*			trans	-134.4	102.2	-179.6	-43.8	0	0	0	0	113.4
329	T	38.7	Very low	42	Very low	137 Å²	137	143.2 Å²	143.2	84%	0.84	78%	0.776	S	S	*	*			trans	25	119.8	154.8	59.4	0	0	0	0	120.6
330	G	36.1	Very low	41.6	Very low	79 Å²	79	146.9 Å²	146.9	81%	0.814	79%	0.79	S	S	*	*			trans	-141.8	115.6	151.5	0	0	0	0	0	109.5
331	N	38.9	Very low	42	Very low	163 Å²	163	148.7 Å²	148.7	87%	0.872	81%	0.81	S	S	*	*			trans	-156.2	77.4	-175.8	-155.4	18.8	0	0	0	113.2
332	Q	40.2	Very low	41.9	Very low	180 Å²	180	141.4 Å²	141.4	84%	0.841	81%	0.809	S	S	*	*			trans	-165.4	134	159.6	-93.1	-139.9	71.9	0	0	109.8
333	V	49.7	Very low	41.9	Very low	140 Å²	140	134.7 Å²	134.7	85%	0.848	80%	0.803	S	S	*	*			trans	-174	137.6	143.7	141.3	0	0	0	0	107.6
334	Q	38.4	Very low	41.8	Very low	170 Å²	170	133.8 Å²	133.8	79%	0.794	81%	0.809	S	S	*	*			trans	-111.1	143.1	164.8	-60.6	-179.5	11.2	0	0	109.1
335	L	46.4	Very low	41.9	Very low	167 Å²	167	134.7 Å²	134.7	87%	0.874	81%	0.805	S	S	*	*			trans	172.2	122.5	150.4	-115.1	69	0	0	0	105.1
336	K	42.1	Very low	42.1	Very low	166 Å²	166	132.7 Å²	132.7	72%	0.722	80%	0.798	S	S	*	*			cis	94.8	95.7	33.3	-171	-177.4	174.1	-178.3	0	113.6
337	Q	40.8	Very low	42.3	Very low	170 Å²	170	131.3 Å²	131.3	79%	0.794	79%	0.786	S	S	*	*			trans	66.6	146.9	157.4	-68.1	166.5	-30.7	0	0	115.7
338	S	37.9	Very low	43	Very low	110 Å²	110	136 Å²	136	77%	0.769	79%	0.788	S	S	*	*			cis	-161.5	-178.5	-9.7	-158.3	0	0	0	0	107.3
339	S	48.1	Very low	43.2	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	78%	0.782	S	S	*	*			cis	-155.2	164.2	14.7	-77.1	0	0	0	0	113.9
340	N	40.7	Very low	43.5	Very low	151 Å²	151	134.1 Å²	134.1	81%	0.807	78%	0.778	S	S	*	*			trans	-38	174.2	154	-88.4	2.4	0	0	0	119.5
341	P	52.9	Low	43.9	Very low	121 Å²	121	136.3 Å²	136.3	79%	0.786	77%	0.772	S	S	*	*			cis	-147.3	178.7	-34	40.9	-23.1	0	0	0	116.1
342	G	45.7	Very low	44.2	Very low	84 Å²	84	134.5 Å²	134.5	87%	0.866	76%	0.762	S	S	*	*			trans	132.2	134.4	152.6	0	0	0	0	0	115.4
343	G	46.4	Very low	44.4	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	76%	0.758	S	S	*	*			cis	175.2	158.5	-10.7	0	0	0	0	0	112.8
344	S	43.5	Very low	44	Very low	121 Å²	121	131.4 Å²	131.4	85%	0.846	75%	0.75	S	S	*	*			trans	62.9	142.9	164.5	71.9	0	0	0	0	117.7
345	E	46.8	Very low	44.3	Very low	150 Å²	150	128.6 Å²	128.6	70%	0.701	74%	0.744	S	S	*	*			cis	-148.6	161.6	20.1	-85.6	-156.2	95.9	0	0	114.3
346	Q	43.6	Very low	44	Very low	150 Å²	150	131.1 Å²	131.1	70%	0.701	74%	0.742	S	S	*	*			trans	38.1	147.8	143.7	-58.7	-168.9	49.9	0	0	123.5
347	T	40.8	Very low	44.1	Very low	96 Å²	96	128.8 Å²	128.8	59%	0.589	74%	0.741	S	S	*	*			cis	-166.5	160.4	-25.1	33.2	0	0	0	0	110.2
348	K	46	Very low	44.1	Very low	198 Å²	198	129 Å²	129	86%	0.861	74%	0.742	S	S	*	*			trans	68	150.9	167.6	-61.4	151.7	-174.6	172.4	0	114.6
349	A	42.6	Very low	44.4	Very low	84 Å²	84	132.7 Å²	132.7	69%	0.694	74%	0.744	S	S	*	*			cis	-171.8	162.4	-11.9	0	0	0	0	0	107.7
350	L	45.6	Very low	44.7	Very low	145 Å²	145	132.7 Å²	132.7	76%	0.759	74%	0.741	S	S	*	*			cis	-165.8	141.3	-15.3	-105.7	168.3	0	0	0	108.3
351	N	45.4	Very low	45.5	Very low	125 Å²	125	131.2 Å²	131.2	67%	0.668	74%	0.74	S	S	*	*			trans	62.2	154.8	160.5	-58	-9.7	0	0	0	118.8
352	N	44.8	Very low	45	Very low	126 Å²	126	130 Å²	130	67%	0.674	74%	0.74	S	S	*	*			cis	-157.9	142.2	-22.3	-99.2	-17.8	0	0	0	106.9
353	L	44.1	Very low	44.9	Very low	145 Å²	145	133.3 Å²	133.3	76%	0.759	74%	0.737	S	S	*	*				69.5	130.7	64.4	-158.3	69.5	0	0	0	111.3
354	V	42.4	Very low	45.2	Very low	110 Å²	110	135.7 Å²	135.7	67%	0.667	74%	0.739	S	S	*	*			cis	-152	129.9	26.6	97	0	0	0	0	108.4
355	T	43.6	Very low	45.1	Very low	110 Å²	110	137 Å²	137	68%	0.675	74%	0.736	S	S	*	*				50.4	155.2	98.3	65.7	0	0	0	0	119.3
356	R	41.2	Very low	45	Very low	221 Å²	221	134.6 Å²	134.6	83%	0.834	74%	0.736	S	S	*	*			cis	171.9	-176	-16.8	-171.9	-179.2	-163.7	-170.6	7.6	108.2
357	V	42.5	Very low	45	Very low	117 Å²	117	136.2 Å²	136.2	71%	0.709	74%	0.741	S	S	*	*			trans	84.4	114.5	161.7	-171.2	0	0	0	0	114.1
358	H	42.2	Very low	45.3	Very low	173 Å²	173	138.9 Å²	138.9	80%	0.801	75%	0.751	S	S	*	*				70	145	68.6	-73.3	-55.8	0	0	0	113.8
359	K	44.6	Very low	45.4	Very low	188 Å²	188	139.1 Å²	139.1	82%	0.817	75%	0.746	S	S	*	*			cis	-168.1	154.5	5.1	154.3	-173.2	178.4	-167.8	0	110.7
360	P	52.6	Low	45.6	Very low	107 Å²	107	141 Å²	141	70%	0.695	75%	0.745	S	S	*	*			trans	-102	-162.8	177.3	43.9	-39.1	0	0	0	112.7
361	P	58.2	Low	45.4	Very low	120 Å²	120	141.2 Å²	141.2	78%	0.779	74%	0.742	S	S	*	*			cis	-139.8	-150.1	1.7	45.3	-24	0	0	0	115.6
362	A	43.4	Very low	45.7	Very low	96 Å²	96	141.1 Å²	141.1	79%	0.793	75%	0.748	S	S	*	*			trans	86.5	147.1	167.8	0	0	0	0	0	117.7
363	L	43.2	Very low	45.5	Very low	153 Å²	153	142.5 Å²	142.5	80%	0.801	75%	0.751	S	S	*	*			cis	-165.6	167.1	-16.1	-168.6	73.5	0	0	0	110.3
364	V	52.4	Low	45.8	Very low	114 Å²	114	147 Å²	147	69%	0.691	76%	0.757	S	S	*	*			trans	65.3	114.1	160.7	-82.8	0	0	0	0	124.5
365	D	41.5	Very low	46	Very low	148 Å²	148	146.1 Å²	146.1	79%	0.791	76%	0.756	S	S	*	*				67.8	139.9	123.6	-67.6	-21.6	0	0	0	128.6
366	S	44.8	Very low	46.2	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	77%	0.765	S	S	*	*			trans	98.9	113.2	139.6	-78	0	0	0	0	124.5
367	K	43.9	Very low	46.9	Very low	185 Å²	185	144 Å²	144	80%	0.804	77%	0.765	S	S	*	*				89.7	119.9	128	-77.6	-175.5	173.8	179.3	0	124.8
368	L	46.9	Very low	47.1	Very low	152 Å²	152	143.5 Å²	143.5	80%	0.796	77%	0.766	S	S	*	*				90.7	156	129.5	-112.3	85.7	0	0	0	123.9
369	R	46.8	Very low	47.4	Very low	202 Å²	202	141.1 Å²	141.1	76%	0.762	77%	0.768	S	S	*	*			trans	79.7	142.2	169.5	-52.9	-165.5	76.8	162.6	-1	117
370	D	48.6	Very low	47.3	Very low	124 Å²	124	135.5 Å²	135.5	66%	0.663	76%	0.764	S	S	*	*			cis	-153.2	172.7	-7.8	-107.1	-0.4	0	0	0	112.1
371	Q	40.7	Very low	47.1	Very low	150 Å²	150	135.6 Å²	135.6	70%	0.701	76%	0.762	S	S	*	*			trans	-100.1	-177.1	-179.9	-144.4	-158.2	45.5	0	0	111.6
372	P	51.4	Low	46.6	Very low	123 Å²	123	139 Å²	139	80%	0.799	77%	0.765	S	S	*	*				-153.8	-170.1	66.8	41.4	-17.8	0	0	0	117.8
373	E	41.8	Very low	46.8	Very low	155 Å²	155	145 Å²	145	72%	0.724	77%	0.767	S	S	*	*			trans	-98.1	172.1	-170.1	-39.5	174.4	119.7	0	0	117.2
374	R	48.5	Very low	47	Very low	239 Å²	239	145.3 Å²	145.3	90%	0.902	76%	0.764	S	S	*	*			trans	167.8	162.4	137.7	-91.6	159.4	-171.1	-170.9	5.1	111.9
375	S	47.6	Very low	46.7	Very low	91 Å²	91	144.8 Å²	144.8	64%	0.636	77%	0.772	S	S	*	*			cis	-172.9	134.1	-39	-86.2	0	0	0	0	111.2
376	I	48.5	Very low	47	Very low	167 Å²	167	142.8 Å²	142.8	86%	0.856	77%	0.769	S	S	*	*			trans	37.1	126.4	138.7	-47.2	162.4	0	0	0	121.1
377	S	54.5	Low	47.3	Very low	120 Å²	120	144.7 Å²	144.7	84%	0.839	77%	0.771	S	S	*	*				-175.9	179.2	129.7	-156.9	0	0	0	0	113.8
378	S	48.2	Very low	47.6	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	77%	0.767	S	S	*	*			trans	-153	174.3	-163.9	70.9	0	0	0	0	116.9
379	C	47.9	Very low	47.6	Very low	124 Å²	124	143.8 Å²	143.8	84%	0.838	77%	0.765	S	S	*	*			trans	70.9	146.5	172.3	-150.2	0	0	0	0	115.2
380	G	41.7	Very low	47.5	Very low	70 Å²	70	142 Å²	142	72%	0.722	77%	0.765	S	S	*	*			cis	177.1	-168.3	5.8	0	0	0	0	0	108.6
381	T	49.7	Very low	47.5	Very low	109 Å²	109	145.3 Å²	145.3	67%	0.669	78%	0.777	S	S	*	*			cis	-171.7	123.3	-15.4	-85.1	0	0	0	0	110.6
382	K	47.3	Very low	48	Very low	192 Å²	192	142.9 Å²	142.9	84%	0.835	78%	0.782	S	S	*	*			trans	59.6	130.7	162.2	-64.8	168.4	-178.9	175.2	0	121.9
383	R	47.4	Very low	47.8	Very low	222 Å²	222	145 Å²	145	84%	0.838	79%	0.786	S	S	*	*				174.4	141.9	110.7	-96	179.5	-177.1	-157.8	1.6	115.6
384	Q	47.5	Very low	48	Very low	158 Å²	158	142.5 Å²	142.5	74%	0.738	79%	0.786	S	S	*	*			trans	42.6	122.4	146.2	-68.4	165.3	-70.1	0	0	120.9
385	A	45.7	Very low	48	Very low	103 Å²	103	140 Å²	140	85%	0.851	78%	0.784	S	S	*	*				71.7	133.1	76.9	0	0	0	0	0	113.5
386	S	47.5	Very low	48	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	80%	0.795	S	S	*	*			cis	-142.7	158.7	30.5	-177.8	0	0	0	0	109.9
387	L	51.3	Low	48.3	Very low	141 Å²	141	141.5 Å²	141.5	74%	0.738	80%	0.798	S	S	*	*			cis	75.6	129.4	44.4	-124.2	169.3	0	0	0	115
388	H	50.3	Low	48.2	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.718	79%	0.793	S	S	*	*			trans	74.3	145.4	-176.7	-68.7	102.6	0	0	0	117
389	Q	46.2	Very low	48.4	Very low	162 Å²	162	146.7 Å²	146.7	76%	0.757	79%	0.794	S	S	*	*			cis	-156.6	168.2	-16.3	-172.7	161.1	4.5	0	0	110.6
390	Q	44.2	Very low	48.4	Very low	164 Å²	164	146.3 Å²	146.3	77%	0.766	79%	0.793	S	S	*	*			trans	-66.3	156.8	179.9	-55	154	-71	0	0	114.2
391	H	49.8	Very low	49.5	Very low	195 Å²	195	148.6 Å²	148.6	90%	0.903	79%	0.793	S	S	*	*			trans	-162.1	160	141.8	-114.1	-79.5	0	0	0	113
392	A	50.3	Low	49.9	Very low	98 Å²	98	149 Å²	149	81%	0.81	80%	0.797	S	S	*	*			trans	70.1	124.9	166.5	0	0	0	0	0	119.8
393	L	47.4	Very low	50.5	Low	168 Å²	168	146.4 Å²	146.4	88%	0.88	80%	0.797	S	S	*	*			trans	-109.7	174.1	161.5	-90.5	167.5	0	0	0	109.1
394	S	45.6	Very low	50.8	Low	103 Å²	103	143 Å²	143	72%	0.72	80%	0.795	S	S	*	*			trans	95.7	147.4	158.7	-57.4	0	0	0	0	119.3
395	E	49.2	Very low	51.2	Low	187 Å²	187	140.3 Å²	140.3	87%	0.874	79%	0.791	S	S	*	*			trans	62.8	97.1	157.8	-71.1	164.1	-138.6	0	0	119.7
396	A	48.7	Very low	51.4	Low	105 Å²	105	141.5 Å²	141.5	87%	0.868	79%	0.79	S	S	*	*				-167.2	147.7	108.9	0	0	0	0	0	111.6
397	M	53.6	Low	51.5	Low	184 Å²	184	143.9 Å²	143.9	91%	0.906	79%	0.79	S	S	*	*			trans	-93.2	126.1	168.7	-69.8	163.1	51.4	0	0	110.2
398	E	51.8	Low	51.5	Low	159 Å²	159	141.2 Å²	141.2	74%	0.743	79%	0.788	S	S	*	*			trans	-173.3	139.5	130.9	-112.7	-158.8	108.2	0	0	113.9
399	K	52.5	Low	51.6	Low	176 Å²	176	144.1 Å²	144.1	77%	0.765	80%	0.799	S	S	*	*			trans	63.2	53.5	136.9	-147.9	178.1	-136.9	135.6	0	119.8
400	S	49.7	Very low	52.3	Low	115 Å²	115	142.7 Å²	142.7	80%	0.804	79%	0.786	S	S	*	*			trans	-82.8	110.4	167.5	58.9	0	0	0	0	113.4
401	T	63.3	Low	54	Low	119 Å²	119	138 Å²	138	73%	0.73	77%	0.771	S	S	*	*			trans	-69.5	133.9	172.6	-54.2	0	0	0	0	111.6	V403	T401-V403 PolarHBondContact O-N 3.18Å
402	P	58.2	Low	55.6	Low	117 Å²	117	134.5 Å²	134.5	76%	0.76	75%	0.751	S	S	*	*			trans	-74	108.9	177.6	29.3	-33.9	0	0	0	111.7	L404	P402-L404 PolarHBondContact O-N 3.45Å
403	V	61.2	Low	57.1	Low	138 Å²	138	132.6 Å²	132.6	84%	0.836	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-75.2	117.6	170.9	178.6	0	0	0	0	109.1	T401	T401-V403 PolarHBondContact O-N 3.18Å
404	L	53.7	Low	59	Low	149 Å²	149	128.9 Å²	128.9	78%	0.78	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-66.3	139.4	176.5	-86.4	136.8	0	0	0	111.5	P402	P402-L404 PolarHBondContact O-N 3.45Å
405	P	55	Low	61	Low	103 Å²	103	129 Å²	129	67%	0.669	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-65.7	148.2	173.9	28.1	-34.6	0	0	0	111.2	Q407	P405-Q407 PolarHBondContact O-N 3.3Å
406	P	49.2	Very low	63	Low	127 Å²	127	120.5 Å²	120.5	83%	0.825	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-64.4	130.8	-176.6	26.4	-34.5	0	0	0	111.2	A408	P406-A408 PolarHBondContact O-N 2.94Å
407	Q	50.3	Low	65	Low	156 Å²	156	116 Å²	116	73%	0.729	62%	0.618	S	S	*	*			trans	-72.6	94.2	178.6	-65	-160.6	22.9	0	0	110.9	P405	P405-Q407 PolarHBondContact O-N 3.3Å
408	A	51.8	Low	66.8	Low	86 Å²	86	111.5 Å²	111.5	71%	0.711	60%	0.595	S	S	*	*			trans	-56.3	149.3	167.9	0	0	0	0	0	110.9	P406 R410	P406-A408 PolarHBondContact O-N 2.94Å; A408-R410 PolarHBondContact O-N 2.84Å
409	K	51.7	Low	68.7	Low	215 Å²	215	105 Å²	105	94%	0.935	57%	0.567	S	S	*	*			trans	-58.1	94.8	-171.6	-60.3	173.5	-176.2	175.5	0	111.7
410	R	60.6	Low	70.7	Confident	132 Å²	132	96.8 Å²	96.8	50%	0.498	53%	0.531	S	S	.	.			trans	-58.1	143	171.4	-68.9	-172.2	-177.1	152.9	10.6	109.6	A408 E414	A408-R410 PolarHBondContact O-N 2.84Å; R410-E414 HydrophobicContact CB-CB 4.44Å; R410-E414 HydrophobicContact CB-CG 4.33Å; R410-E414 HydrophobicContact CG-CG 4.44Å
411	S	79.6	Confident	72.7	Confident	65 Å²	65	94.3 Å²	94.3	46%	0.455	51%	0.508	S	S	.	.			trans	-65.7	153.9	174.5	86.5	0	0	0	0	109.9	M413 E414 L415	S411-M413 PolarHBondContact O-N 3.4Å; S411-M413 PolarHBondContact OG-N 2.9Å; S411-E414 WeakPolarHBondContact O-CB 3.46Å; S411-E414 PolarHBondContact O-N 2.73Å; S411-E414 WeakPolarHBondContact OG-CB 3.42Å; S411-E414 PolarHBondContact OG-N 3.02Å; S411-L415 PolarHBondContact O-N 3.45Å
412	R	83.6	Confident	74.2	Confident	123 Å²	123	96.5 Å²	96.5	46%	0.464	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-27.3	175.8	-176	171.5	166.4	-150	-17.6	111.8	H416 D518 S519	R412-H416 PolarHBondContact O-CD2 3.27Å; R412-H416 PolarHBondContact O-N 2.88Å; R412-D518 IonicContact CZ-OD1 3.58Å; R412-D518 IonicContact NH1-OD1 3.7Å; R412-D518 IonicContact NH2-OD1 2.69Å; R412-D518 PolarHBondContact NH2-OD1 2.92Å; R412-S519 VanDerWaalsContact CD-OG 3.28Å; R412-S519 WeakPolarHBondContact CD-OG 3.37Å; R412-S519 PolarHBondContact NE-OG 2.88Å; R412-S519 VanDerWaalsContact NE-OG 3.12Å; R412-S519 PolarHBondContact NH1-OG 3.01Å; R412-S519 PolarHBondContact NH2-OG 3.36Å
413	M	82.4	Confident	75.8	Confident	57 Å²	57	94.1 Å²	94.1	28%	0.281	49%	0.49	S	S	.	.	H	α-helix	trans	-75.6	-37.5	176.9	-64.5	174.2	74.1	0	0	111.9	S411 L415 H416 S417 E676	S411-M413 PolarHBondContact O-N 3.4Å; S411-M413 PolarHBondContact OG-N 2.9Å; M413-L415 VanDerWaalsContact C-N 3.31Å; M413-L415 PolarHBondContact O-N 2.95Å; M413-H416 CarbonylContact O-C 3.58Å; M413-H416 PolarHBondContact O-N 3.31Å; M413-H416 VanDerWaalsContact O-N 3.11Å; M413-S417 PolarHBondContact O-N 3.08Å; M413-E676 WeakPolarHBondContact CE-OE2 3.23Å
414	E	86.6	Confident	77.4	Confident	91 Å²	91	88.2 Å²	88.2	43%	0.425	46%	0.455	S	S	.	.	H	α-helix	trans	-59.2	-42.1	172	-177	61.9	-161.7	0	0	111.4	R410 S411 H416 S417 Q418	R410-E414 HydrophobicContact CB-CB 4.44Å; R410-E414 HydrophobicContact CB-CG 4.33Å; R410-E414 HydrophobicContact CG-CG 4.44Å; S411-E414 WeakPolarHBondContact O-CB 3.46Å; S411-E414 PolarHBondContact O-N 2.73Å; S411-E414 WeakPolarHBondContact OG-CB 3.42Å; S411-E414 PolarHBondContact OG-N 3.02Å; E414-H416 VanDerWaalsContact C-N 3.34Å; E414-H416 PolarHBondContact O-N 2.88Å; E414-S417 PolarHBondContact O-N 2.7Å; E414-Q418 PolarHBondContact O-N 3.43Å
415	L	88.2	Confident	79.4	Confident	105 Å²	105	81.8 Å²	81.8	55%	0.55	42%	0.423	S	S	.	.	H	α-helix	trans	-64.1	-37.4	174.8	-174.8	65.5	0	0	0	112.5	S411 M413 C419	S411-L415 PolarHBondContact O-N 3.45Å; M413-L415 VanDerWaalsContact C-N 3.31Å; M413-L415 PolarHBondContact O-N 2.95Å; L415-C419 VanDerWaalsContact O-CB 3.28Å; L415-C419 WeakPolarHBondContact O-CB 3.45Å; L415-C419 PolarHBondContact O-N 2.93Å; L415-C419 VanDerWaalsContact O-N 3.12Å
416	H	91	Very high	81.2	Confident	8 Å²	8	85.8 Å²	85.8	4%	0.037	43%	0.432	C	S	.	.	H	α-helix	trans	-68.2	-38.5	173	-72.1	-53.9	0	0	0	111.8	R412 M413 E414 C419 L420 F523 F714 Q718	R412-H416 PolarHBondContact O-CD2 3.27Å; R412-H416 PolarHBondContact O-N 2.88Å; M413-H416 CarbonylContact O-C 3.58Å; M413-H416 PolarHBondContact O-N 3.31Å; M413-H416 VanDerWaalsContact O-N 3.11Å; E414-H416 VanDerWaalsContact C-N 3.34Å; E414-H416 PolarHBondContact O-N 2.88Å; H416-C419 PolarHBondContact O-N 3.24Å; H416-L420 WeakPolarHBondContact O-CB 3.19Å; H416-L420 PolarHBondContact O-N 2.96Å; H416-F523 HydrophobicContact CB-CD1 3.91Å; H416-F523 HydrophobicContact CB-CD2 4.25Å; H416-F523 HydrophobicContact CB-CE1 4.03Å; H416-F523 HydrophobicContact CB-CE2 4.35Å; H416-F523 HydrophobicContact CB-CG 4.02Å; H416-F523 HydrophobicContact CB-CZ 4.25Å; H416-F714 HydrophobicContact CB-CZ 4.22Å; H416-F714 WeakPolarHBondContact O-CE2 3.44Å; H416-F714 WeakPolarHBondContact O-CZ 3.14Å; H416-Q718 PolarHBondContact ND1-NE2 2.83Å
417	S	91.2	Very high	83.4	Confident	10 Å²	10	84 Å²	84	7%	0.07	42%	0.422	C	S	.	.	H	α-helix	trans	-63.3	-51.2	174.6	-165.1	0	0	0	0	111.9	M413 E414 C419 L420 L421 Q679	M413-S417 PolarHBondContact O-N 3.08Å; E414-S417 PolarHBondContact O-N 2.7Å; S417-C419 VanDerWaalsContact C-N 3.29Å; S417-C419 PolarHBondContact O-N 2.79Å; S417-L420 WeakPolarHBondContact O-CB 3.48Å; S417-L420 PolarHBondContact O-N 3.05Å; S417-L421 WeakPolarHBondContact O-CG 3.35Å; S417-L421 PolarHBondContact O-N 3.04Å; S417-Q679 PolarHBondContact OG-OE1 2.86Å
418	Q	91	Very high	85.5	Confident	91 Å²	91	78 Å²	78	43%	0.425	40%	0.4	S	S	.	.	H	α-helix	trans	-58.4	-40.7	178.2	-174.5	170.1	30	0	0	112.1	E414 Q422	E414-Q418 PolarHBondContact O-N 3.43Å; Q418-Q422 WeakPolarHBondContact O-CB 3.28Å; Q418-Q422 PolarHBondContact O-N 3.49Å
419	C	92	Very high	87.5	Confident	23 Å²	23	77.2 Å²	77.2	16%	0.155	38%	0.383	C	S	.	.	H	α-helix	trans	-70.1	-32.9	175.9	179.9	0	0	0	0	112.9	L415 H416 S417 M423 F714 Q718	L415-C419 VanDerWaalsContact O-CB 3.28Å; L415-C419 WeakPolarHBondContact O-CB 3.45Å; L415-C419 PolarHBondContact O-N 2.93Å; L415-C419 VanDerWaalsContact O-N 3.12Å; H416-C419 PolarHBondContact O-N 3.24Å; S417-C419 VanDerWaalsContact C-N 3.29Å; S417-C419 PolarHBondContact O-N 2.79Å; C419-M423 WeakPolarHBondContact O-CG 3.37Å; C419-M423 PolarHBondContact O-N 3.05Å; C419-F714 HydrophobicContact CB-CE2 4.03Å; C419-Q718 PolarHBondContact SG-NE2 3.4Å
420	L	93.6	Very high	89.2	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-65.8	-49.1	173.4	179.9	64.3	0	0	0	110.5	H416 S417 Q422 M423 A424 F523 K527 F680 W710 L711 F714	H416-L420 WeakPolarHBondContact O-CB 3.19Å; H416-L420 PolarHBondContact O-N 2.96Å; S417-L420 WeakPolarHBondContact O-CB 3.48Å; S417-L420 PolarHBondContact O-N 3.05Å; L420-Q422 VanDerWaalsContact C-N 3.34Å; L420-Q422 PolarHBondContact O-N 3.49Å; L420-M423 CarbonylContact O-C 3.59Å; L420-M423 PolarHBondContact O-N 3.4Å; L420-A424 PolarHBondContact O-N 2.9Å; L420-F523 HydrophobicContact CB-CE1 4.3Å; L420-F523 HydrophobicContact CB-CZ 4.15Å; L420-F523 HydrophobicContact CD2-CE1 3.84Å; L420-F523 HydrophobicContact CD2-CZ 3.63Å; L420-K527 HydrophobicContact CD2-CD 4.01Å; L420-F680 HydrophobicContact CD2-CB 4.29Å; L420-F680 HydrophobicContact CD2-CD2 3.67Å; L420-F680 HydrophobicContact CD2-CE2 4.35Å; L420-F680 HydrophobicContact CD2-CG 4.25Å; L420-F680 HydrophobicContact CG-CD2 4.28Å; L420-W710 HydrophobicContact CD1-CD2 4.42Å; L420-W710 HydrophobicContact CD1-CG 4.48Å; L420-W710 HydrophobicContact CD1-CZ2 4.21Å; L420-W710 HydrophobicContact CG-CZ2 3.84Å; L420-W710 WeakPolarHBondContact O-CZ2 3.49Å; L420-W710 PolarHBondContact O-NE1 3.43Å; L420-L711 HydrophobicContact CD1-CD2 4.22Å; L420-F714 VanDerWaalsContact CA-CD2 3.49Å; L420-F714 HydrophobicContact CB-CD2 3.86Å; L420-F714 HydrophobicContact CB-CE2 3.75Å; L420-F714 HydrophobicContact CB-CG 4.32Å; L420-F714 HydrophobicContact CB-CZ 4.15Å; L420-F714 HydrophobicContact CD1-CB 3.67Å; L420-F714 HydrophobicContact CD1-CD1 3.83Å; L420-F714 HydrophobicContact CD1-CD2 3.94Å; L420-F714 HydrophobicContact CD1-CE1 4.4Å; L420-F714 HydrophobicContact CD1-CE2 4.5Å; L420-F714 HydrophobicContact CD1-CG 3.55Å
421	L	93.5	Very high	90.4	Very high	63 Å²	63	71.2 Å²	71.2	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-63.4	-34.9	178.6	-66.9	175.5	0	0	0	113.1	S417 M423 A424 Q679 W710	S417-L421 WeakPolarHBondContact O-CG 3.35Å; S417-L421 PolarHBondContact O-N 3.04Å; L421-M423 PolarHBondContact O-N 3Å; L421-A424 WeakPolarHBondContact O-CB 3.22Å; L421-A424 PolarHBondContact O-N 2.91Å; L421-Q679 HydrophobicContact CD1-CB 4.43Å; L421-Q679 HydrophobicContact CD2-CB 4.46Å; L421-W710 HydrophobicContact CD2-CH2 4.22Å; L421-W710 HydrophobicContact CD2-CZ2 4.25Å
422	Q	93.4	Very high	90.5	Very high	165 Å²	165	74.7 Å²	74.7	77%	0.771	36%	0.362	S	S	*	.	H	α-helix	trans	-63.3	-25.2	173.1	-171.5	177.3	9.3	0	0	113	Q418 L420	Q418-Q422 WeakPolarHBondContact O-CB 3.28Å; Q418-Q422 PolarHBondContact O-N 3.49Å; L420-Q422 VanDerWaalsContact C-N 3.34Å; L420-Q422 PolarHBondContact O-N 3.49Å
423	M	93	Very high	90.2	Very high	68 Å²	68	70.9 Å²	70.9	34%	0.335	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	10	178.9	-62.5	-66.1	-65.6	0	0	113.1	C419 L420 L421 W710 R713 A717	C419-M423 WeakPolarHBondContact O-CG 3.37Å; C419-M423 PolarHBondContact O-N 3.05Å; L420-M423 CarbonylContact O-C 3.59Å; L420-M423 PolarHBondContact O-N 3.4Å; L421-M423 PolarHBondContact O-N 3Å; M423-W710 VanDerWaalsContact O-CD1 3.26Å; M423-W710 PolarHBondContact O-NE1 3.31Å; M423-R713 HydrophobicContact CE-CB 4.02Å; M423-A717 HydrophobicContact CE-CB 4.47Å
424	A	94.3	Very high	89.7	Confident	13 Å²	13	74.5 Å²	74.5	11%	0.107	37%	0.37	C	S	.	.			trans	-67.8	142.4	-171.6	0	0	0	0	0	113.4	L420 L421 W710	L420-A424 PolarHBondContact O-N 2.9Å; L421-A424 WeakPolarHBondContact O-CB 3.22Å; L421-A424 PolarHBondContact O-N 2.91Å; A424-W710 HydrophobicContact CB-CH2 3.96Å; A424-W710 HydrophobicContact CB-CZ2 3.49Å; A424-W710 VanDerWaalsContact CB-CZ2 3.49Å
425	P	95.2	Very high	89	Confident	15 Å²	15	73.7 Å²	73.7	10%	0.097	37%	0.366	C	S	.	.			trans	-69.6	136.2	178.1	28.7	-33.6	0	0	0	110.9	S427 H683 T706 W710	P425-S427 VanDerWaalsContact C-N 3.34Å; P425-H683 PolarHBondContact O-NE2 3.29Å; P425-T706 HydrophobicContact CB-CG2 4.13Å; P425-T706 HydrophobicContact CG-CG2 3.72Å; P425-W710 VanDerWaalsContact CD-CD2 3.48Å; P425-W710 HydrophobicContact CG-CB 4.48Å; P425-W710 HydrophobicContact CG-CD2 4.43Å; P425-W710 HydrophobicContact CG-CE3 4.25Å
426	H	93.7	Very high	88.3	Confident	186 Å²	186	77.4 Å²	77.4	86%	0.861	38%	0.378	S	S	*	.	S	Bend	trans	-84.3	-8.9	174.1	-55	-41.2	0	0	0	113.3
427	S	94.8	Very high	88.1	Confident	89 Å²	89	82.6 Å²	82.6	62%	0.622	40%	0.402	S	S	*	.	S	Bend	trans	-156.7	152.6	179.9	54.3	0	0	0	0	110.5	P425	P425-S427 VanDerWaalsContact C-N 3.34Å
428	A	94.5	Very high	88.2	Confident	31 Å²	31	83.3 Å²	83.3	26%	0.256	41%	0.407	S	S	.	.			trans	-63.7	144.7	176.1	0	0	0	0	0	111.2	R430 V687 T702	A428-R430 PolarHBondContact O-N 2.86Å; A428-V687 HydrophobicContact CB-CG1 4.28Å; A428-V687 VanDerWaalsContact N-CG1 3.26Å; A428-T702 HydrophobicContact CB-CG2 3.86Å
429	L	92.9	Very high	88.3	Confident	70 Å²	70	83 Å²	83	37%	0.366	41%	0.405	S	S	.	.			trans	-65.8	118	170.9	-170.5	76.5	0	0	0	109	V431 L705 T706	L429-V431 PolarHBondContact O-N 3.41Å; L429-V431 VanDerWaalsContact O-N 3.12Å; L429-L705 HydrophobicContact CD2-CB 3.77Å; L429-T706 PolarHBondContact N-OG1 3.19Å
430	R	88.4	Confident	88.4	Confident	194 Å²	194	85 Å²	85	73%	0.732	42%	0.417	S	S	*	.			trans	-64.5	113.8	176.9	-68.4	-173.5	179	-167.8	-0.8	110.4	A428 Y432	A428-R430 PolarHBondContact O-N 2.86Å; R430-Y432 HydrophobicContact CB-CE2 4.08Å; R430-Y432 WeakPolarHBondContact CD-OH 3.49Å
431	V	86	Confident	88.4	Confident	26 Å²	26	85.3 Å²	85.3	16%	0.158	42%	0.418	C	S	.	.			trans	-100.7	106.1	169.8	-166.4	0	0	0	0	107.6	L429 M433 L475 L705	L429-V431 PolarHBondContact O-N 3.41Å; L429-V431 VanDerWaalsContact O-N 3.12Å; V431-M433 HydrophobicContact CB-CE 3.89Å; V431-M433 HydrophobicContact CG1-CE 3.61Å; V431-M433 HydrophobicContact CG1-SD 4.28Å; V431-M433 PolarHBondContact O-N 3.14Å; V431-L475 HydrophobicContact CG1-CD1 3.88Å; V431-L475 HydrophobicContact CG1-CD2 4.01Å; V431-L705 HydrophobicContact CG1-CD1 4.37Å; V431-L705 HydrophobicContact CG2-CD1 3.76Å
432	Y	80.5	Confident	88.6	Confident	138 Å²	138	83.4 Å²	83.4	54%	0.541	41%	0.408	S	S	.	.			trans	-76.1	102.5	178.4	-65.6	-80.8	0	0	0	109.4	R430 D434 Y441	R430-Y432 HydrophobicContact CB-CE2 4.08Å; R430-Y432 WeakPolarHBondContact CD-OH 3.49Å; Y432-D434 PolarHBondContact O-N 2.96Å; Y432-Y441 PolarHBondContact O-OH 3.21Å
433	M	78.2	Confident	88.7	Confident	43 Å²	43	79.2 Å²	79.2	21%	0.212	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.1	-178.2	-63.4	-67.6	172.1	0	0	113.4	V431 E435 Y441 L475 Y478 C701	V431-M433 HydrophobicContact CB-CE 3.89Å; V431-M433 HydrophobicContact CG1-CE 3.61Å; V431-M433 HydrophobicContact CG1-SD 4.28Å; V431-M433 PolarHBondContact O-N 3.14Å; M433-E435 PolarHBondContact O-N 2.99Å; M433-Y441 WeakPolarHBondContact CA-OH 3.46Å; M433-L475 HydrophobicContact CE-CD2 3.55Å; M433-L475 HydrophobicContact SD-CD2 3.41Å; M433-L475 WeakPolarHBondContact SD-CD2 3.29Å; M433-Y478 HydrophobicContact SD-CD1 4.38Å; M433-Y478 HydrophobicContact SD-CE1 4.37Å; M433-C701 HydrophobicContact CE-CB 3.93Å
434	D	72	Confident	88.9	Confident	134 Å²	134	80.1 Å²	80.1	72%	0.717	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.4	-174.6	-52.9	-60.8	0	0	0	114.3	Y432 K436	Y432-D434 PolarHBondContact O-N 2.96Å; D434-K436 VanDerWaalsContact C-N 3.33Å; D434-K436 PolarHBondContact O-N 3.49Å
435	E	71.8	Confident	89	Confident	73 Å²	73	79.5 Å²	79.5	34%	0.341	39%	0.385	S	S	.	.			trans	-65.8	89.4	170.6	-65.1	-176.2	179	0	0	110.2	M433 E437 V440 Y441 C479	M433-E435 PolarHBondContact O-N 2.99Å; E435-E437 PolarHBondContact O-N 3.25Å; E435-V440 WeakPolarHBondContact OE2-CG1 3.24Å; E435-Y441 HydrophobicContact CB-CE2 3.86Å; E435-C479 PolarHBondContact O-SG 3.05Å
436	K	73.8	Confident	89.2	Confident	183 Å²	183	82 Å²	82	80%	0.796	40%	0.395	S	S	*	.			trans	-67.5	7.3	179.8	-60.3	-174	-178.4	-179	0	115.1	D434 T483	D434-K436 VanDerWaalsContact C-N 3.33Å; D434-K436 PolarHBondContact O-N 3.49Å; K436-T483 WeakPolarHBondContact O-CG2 3.25Å
437	E	87.2	Confident	89.4	Confident	117 Å²	117	82 Å²	82	55%	0.547	39%	0.387	S	S	.	.			trans	-119.6	107.3	179.8	-166.9	-174.9	176.6	0	0	110.3	E435 Q439 V440	E435-E437 PolarHBondContact O-N 3.25Å; E437-Q439 HydrophobicContact CG-CB 3.95Å; E437-Q439 PolarHBondContact O-N 2.98Å; E437-V440 HydrophobicContact CB-CG2 4.24Å; E437-V440 PolarHBondContact O-N 3.37Å; E437-V440 VanDerWaalsContact O-N 3.12Å
438	P	91.8	Very high	89.5	Confident	26 Å²	26	78.6 Å²	78.6	17%	0.169	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-18.3	-175.5	24.5	-33.2	0	0	0	112.8	V440 L442 T476 C479 M480	P438-V440 VanDerWaalsContact C-N 3.29Å; P438-V440 PolarHBondContact O-N 3.19Å; P438-L442 WeakPolarHBondContact O-CB 3.39Å; P438-L442 PolarHBondContact O-N 3.26Å; P438-T476 HydrophobicContact CB-CG2 4.15Å; P438-C479 HydrophobicContact CB-CB 3.99Å; P438-C479 VanDerWaalsContact N-SG 3.42Å; P438-M480 HydrophobicContact CB-CE 4.28Å; P438-M480 HydrophobicContact CB-CG 3.76Å; P438-M480 HydrophobicContact CG-CG 3.96Å
439	Q	93.6	Very high	89.7	Confident	83 Å²	83	77.9 Å²	77.9	39%	0.388	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-29.8	177.2	-173.6	56.7	26	0	0	113	E437 L442 E443	E437-Q439 HydrophobicContact CG-CB 3.95Å; E437-Q439 PolarHBondContact O-N 2.98Å; Q439-L442 PolarHBondContact O-N 3.22Å; Q439-E443 PolarHBondContact NE2-OE1 2.82Å; Q439-E443 PolarHBondContact O-N 2.84Å
440	V	93.9	Very high	90	Very high	65 Å²	65	79.2 Å²	79.2	39%	0.394	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-51.2	179.6	-177.3	0	0	0	0	110.6	E435 E437 P438 L442 E443 K444	E435-V440 WeakPolarHBondContact OE2-CG1 3.24Å; E437-V440 HydrophobicContact CB-CG2 4.24Å; E437-V440 PolarHBondContact O-N 3.37Å; E437-V440 VanDerWaalsContact O-N 3.12Å; P438-V440 VanDerWaalsContact C-N 3.29Å; P438-V440 PolarHBondContact O-N 3.19Å; V440-L442 VanDerWaalsContact C-N 3.29Å; V440-L442 PolarHBondContact O-N 2.74Å; V440-E443 PolarHBondContact O-N 2.6Å; V440-K444 WeakPolarHBondContact O-CB 3.39Å; V440-K444 PolarHBondContact O-N 3.27Å; V440-K444 VanDerWaalsContact O-N 3.12Å
441	Y	95.1	Very high	90.4	Very high	9 Å²	9	72.2 Å²	72.2	4%	0.035	34%	0.342	C	S	.	.	H	α-helix	trans	-59.1	-40.1	171.7	-60.9	-65.6	0	0	0	112	Y432 M433 E435 K444 A445 L475 T476 C479	Y432-Y441 PolarHBondContact O-OH 3.21Å; M433-Y441 WeakPolarHBondContact CA-OH 3.46Å; E435-Y441 HydrophobicContact CB-CE2 3.86Å; Y441-K444 WeakPolarHBondContact O-CB 3.14Å; Y441-K444 PolarHBondContact O-N 3.05Å; Y441-A445 WeakPolarHBondContact O-CB 3.46Å; Y441-A445 PolarHBondContact O-N 2.97Å; Y441-L475 HydrophobicContact CD1-CB 3.58Å; Y441-L475 HydrophobicContact CD1-CD1 4.01Å; Y441-L475 HydrophobicContact CD1-CG 4.33Å; Y441-L475 HydrophobicContact CD2-CB 4.23Å; Y441-L475 HydrophobicContact CE1-CB 3.88Å; Y441-L475 HydrophobicContact CE1-CD1 4Å; Y441-L475 HydrophobicContact CE1-CD2 4.36Å; Y441-L475 HydrophobicContact CE1-CG 4.3Å; Y441-L475 HydrophobicContact CE2-CB 4.5Å; Y441-L475 HydrophobicContact CG-CB 3.76Å; Y441-T476 WeakPolarHBondContact CB-OG1 3.35Å; Y441-C479 HydrophobicContact CD2-CB 3.97Å; Y441-C479 HydrophobicContact CE2-CB 3.91Å
442	L	96.4	Very high	91	Very high	23 Å²	23	71 Å²	71	12%	0.12	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-41.7	-177.3	-177.8	55.9	0	0	0	112.7	P438 Q439 V440 A445 K446 F473 T476 M494	P438-L442 WeakPolarHBondContact O-CB 3.39Å; P438-L442 PolarHBondContact O-N 3.26Å; Q439-L442 PolarHBondContact O-N 3.22Å; V440-L442 VanDerWaalsContact C-N 3.29Å; V440-L442 PolarHBondContact O-N 2.74Å; L442-A445 PolarHBondContact O-N 2.94Å; L442-K446 HydrophobicContact CG-CD 4.47Å; L442-K446 VanDerWaalsContact O-CG 3.27Å; L442-K446 WeakPolarHBondContact O-CG 3.27Å; L442-K446 PolarHBondContact O-N 3.49Å; L442-F473 HydrophobicContact CD1-CD1 4Å; L442-F473 HydrophobicContact CD1-CE1 3.84Å; L442-T476 WeakPolarHBondContact CA-OG1 3.38Å; L442-T476 HydrophobicContact CB-CG2 3.92Å; L442-T476 HydrophobicContact CD1-CG2 4.34Å; L442-T476 HydrophobicContact CG-CG2 4.5Å; L442-T476 PolarHBondContact N-OG1 3.4Å; L442-M494 HydrophobicContact CD1-CE 4.18Å
443	E	96.3	Very high	91.8	Very high	77 Å²	77	66.2 Å²	66.2	36%	0.36	32%	0.318	S	S	.	.	H	α-helix	trans	-70.5	-32.9	173.8	-68.1	-49.4	132.1	0	0	112.6	Q439 V440 K446 R447	Q439-E443 PolarHBondContact NE2-OE1 2.82Å; Q439-E443 PolarHBondContact O-N 2.84Å; V440-E443 PolarHBondContact O-N 2.6Å; E443-K446 WeakPolarHBondContact OE1-CD 3.45Å; E443-K446 IonicContact OE1-NZ 2.97Å; E443-K446 PolarHBondContact OE1-NZ 2.84Å; E443-R447 VanDerWaalsContact O-CB 3.28Å; E443-R447 WeakPolarHBondContact O-CB 3.48Å; E443-R447 PolarHBondContact O-N 3.18Å
444	K	95.9	Very high	92.7	Very high	87 Å²	87	67.6 Å²	67.6	38%	0.378	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-44.5	172.4	-160.2	175	-175.9	-170.2	0	111.2	V440 Y441 R447 V448 Y472	V440-K444 WeakPolarHBondContact O-CB 3.39Å; V440-K444 PolarHBondContact O-N 3.27Å; V440-K444 VanDerWaalsContact O-N 3.12Å; Y441-K444 WeakPolarHBondContact O-CB 3.14Å; Y441-K444 PolarHBondContact O-N 3.05Å; K444-R447 PolarHBondContact O-N 3.39Å; K444-V448 WeakPolarHBondContact O-CG2 3.26Å; K444-V448 PolarHBondContact O-N 3.48Å; K444-Y472 HydrophobicContact CB-CG 4.37Å; K444-Y472 HydrophobicContact CD-CD1 3.79Å; K444-Y472 HydrophobicContact CD-CD2 4.36Å; K444-Y472 HydrophobicContact CD-CE1 3.56Å; K444-Y472 HydrophobicContact CD-CE2 4.12Å; K444-Y472 HydrophobicContact CD-CG 4.22Å; K444-Y472 VanDerWaalsContact CE-OH 3.3Å; K444-Y472 WeakPolarHBondContact CE-OH 3.35Å; K444-Y472 HydrophobicContact CG-CD1 4.24Å; K444-Y472 HydrophobicContact CG-CD2 4.04Å; K444-Y472 HydrophobicContact CG-CE1 4.29Å; K444-Y472 HydrophobicContact CG-CE2 4.04Å; K444-Y472 HydrophobicContact CG-CG 4.15Å; K444-Y472 PolarHBondContact NZ-OH 3.12Å
445	A	97.7	Very high	93.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-49.7	176.1	0	0	0	0	0	112	Y441 L442 R447 V448 K449 F473	Y441-A445 WeakPolarHBondContact O-CB 3.46Å; Y441-A445 PolarHBondContact O-N 2.97Å; L442-A445 PolarHBondContact O-N 2.94Å; A445-R447 VanDerWaalsContact C-N 3.34Å; A445-R447 PolarHBondContact O-N 3.17Å; A445-V448 PolarHBondContact O-N 3.01Å; A445-K449 VanDerWaalsContact O-CB 3.26Å; A445-K449 WeakPolarHBondContact O-CB 3.38Å; A445-K449 PolarHBondContact O-N 3.2Å; A445-F473 HydrophobicContact CB-CB 4.49Å; A445-F473 HydrophobicContact CB-CD1 3.33Å; A445-F473 HydrophobicContact CB-CD2 3.99Å; A445-F473 HydrophobicContact CB-CE1 3.39Å; A445-F473 HydrophobicContact CB-CE2 4.01Å; A445-F473 HydrophobicContact CB-CG 3.66Å; A445-F473 HydrophobicContact CB-CZ 3.74Å
446	K	98.2	Very high	94.6	Very high	67 Å²	67	66.1 Å²	66.1	29%	0.291	33%	0.333	S	S	.	.	H	α-helix	trans	-56.2	-46.2	174	-72.3	165.8	-173.2	168	0	111.8	L442 E443 K449 H450	L442-K446 HydrophobicContact CG-CD 4.47Å; L442-K446 VanDerWaalsContact O-CG 3.27Å; L442-K446 WeakPolarHBondContact O-CG 3.27Å; L442-K446 PolarHBondContact O-N 3.49Å; E443-K446 WeakPolarHBondContact OE1-CD 3.45Å; E443-K446 IonicContact OE1-NZ 2.97Å; E443-K446 PolarHBondContact OE1-NZ 2.84Å; K446-K449 PolarHBondContact O-N 3.33Å; K446-H450 WeakPolarHBondContact O-CB 3.49Å; K446-H450 PolarHBondContact O-N 2.65Å; K446-H450 PolarHBondContact O-ND1 2.88Å
447	R	98.4	Very high	95.4	Very high	186 Å²	186	61.6 Å²	61.6	70%	0.702	33%	0.329	S	S	*	.	H	α-helix	trans	-60.6	-48.2	-179.6	-170.4	-174.3	-56.1	175	4	112	E443 K444 A445 H450 A451	E443-R447 VanDerWaalsContact O-CB 3.28Å; E443-R447 WeakPolarHBondContact O-CB 3.48Å; E443-R447 PolarHBondContact O-N 3.18Å; K444-R447 PolarHBondContact O-N 3.39Å; A445-R447 VanDerWaalsContact C-N 3.34Å; A445-R447 PolarHBondContact O-N 3.17Å; R447-H450 PolarHBondContact O-N 2.69Å; R447-A451 PolarHBondContact O-N 3.44Å; R447-A451 VanDerWaalsContact O-N 3.12Å
448	V	98.1	Very high	95.6	Very high	19 Å²	19	58.3 Å²	58.3	12%	0.115	32%	0.316	C	S	.	.	H	α-helix	trans	-69.7	-38.7	178.7	-178.6	0	0	0	0	111.1	K444 A445 H450 A451 A452 L465 E468 Y472	K444-V448 WeakPolarHBondContact O-CG2 3.26Å; K444-V448 PolarHBondContact O-N 3.48Å; A445-V448 PolarHBondContact O-N 3.01Å; V448-H450 PolarHBondContact O-N 3.12Å; V448-A451 WeakPolarHBondContact O-CB 3.32Å; V448-A451 PolarHBondContact O-N 3.08Å; V448-A452 PolarHBondContact O-N 3.33Å; V448-L465 HydrophobicContact CG1-CB 4.42Å; V448-L465 HydrophobicContact CG1-CD2 4.27Å; V448-L465 VanDerWaalsContact CG1-O 3.29Å; V448-L465 WeakPolarHBondContact CG1-O 3.38Å; V448-E468 HydrophobicContact CG1-CB 3.95Å; V448-E468 HydrophobicContact CG1-CG 3.91Å; V448-Y472 HydrophobicContact CG2-CD2 4.18Å; V448-Y472 HydrophobicContact CG2-CE2 4.08Å
449	K	98.1	Very high	95.7	Very high	15 Å²	15	61 Å²	61	7%	0.065	33%	0.325	C	S	.	.	H	α-helix	trans	-59.9	-46.3	174	-170.9	-157.9	171	-59.8	0	111.2	A445 K446 A451 A452 D453 Y466 F473	A445-K449 VanDerWaalsContact O-CB 3.26Å; A445-K449 WeakPolarHBondContact O-CB 3.38Å; A445-K449 PolarHBondContact O-N 3.2Å; K446-K449 PolarHBondContact O-N 3.33Å; K449-A451 VanDerWaalsContact C-N 3.28Å; K449-A451 PolarHBondContact O-N 3.05Å; K449-A452 CarbonylContact O-C 3.28Å; K449-A452 WeakPolarHBondContact O-CA 3.39Å; K449-A452 WeakPolarHBondContact O-CB 3.37Å; K449-A452 PolarHBondContact O-N 3.21Å; K449-A452 VanDerWaalsContact O-N 3.09Å; K449-D453 IonicContact NZ-OD1 2.62Å; K449-D453 PolarHBondContact NZ-OD1 2.85Å; K449-D453 IonicContact NZ-OD2 3.91Å; K449-D453 PolarHBondContact NZ-OD2 3.29Å; K449-D453 PolarHBondContact O-N 2.92Å; K449-Y466 HydrophobicContact CG-CD1 4.41Å; K449-Y466 HydrophobicContact CG-CE1 4.17Å; K449-F473 HydrophobicContact CB-CE2 4.32Å; K449-F473 HydrophobicContact CB-CZ 4.46Å; K449-F473 HydrophobicContact CD-CE2 4.26Å; K449-F473 HydrophobicContact CD-CZ 4.23Å
450	H	98.2	Very high	95.7	Very high	99 Å²	99	57.2 Å²	57.2	46%	0.458	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-32	177.1	-65.6	150.6	0	0	0	112.6	K446 R447 V448 D453 A454	K446-H450 WeakPolarHBondContact O-CB 3.49Å; K446-H450 PolarHBondContact O-N 2.65Å; K446-H450 PolarHBondContact O-ND1 2.88Å; R447-H450 PolarHBondContact O-N 2.69Å; V448-H450 PolarHBondContact O-N 3.12Å; H450-D453 IonicContact CD2-OD2 3.87Å; H450-D453 PolarHBondContact CD2-OD2 2.81Å; H450-D453 PolarHBondContact O-N 3.21Å; H450-A454 WeakPolarHBondContact O-CB 3.16Å; H450-A454 PolarHBondContact O-N 3.32Å
451	A	98	Very high	95.8	Very high	47 Å²	47	55.7 Å²	55.7	39%	0.388	30%	0.297	S	S	.	.	H	α-helix	trans	-66.7	-39.2	170.9	0	0	0	0	0	112.2	R447 V448 K449 A454 Q455 L465	R447-A451 PolarHBondContact O-N 3.44Å; R447-A451 VanDerWaalsContact O-N 3.12Å; V448-A451 WeakPolarHBondContact O-CB 3.32Å; V448-A451 PolarHBondContact O-N 3.08Å; K449-A451 VanDerWaalsContact C-N 3.28Å; K449-A451 PolarHBondContact O-N 3.05Å; A451-A454 PolarHBondContact O-N 2.95Å; A451-Q455 PolarHBondContact O-N 2.98Å; A451-L465 HydrophobicContact CB-CD1 4.39Å
452	A	97.9	Very high	95.8	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-44.7	171.3	0	0	0	0	0	112	V448 K449 A454 Q455 R462 L465 Y466	V448-A452 PolarHBondContact O-N 3.33Å; K449-A452 CarbonylContact O-C 3.28Å; K449-A452 WeakPolarHBondContact O-CA 3.39Å; K449-A452 WeakPolarHBondContact O-CB 3.37Å; K449-A452 PolarHBondContact O-N 3.21Å; K449-A452 VanDerWaalsContact O-N 3.09Å; A452-A454 VanDerWaalsContact C-N 3.26Å; A452-A454 PolarHBondContact O-N 2.9Å; A452-Q455 PolarHBondContact O-N 2.93Å; A452-R462 HydrophobicContact CB-CG 4.32Å; A452-R462 WeakPolarHBondContact O-CD 3.33Å; A452-R462 VanDerWaalsContact O-CG 3.29Å; A452-R462 WeakPolarHBondContact O-CG 3.22Å; A452-L465 HydrophobicContact CB-CB 3.67Å; A452-Y466 HydrophobicContact CB-CD1 3.55Å; A452-Y466 HydrophobicContact CB-CD2 4.17Å; A452-Y466 HydrophobicContact CB-CE1 3.67Å; A452-Y466 HydrophobicContact CB-CE2 4.29Å; A452-Y466 HydrophobicContact CB-CG 3.8Å
453	D	97	Very high	95.9	Very high	38 Å²	38	56 Å²	56	20%	0.203	30%	0.297	C	S	.	.	H	α-helix	trans	-58.4	-38.8	177.7	-62	-31.1	0	0	0	111.5	F320 K449 H450 Q455 Y466	F320-D453 HydrophobicContact CZ-CB 4.15Å; F320-D453 WeakPolarHBondContact CZ-OD1 3.2Å; K449-D453 IonicContact NZ-OD1 2.62Å; K449-D453 PolarHBondContact NZ-OD1 2.85Å; K449-D453 IonicContact NZ-OD2 3.91Å; K449-D453 PolarHBondContact NZ-OD2 3.29Å; K449-D453 PolarHBondContact O-N 2.92Å; H450-D453 IonicContact CD2-OD2 3.87Å; H450-D453 PolarHBondContact CD2-OD2 2.81Å; H450-D453 PolarHBondContact O-N 3.21Å; D453-Q455 VanDerWaalsContact C-N 3.35Å; D453-Y466 WeakPolarHBondContact OD1-CE1 3.43Å; D453-Y466 PolarHBondContact OD1-OH 3.39Å; D453-Y466 VanDerWaalsContact OD1-OH 3.07Å
454	A	97.1	Very high	96	Very high	71 Å²	71	52.3 Å²	52.3	59%	0.587	28%	0.279	S	S	*	.	H	α-helix	trans	-72.2	-23.1	176.8	0	0	0	0	0	113.8	H450 A451 A452 T456	H450-A454 WeakPolarHBondContact O-CB 3.16Å; H450-A454 PolarHBondContact O-N 3.32Å; A451-A454 PolarHBondContact O-N 2.95Å; A452-A454 VanDerWaalsContact C-N 3.26Å; A452-A454 PolarHBondContact O-N 2.9Å; A454-T456 PolarHBondContact O-N 3.45Å
455	Q	94.3	Very high	96.1	Very high	61 Å²	61	49.2 Å²	49.2	29%	0.285	27%	0.267	S	S	.	.			trans	-78.6	71.5	-177.7	-164.2	62.6	21.7	0	0	111.5	A451 A452 D453 D458 L461 R462	A451-Q455 PolarHBondContact O-N 2.98Å; A452-Q455 PolarHBondContact O-N 2.93Å; D453-Q455 VanDerWaalsContact C-N 3.35Å; Q455-D458 HydrophobicContact CG-CB 4.05Å; Q455-D458 VanDerWaalsContact NE2-CB 3.26Å; Q455-L461 HydrophobicContact CG-CB 4.24Å; Q455-L461 HydrophobicContact CG-CD2 4.24Å; Q455-L461 HydrophobicContact CG-CG 4.3Å; Q455-R462 HydrophobicContact CB-CB 4.06Å; Q455-R462 HydrophobicContact CG-CB 4.26Å; Q455-R462 WeakPolarHBondContact O-CD 3.46Å; Q455-R462 PolarHBondContact O-NH1 3.35Å
456	T	89.2	Confident	96.1	Very high	115 Å²	115	50.3 Å²	50.3	71%	0.706	27%	0.271	S	S	*	.			trans	-70	-43.1	-175.9	52.4	0	0	0	0	113.1	A454 R462	A454-T456 PolarHBondContact O-N 3.45Å; T456-R462 PolarHBondContact O-NH1 3.49Å
457	A	90.5	Very high	96.1	Very high	88 Å²	88	47.3 Å²	47.3	73%	0.727	26%	0.258	S	S	*	.	S	Bend	trans	-77.1	-49.3	-175.1	0	0	0	0	0	113.5	K459	A457-K459 PolarHBondContact O-N 2.76Å
458	D	92.4	Very high	96.1	Very high	48 Å²	48	39.3 Å²	39.3	26%	0.257	23%	0.229	S	C	.	.			trans	-90.7	99.5	-175.5	-161.4	-53.8	0	0	0	112	Q455 S460 L461 R462 H715	Q455-D458 HydrophobicContact CG-CB 4.05Å; Q455-D458 VanDerWaalsContact NE2-CB 3.26Å; D458-S460 VanDerWaalsContact C-N 3.25Å; D458-S460 PolarHBondContact O-N 2.9Å; D458-S460 WeakPolarHBondContact OD1-CA 3.19Å; D458-S460 PolarHBondContact OD1-N 3.38Å; D458-L461 HydrophobicContact CB-CB 4.07Å; D458-L461 PolarHBondContact OD1-N 2.95Å; D458-R462 VanDerWaalsContact O-CB 3.24Å; D458-R462 WeakPolarHBondContact O-CB 3.38Å; D458-R462 PolarHBondContact O-N 3.34Å; D458-R462 VanDerWaalsContact O-N 3.09Å; D458-H715 IonicContact OD1-CD2 3.14Å; D458-H715 IonicContact OD1-CE1 3.21Å; D458-H715 IonicContact OD1-NE2 2.78Å; D458-H715 PolarHBondContact OD1-NE2 3.12Å; D458-H715 IonicContact OD2-CE1 3.08Å; D458-H715 PolarHBondContact OD2-CE1 3.14Å; D458-H715 IonicContact OD2-NE2 2.69Å; D458-H715 PolarHBondContact OD2-NE2 3.19Å
459	K	93	Very high	96.1	Very high	84 Å²	84	38.4 Å²	38.4	37%	0.365	22%	0.223	S	C	.	.	H	α-helix	trans	-58.4	-35.9	178.2	-62.2	172.1	178.4	174.7	0	112.8	A457 I463 Y509 Q512	A457-K459 PolarHBondContact O-N 2.76Å; K459-I463 PolarHBondContact O-N 3.35Å; K459-Y509 HydrophobicContact CB-CD2 4.28Å; K459-Y509 HydrophobicContact CB-CE2 4.08Å; K459-Y509 WeakPolarHBondContact O-CD2 3.31Å; K459-Y509 VanDerWaalsContact O-CE2 3.29Å; K459-Y509 WeakPolarHBondContact O-CE2 3.45Å; K459-Q512 HydrophobicContact CD-CB 4.04Å; K459-Q512 PolarHBondContact NZ-O 3.2Å
460	S	94	Very high	96.1	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-81.9	-45.2	-172	-68	0	0	0	0	111.7	D458 R462 I463 I464 Y509	D458-S460 VanDerWaalsContact C-N 3.25Å; D458-S460 PolarHBondContact O-N 2.9Å; D458-S460 WeakPolarHBondContact OD1-CA 3.19Å; D458-S460 PolarHBondContact OD1-N 3.38Å; S460-R462 VanDerWaalsContact C-N 3.25Å; S460-R462 PolarHBondContact O-N 3.2Å; S460-I463 VanDerWaalsContact O-CG2 3.25Å; S460-I463 WeakPolarHBondContact O-CG2 3.24Å; S460-I463 PolarHBondContact O-N 2.88Å; S460-I464 WeakPolarHBondContact O-CD1 3.27Å; S460-I464 VanDerWaalsContact O-CG1 3.29Å; S460-I464 WeakPolarHBondContact O-CG1 3.42Å; S460-I464 PolarHBondContact O-N 3.43Å; S460-I464 VanDerWaalsContact O-N 3.12Å; S460-Y509 PolarHBondContact OG-OH 3.45Å
461	L	95.8	Very high	96.1	Very high	32 Å²	32	33 Å²	33	17%	0.168	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-39.8	170.9	-178	58.5	0	0	0	110.9	Q455 D458 I463 I464 L465 R712	Q455-L461 HydrophobicContact CG-CB 4.24Å; Q455-L461 HydrophobicContact CG-CD2 4.24Å; Q455-L461 HydrophobicContact CG-CG 4.3Å; D458-L461 HydrophobicContact CB-CB 4.07Å; D458-L461 PolarHBondContact OD1-N 2.95Å; L461-I463 PolarHBondContact O-N 3.33Å; L461-I464 PolarHBondContact O-N 3.1Å; L461-L465 HydrophobicContact CD1-CD1 4.26Å; L461-L465 HydrophobicContact CD1-CG 4.2Å; L461-L465 HydrophobicContact CG-CD1 4Å; L461-L465 HydrophobicContact CG-CG 4.39Å; L461-L465 WeakPolarHBondContact O-CG 3.2Å; L461-L465 PolarHBondContact O-N 2.79Å; L461-R712 HydrophobicContact CD1-CG 4.31Å
462	R	96.5	Very high	96.1	Very high	37 Å²	37	31.3 Å²	31.3	14%	0.14	18%	0.182	C	C	.	.	H	α-helix	trans	-58.2	-47.2	176.6	179.2	173.7	70.7	-137.5	1.5	113.1	A452 Q455 T456 D458 S460 L465 Y466	A452-R462 HydrophobicContact CB-CG 4.32Å; A452-R462 WeakPolarHBondContact O-CD 3.33Å; A452-R462 VanDerWaalsContact O-CG 3.29Å; A452-R462 WeakPolarHBondContact O-CG 3.22Å; Q455-R462 HydrophobicContact CB-CB 4.06Å; Q455-R462 HydrophobicContact CG-CB 4.26Å; Q455-R462 WeakPolarHBondContact O-CD 3.46Å; Q455-R462 PolarHBondContact O-NH1 3.35Å; T456-R462 PolarHBondContact O-NH1 3.49Å; D458-R462 VanDerWaalsContact O-CB 3.24Å; D458-R462 WeakPolarHBondContact O-CB 3.38Å; D458-R462 PolarHBondContact O-N 3.34Å; D458-R462 VanDerWaalsContact O-N 3.09Å; S460-R462 VanDerWaalsContact C-N 3.25Å; S460-R462 PolarHBondContact O-N 3.2Å; R462-L465 PolarHBondContact O-N 3.1Å; R462-Y466 HydrophobicContact CG-CD2 3.73Å; R462-Y466 HydrophobicContact CG-CE2 3.43Å; R462-Y466 VanDerWaalsContact CG-CE2 3.43Å; R462-Y466 VanDerWaalsContact O-CD2 3.3Å; R462-Y466 WeakPolarHBondContact O-CD2 3.48Å; R462-Y466 PolarHBondContact O-N 2.9Å
463	I	97.3	Very high	96.1	Very high	2 Å²	2	32 Å²	32	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-32.2	-180	-171.1	61.5	0	0	0	112.1	K459 S460 L461 Y466 L467 V505 Y509 I528	K459-I463 PolarHBondContact O-N 3.35Å; S460-I463 VanDerWaalsContact O-CG2 3.25Å; S460-I463 WeakPolarHBondContact O-CG2 3.24Å; S460-I463 PolarHBondContact O-N 2.88Å; L461-I463 PolarHBondContact O-N 3.33Å; I463-Y466 PolarHBondContact O-N 2.85Å; I463-L467 WeakPolarHBondContact O-CG 3.41Å; I463-L467 PolarHBondContact O-N 3.12Å; I463-V505 HydrophobicContact CD1-CB 4.2Å; I463-V505 HydrophobicContact CD1-CG2 3.87Å; I463-Y509 HydrophobicContact CB-CD1 4.28Å; I463-Y509 HydrophobicContact CB-CD2 3.79Å; I463-Y509 HydrophobicContact CB-CE2 4.24Å; I463-Y509 HydrophobicContact CB-CG 3.81Å; I463-Y509 HydrophobicContact CG1-CD1 4.07Å; I463-Y509 HydrophobicContact CG1-CD2 4.4Å; I463-Y509 HydrophobicContact CG1-CG 3.9Å; I463-Y509 HydrophobicContact CG2-CD1 3.94Å; I463-Y509 HydrophobicContact CG2-CD2 3.54Å; I463-Y509 HydrophobicContact CG2-CE1 3.86Å; I463-Y509 HydrophobicContact CG2-CE2 3.46Å; I463-Y509 VanDerWaalsContact CG2-CE2 3.46Å; I463-Y509 HydrophobicContact CG2-CG 3.78Å; I463-I528 HydrophobicContact CG1-CG2 3.81Å; I463-I528 HydrophobicContact CG2-CD1 3.81Å; I463-I528 HydrophobicContact CG2-CG2 4.21Å
464	I	97.8	Very high	96.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-45.3	172.7	-65.9	162.9	0	0	0	110.5	S460 L461 L467 E468 A708 L711 R712 H715	S460-I464 WeakPolarHBondContact O-CD1 3.27Å; S460-I464 VanDerWaalsContact O-CG1 3.29Å; S460-I464 WeakPolarHBondContact O-CG1 3.42Å; S460-I464 PolarHBondContact O-N 3.43Å; S460-I464 VanDerWaalsContact O-N 3.12Å; L461-I464 PolarHBondContact O-N 3.1Å; I464-L467 PolarHBondContact O-N 3.32Å; I464-E468 PolarHBondContact O-N 3.26Å; I464-A708 WeakPolarHBondContact CG2-O 3.5Å; I464-L711 HydrophobicContact CD1-CB 3.94Å; I464-L711 HydrophobicContact CG1-CB 4.24Å; I464-L711 HydrophobicContact CG2-CB 4.49Å; I464-R712 HydrophobicContact CG2-CB 3.97Å; I464-H715 HydrophobicContact CD1-CB 4.42Å
465	L	98.2	Very high	96.1	Very high	21 Å²	21	26.8 Å²	26.8	11%	0.11	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-36.4	174.3	-68.4	171.5	0	0	0	112.2	V448 A451 A452 L461 R462 E468 S469	V448-L465 HydrophobicContact CG1-CB 4.42Å; V448-L465 HydrophobicContact CG1-CD2 4.27Å; V448-L465 VanDerWaalsContact CG1-O 3.29Å; V448-L465 WeakPolarHBondContact CG1-O 3.38Å; A451-L465 HydrophobicContact CB-CD1 4.39Å; A452-L465 HydrophobicContact CB-CB 3.67Å; L461-L465 HydrophobicContact CD1-CD1 4.26Å; L461-L465 HydrophobicContact CD1-CG 4.2Å; L461-L465 HydrophobicContact CG-CD1 4Å; L461-L465 HydrophobicContact CG-CG 4.39Å; L461-L465 WeakPolarHBondContact O-CG 3.2Å; L461-L465 PolarHBondContact O-N 2.79Å; R462-L465 PolarHBondContact O-N 3.1Å; L465-E468 PolarHBondContact O-N 3.43Å; L465-S469 WeakPolarHBondContact O-CB 3.37Å; L465-S469 PolarHBondContact O-N 2.91Å
466	Y	98.4	Very high	96.2	Very high	24 Å²	24	23.9 Å²	23.9	9%	0.094	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-43.4	172.4	-80.7	-49.9	0	0	0	112	K449 A452 D453 R462 I463 S469 V470 V505	K449-Y466 HydrophobicContact CG-CD1 4.41Å; K449-Y466 HydrophobicContact CG-CE1 4.17Å; A452-Y466 HydrophobicContact CB-CD1 3.55Å; A452-Y466 HydrophobicContact CB-CD2 4.17Å; A452-Y466 HydrophobicContact CB-CE1 3.67Å; A452-Y466 HydrophobicContact CB-CE2 4.29Å; A452-Y466 HydrophobicContact CB-CG 3.8Å; D453-Y466 WeakPolarHBondContact OD1-CE1 3.43Å; D453-Y466 PolarHBondContact OD1-OH 3.39Å; D453-Y466 VanDerWaalsContact OD1-OH 3.07Å; R462-Y466 HydrophobicContact CG-CD2 3.73Å; R462-Y466 HydrophobicContact CG-CE2 3.43Å; R462-Y466 VanDerWaalsContact CG-CE2 3.43Å; R462-Y466 VanDerWaalsContact O-CD2 3.3Å; R462-Y466 WeakPolarHBondContact O-CD2 3.48Å; R462-Y466 PolarHBondContact O-N 2.9Å; I463-Y466 PolarHBondContact O-N 2.85Å; Y466-S469 WeakPolarHBondContact CA-OG 3.36Å; Y466-S469 PolarHBondContact O-N 3.34Å; Y466-S469 PolarHBondContact O-OG 3.24Å; Y466-V470 WeakPolarHBondContact O-CB 3.49Å; Y466-V470 WeakPolarHBondContact O-CG2 3.36Å; Y466-V470 PolarHBondContact O-N 3.48Å; Y466-V505 HydrophobicContact CD1-CG1 4Å; Y466-V505 HydrophobicContact CD2-CB 3.78Å; Y466-V505 HydrophobicContact CD2-CG1 3.77Å; Y466-V505 HydrophobicContact CD2-CG2 4.28Å; Y466-V505 HydrophobicContact CE1-CG1 4.02Å; Y466-V505 HydrophobicContact CE2-CB 4.13Å; Y466-V505 HydrophobicContact CE2-CG1 3.78Å; Y466-V505 HydrophobicContact CG-CB 4.08Å; Y466-V505 HydrophobicContact CG-CG1 3.9Å; Y466-V505 HydrophobicContact CG-CG2 4.16Å
467	L	98.2	Very high	96.5	Very high	3 Å²	3	18.4 Å²	18.4	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-58.4	-47.4	174.3	-74.7	171.3	0	0	0	111.1	I463 I464 S469 V470 I471 L502 I528 M704	I463-L467 WeakPolarHBondContact O-CG 3.41Å; I463-L467 PolarHBondContact O-N 3.12Å; I464-L467 PolarHBondContact O-N 3.32Å; L467-S469 VanDerWaalsContact C-N 3.33Å; L467-S469 PolarHBondContact O-N 3.34Å; L467-V470 PolarHBondContact O-N 3.09Å; L467-I471 WeakPolarHBondContact O-CG1 3.2Å; L467-I471 PolarHBondContact O-N 3.19Å; L467-I471 VanDerWaalsContact O-N 3.12Å; L467-L502 HydrophobicContact CD2-CD1 3.72Å; L467-I528 HydrophobicContact CD1-CG2 4.36Å; L467-M704 HydrophobicContact CD2-CE 4.18Å
468	E	98.1	Very high	96.7	Very high	18 Å²	18	16.9 Å²	16.9	8%	0.084	8%	0.076	C	C	.	.	H	α-helix	trans	-57.7	-43.8	174.5	-176	-179.8	-175.8	0	0	111.7	V448 I464 L465 I471 Y472 L705 A708 R712	V448-E468 HydrophobicContact CG1-CB 3.95Å; V448-E468 HydrophobicContact CG1-CG 3.91Å; I464-E468 PolarHBondContact O-N 3.26Å; L465-E468 PolarHBondContact O-N 3.43Å; E468-I471 PolarHBondContact O-N 3.09Å; E468-Y472 HydrophobicContact CG-CD2 4.29Å; E468-Y472 HydrophobicContact CG-CE2 3.64Å; E468-Y472 WeakPolarHBondContact O-CD2 3.46Å; E468-Y472 PolarHBondContact O-N 3.3Å; E468-L705 HydrophobicContact CG-CD2 3.89Å; E468-A708 HydrophobicContact CB-CB 4.3Å; E468-R712 IonicContact OE1-CZ 3.35Å; E468-R712 IonicContact OE1-NH1 2.7Å; E468-R712 PolarHBondContact OE1-NH1 2.61Å; E468-R712 IonicContact OE2-CZ 2.72Å; E468-R712 IonicContact OE2-NH1 2.67Å; E468-R712 PolarHBondContact OE2-NH1 2.89Å
469	S	98.2	Very high	96.8	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-66.4	-37.9	177.3	76.5	0	0	0	0	113.6	L465 Y466 L467 I471 Y472 F473	L465-S469 WeakPolarHBondContact O-CB 3.37Å; L465-S469 PolarHBondContact O-N 2.91Å; Y466-S469 WeakPolarHBondContact CA-OG 3.36Å; Y466-S469 PolarHBondContact O-N 3.34Å; Y466-S469 PolarHBondContact O-OG 3.24Å; L467-S469 VanDerWaalsContact C-N 3.33Å; L467-S469 PolarHBondContact O-N 3.34Å; S469-I471 VanDerWaalsContact C-N 3.35Å; S469-Y472 PolarHBondContact O-N 2.99Å; S469-F473 WeakPolarHBondContact O-CD2 3.24Å; S469-F473 PolarHBondContact O-N 3.32Å; S469-F473 VanDerWaalsContact O-N 3.08Å
470	V	98.4	Very high	96.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61	-45.7	177.1	159.9	0	0	0	0	109.6	Y466 L467 Y472 F473 V474 T498 L501 L502 V535	Y466-V470 WeakPolarHBondContact O-CB 3.49Å; Y466-V470 WeakPolarHBondContact O-CG2 3.36Å; Y466-V470 PolarHBondContact O-N 3.48Å; L467-V470 PolarHBondContact O-N 3.09Å; V470-Y472 VanDerWaalsContact C-N 3.32Å; V470-Y472 PolarHBondContact O-N 3.3Å; V470-F473 CarbonylContact O-C 3.45Å; V470-F473 WeakPolarHBondContact O-CA 3.15Å; V470-F473 WeakPolarHBondContact O-CB 3.31Å; V470-F473 PolarHBondContact O-N 3.44Å; V470-V474 HydrophobicContact CG1-CG2 4.43Å; V470-V474 WeakPolarHBondContact O-CG2 3.05Å; V470-V474 PolarHBondContact O-N 2.92Å; V470-T498 HydrophobicContact CG1-CG2 3.91Å; V470-L501 HydrophobicContact CG2-CD2 4.32Å; V470-L501 HydrophobicContact CG2-CG 4.45Å; V470-L502 HydrophobicContact CG1-CB 4.26Å; V470-L502 HydrophobicContact CG1-CD2 4.31Å; V470-L502 HydrophobicContact CG2-CB 4.13Å; V470-L502 HydrophobicContact CG2-CD1 4.39Å; V470-V535 HydrophobicContact CG1-CG1 4.26Å
471	I	98	Very high	96.9	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-63.4	-36.4	178.7	-59	-59.6	0	0	0	112.3	L467 E468 S469 F473 V474 L475 V535 C701 M704 L705	L467-I471 WeakPolarHBondContact O-CG1 3.2Å; L467-I471 PolarHBondContact O-N 3.19Å; L467-I471 VanDerWaalsContact O-N 3.12Å; E468-I471 PolarHBondContact O-N 3.09Å; S469-I471 VanDerWaalsContact C-N 3.35Å; I471-F473 VanDerWaalsContact C-N 3.32Å; I471-F473 PolarHBondContact O-N 3.25Å; I471-V474 WeakPolarHBondContact O-CB 3.27Å; I471-V474 PolarHBondContact O-N 3.41Å; I471-L475 HydrophobicContact CG2-CD1 4.2Å; I471-L475 HydrophobicContact CG2-CG 4.48Å; I471-L475 WeakPolarHBondContact O-CG 3.45Å; I471-L475 PolarHBondContact O-N 2.87Å; I471-V535 HydrophobicContact CD1-CG1 4.44Å; I471-V535 HydrophobicContact CD1-CG2 4.14Å; I471-C701 HydrophobicContact CG2-CB 3.7Å; I471-M704 HydrophobicContact CD1-CB 3.51Å; I471-M704 HydrophobicContact CD1-CG 3.84Å; I471-M704 HydrophobicContact CG1-CB 3.63Å; I471-M704 HydrophobicContact CG1-CG 4.47Å; I471-L705 HydrophobicContact CB-CD2 4.11Å; I471-L705 HydrophobicContact CB-CG 4.17Å; I471-L705 HydrophobicContact CG2-CD1 3.9Å; I471-L705 HydrophobicContact CG2-CD2 4.16Å; I471-L705 HydrophobicContact CG2-CG 3.72Å
472	Y	97.6	Very high	96.7	Very high	12 Å²	12	19 Å²	19	5%	0.047	8%	0.084	C	C	.	.	H	α-helix	trans	-67.7	-29.4	172.4	-64.6	-54	0	0	0	113.3	K444 V448 E468 S469 V470 L475 T476 L705	K444-Y472 HydrophobicContact CB-CG 4.37Å; K444-Y472 HydrophobicContact CD-CD1 3.79Å; K444-Y472 HydrophobicContact CD-CD2 4.36Å; K444-Y472 HydrophobicContact CD-CE1 3.56Å; K444-Y472 HydrophobicContact CD-CE2 4.12Å; K444-Y472 HydrophobicContact CD-CG 4.22Å; K444-Y472 VanDerWaalsContact CE-OH 3.3Å; K444-Y472 WeakPolarHBondContact CE-OH 3.35Å; K444-Y472 HydrophobicContact CG-CD1 4.24Å; K444-Y472 HydrophobicContact CG-CD2 4.04Å; K444-Y472 HydrophobicContact CG-CE1 4.29Å; K444-Y472 HydrophobicContact CG-CE2 4.04Å; K444-Y472 HydrophobicContact CG-CG 4.15Å; K444-Y472 PolarHBondContact NZ-OH 3.12Å; V448-Y472 HydrophobicContact CG2-CD2 4.18Å; V448-Y472 HydrophobicContact CG2-CE2 4.08Å; E468-Y472 HydrophobicContact CG-CD2 4.29Å; E468-Y472 HydrophobicContact CG-CE2 3.64Å; E468-Y472 WeakPolarHBondContact O-CD2 3.46Å; E468-Y472 PolarHBondContact O-N 3.3Å; S469-Y472 PolarHBondContact O-N 2.99Å; V470-Y472 VanDerWaalsContact C-N 3.32Å; V470-Y472 PolarHBondContact O-N 3.3Å; Y472-L475 HydrophobicContact CD1-CD1 3.72Å; Y472-L475 HydrophobicContact CE1-CD1 4.17Å; Y472-T476 PolarHBondContact O-N 2.78Å; Y472-T476 PolarHBondContact O-OG1 2.88Å; Y472-L705 HydrophobicContact CE1-CD1 3.87Å; Y472-L705 HydrophobicContact CE1-CD2 4.2Å; Y472-L705 HydrophobicContact CE2-CD2 4.1Å
473	F	98.1	Very high	96.5	Very high	13 Å²	13	20.1 Å²	20.1	6%	0.057	10%	0.095	C	C	.	.	H	α-helix	trans	-70.8	-35.5	168.4	-67.2	-57.5	0	0	0	112.5	L442 A445 K449 S469 V470 I471 T476 G477 M494 T498 L501	L442-F473 HydrophobicContact CD1-CD1 4Å; L442-F473 HydrophobicContact CD1-CE1 3.84Å; A445-F473 HydrophobicContact CB-CB 4.49Å; A445-F473 HydrophobicContact CB-CD1 3.33Å; A445-F473 HydrophobicContact CB-CD2 3.99Å; A445-F473 HydrophobicContact CB-CE1 3.39Å; A445-F473 HydrophobicContact CB-CE2 4.01Å; A445-F473 HydrophobicContact CB-CG 3.66Å; A445-F473 HydrophobicContact CB-CZ 3.74Å; K449-F473 HydrophobicContact CB-CE2 4.32Å; K449-F473 HydrophobicContact CB-CZ 4.46Å; K449-F473 HydrophobicContact CD-CE2 4.26Å; K449-F473 HydrophobicContact CD-CZ 4.23Å; S469-F473 WeakPolarHBondContact O-CD2 3.24Å; S469-F473 PolarHBondContact O-N 3.32Å; S469-F473 VanDerWaalsContact O-N 3.08Å; V470-F473 CarbonylContact O-C 3.45Å; V470-F473 WeakPolarHBondContact O-CA 3.15Å; V470-F473 WeakPolarHBondContact O-CB 3.31Å; V470-F473 PolarHBondContact O-N 3.44Å; I471-F473 VanDerWaalsContact C-N 3.32Å; I471-F473 PolarHBondContact O-N 3.25Å; F473-T476 VanDerWaalsContact O-CB 3.3Å; F473-T476 WeakPolarHBondContact O-CB 3.35Å; F473-T476 PolarHBondContact O-N 3.08Å; F473-G477 PolarHBondContact O-N 3.05Å; F473-M494 HydrophobicContact CB-CE 3.84Å; F473-M494 HydrophobicContact CD1-CE 3.45Å; F473-M494 VanDerWaalsContact CD1-CE 3.45Å; F473-M494 HydrophobicContact CE1-CE 4.37Å; F473-M494 HydrophobicContact CG-CE 4.03Å; F473-T498 HydrophobicContact CB-CG2 3.79Å; F473-T498 WeakPolarHBondContact CB-OG1 3.45Å; F473-L501 HydrophobicContact CD2-CD2 3.9Å; F473-L501 HydrophobicContact CE2-CD2 3.75Å
474	V	97.5	Very high	96.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.9	-45	171.7	-179.8	0	0	0	0	111.2	V470 I471 T476 G477 Y478 L495 T498 L539 I697	V470-V474 HydrophobicContact CG1-CG2 4.43Å; V470-V474 WeakPolarHBondContact O-CG2 3.05Å; V470-V474 PolarHBondContact O-N 2.92Å; I471-V474 WeakPolarHBondContact O-CB 3.27Å; I471-V474 PolarHBondContact O-N 3.41Å; V474-T476 VanDerWaalsContact C-N 3.29Å; V474-T476 PolarHBondContact O-N 3.43Å; V474-G477 PolarHBondContact O-N 3.34Å; V474-G477 VanDerWaalsContact O-N 3.14Å; V474-Y478 PolarHBondContact O-N 3.4Å; V474-L495 HydrophobicContact CB-CD2 4.39Å; V474-L495 HydrophobicContact CG1-CD2 4.12Å; V474-T498 HydrophobicContact CG2-CG2 3.82Å; V474-L539 HydrophobicContact CB-CD2 4.48Å; V474-L539 HydrophobicContact CG1-CD2 3.94Å; V474-L539 HydrophobicContact CG2-CD1 3.97Å; V474-L539 HydrophobicContact CG2-CD2 3.73Å; V474-L539 HydrophobicContact CG2-CG 4.31Å; V474-I697 HydrophobicContact CG1-CD1 4.29Å; V474-I697 HydrophobicContact CG1-CG2 3.62Å
475	L	96.2	Very high	95.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-36.7	174.5	-71.1	164.9	0	0	0	112.3	V431 M433 Y441 I471 Y472 C479 C701 L705	V431-L475 HydrophobicContact CG1-CD1 3.88Å; V431-L475 HydrophobicContact CG1-CD2 4.01Å; M433-L475 HydrophobicContact CE-CD2 3.55Å; M433-L475 HydrophobicContact SD-CD2 3.41Å; M433-L475 WeakPolarHBondContact SD-CD2 3.29Å; Y441-L475 HydrophobicContact CD1-CB 3.58Å; Y441-L475 HydrophobicContact CD1-CD1 4.01Å; Y441-L475 HydrophobicContact CD1-CG 4.33Å; Y441-L475 HydrophobicContact CD2-CB 4.23Å; Y441-L475 HydrophobicContact CE1-CB 3.88Å; Y441-L475 HydrophobicContact CE1-CD1 4Å; Y441-L475 HydrophobicContact CE1-CD2 4.36Å; Y441-L475 HydrophobicContact CE1-CG 4.3Å; Y441-L475 HydrophobicContact CE2-CB 4.5Å; Y441-L475 HydrophobicContact CG-CB 3.76Å; I471-L475 HydrophobicContact CG2-CD1 4.2Å; I471-L475 HydrophobicContact CG2-CG 4.48Å; I471-L475 WeakPolarHBondContact O-CG 3.45Å; I471-L475 PolarHBondContact O-N 2.87Å; Y472-L475 HydrophobicContact CD1-CD1 3.72Å; Y472-L475 HydrophobicContact CE1-CD1 4.17Å; L475-C479 VanDerWaalsContact O-CB 3.26Å; L475-C479 WeakPolarHBondContact O-CB 3.49Å; L475-C479 PolarHBondContact O-N 2.69Å; L475-C701 HydrophobicContact CD1-CB 4.45Å; L475-C701 HydrophobicContact CD2-CB 3.85Å; L475-C701 HydrophobicContact CG-CB 4.19Å; L475-L705 HydrophobicContact CD1-CD1 4.22Å
476	T	96.6	Very high	95.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-50.1	171.3	-55.3	0	0	0	0	111	P438 Y441 L442 Y472 F473 V474 C479 M480 M494	P438-T476 HydrophobicContact CB-CG2 4.15Å; Y441-T476 WeakPolarHBondContact CB-OG1 3.35Å; L442-T476 WeakPolarHBondContact CA-OG1 3.38Å; L442-T476 HydrophobicContact CB-CG2 3.92Å; L442-T476 HydrophobicContact CD1-CG2 4.34Å; L442-T476 HydrophobicContact CG-CG2 4.5Å; L442-T476 PolarHBondContact N-OG1 3.4Å; Y472-T476 PolarHBondContact O-N 2.78Å; Y472-T476 PolarHBondContact O-OG1 2.88Å; F473-T476 VanDerWaalsContact O-CB 3.3Å; F473-T476 WeakPolarHBondContact O-CB 3.35Å; F473-T476 PolarHBondContact O-N 3.08Å; V474-T476 VanDerWaalsContact C-N 3.29Å; V474-T476 PolarHBondContact O-N 3.43Å; T476-C479 PolarHBondContact O-N 3.46Å; T476-M480 HydrophobicContact CG2-CE 3.86Å; T476-M480 HydrophobicContact CG2-SD 4.45Å; T476-M480 WeakPolarHBondContact O-CG 3.37Å; T476-M480 PolarHBondContact O-N 3.17Å; T476-M494 HydrophobicContact CG2-CE 4.01Å; T476-M494 HydrophobicContact CG2-CG 4.4Å; T476-M494 HydrophobicContact CG2-SD 4.3Å
477	G	96.3	Very high	94.4	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-40.8	179.3	0	0	0	0	0	113.3	F473 V474 M480 E481	F473-G477 PolarHBondContact O-N 3.05Å; V474-G477 PolarHBondContact O-N 3.34Å; V474-G477 VanDerWaalsContact O-N 3.14Å; G477-M480 WeakPolarHBondContact O-CB 3.41Å; G477-M480 PolarHBondContact O-N 3.29Å; G477-E481 PolarHBondContact O-N 3.06Å
478	Y	94.6	Very high	94.1	Very high	56 Å²	56	38.2 Å²	38.2	22%	0.22	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-39	175.5	-178.1	-110.6	0	0	0	112.6	M433 V474 M480 E481 K482 I697	M433-Y478 HydrophobicContact SD-CD1 4.38Å; M433-Y478 HydrophobicContact SD-CE1 4.37Å; V474-Y478 PolarHBondContact O-N 3.4Å; Y478-M480 VanDerWaalsContact C-N 3.34Å; Y478-E481 WeakPolarHBondContact O-CB 3.47Å; Y478-E481 PolarHBondContact O-N 3.24Å; Y478-K482 PolarHBondContact O-N 3.46Å; Y478-K482 WeakPolarHBondContact OH-CE 3.23Å; Y478-I697 HydrophobicContact CD2-CB 4.01Å; Y478-I697 HydrophobicContact CD2-CG1 4.37Å; Y478-I697 HydrophobicContact CD2-CG2 4.14Å; Y478-I697 HydrophobicContact CE2-CB 4.42Å; Y478-I697 HydrophobicContact CG-CB 4.3Å; Y478-I697 HydrophobicContact CG-CG2 3.95Å
479	C	94.4	Very high	93.9	Very high	9 Å²	9	38 Å²	38	6%	0.061	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-39.8	172.2	-175.8	0	0	0	0	111.1	E435 P438 Y441 L475 T476 E481 K482 T483	E435-C479 PolarHBondContact O-SG 3.05Å; P438-C479 HydrophobicContact CB-CB 3.99Å; P438-C479 VanDerWaalsContact N-SG 3.42Å; Y441-C479 HydrophobicContact CD2-CB 3.97Å; Y441-C479 HydrophobicContact CE2-CB 3.91Å; L475-C479 VanDerWaalsContact O-CB 3.26Å; L475-C479 WeakPolarHBondContact O-CB 3.49Å; L475-C479 PolarHBondContact O-N 2.69Å; T476-C479 PolarHBondContact O-N 3.46Å; C479-E481 PolarHBondContact O-N 3.37Å; C479-K482 PolarHBondContact O-N 2.95Å; C479-K482 VanDerWaalsContact O-N 3.17Å; C479-T483 WeakPolarHBondContact O-CB 3.4Å; C479-T483 VanDerWaalsContact O-CG2 3.28Å; C479-T483 WeakPolarHBondContact O-CG2 3.39Å; C479-T483 PolarHBondContact O-N 2.98Å; C479-T483 VanDerWaalsContact O-N 3.1Å; C479-T483 PolarHBondContact O-OG1 3.36Å
480	M	95.1	Very high	93.8	Very high	33 Å²	33	44.1 Å²	44.1	16%	0.163	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-42.1	172.5	-72	178.2	177.4	0	0	112.5	P438 T476 G477 Y478 K482 T483 L484 P491 M494	P438-M480 HydrophobicContact CB-CE 4.28Å; P438-M480 HydrophobicContact CB-CG 3.76Å; P438-M480 HydrophobicContact CG-CG 3.96Å; T476-M480 HydrophobicContact CG2-CE 3.86Å; T476-M480 HydrophobicContact CG2-SD 4.45Å; T476-M480 WeakPolarHBondContact O-CG 3.37Å; T476-M480 PolarHBondContact O-N 3.17Å; G477-M480 WeakPolarHBondContact O-CB 3.41Å; G477-M480 PolarHBondContact O-N 3.29Å; Y478-M480 VanDerWaalsContact C-N 3.34Å; M480-K482 PolarHBondContact O-N 3.49Å; M480-T483 PolarHBondContact O-N 3.1Å; M480-L484 HydrophobicContact CB-CD1 3.93Å; M480-L484 HydrophobicContact CB-CG 4.37Å; M480-L484 HydrophobicContact CG-CD1 4.22Å; M480-L484 WeakPolarHBondContact O-CB 3.24Å; M480-L484 WeakPolarHBondContact O-CG 3.43Å; M480-L484 PolarHBondContact O-N 2.96Å; M480-P491 HydrophobicContact CB-CB 4.34Å; M480-P491 HydrophobicContact CB-CG 3.97Å; M480-M494 HydrophobicContact SD-CB 4.33Å; M480-M494 HydrophobicContact SD-CG 4.35Å
481	E	93.4	Very high	93.7	Very high	43 Å²	43	44.5 Å²	44.5	20%	0.201	24%	0.242	C	C	.	.	H	α-helix	trans	-57.6	-33.1	174.2	179.5	-164.4	145.7	0	0	112.7	G477 Y478 C479 P491 K542 L546	G477-E481 PolarHBondContact O-N 3.06Å; Y478-E481 WeakPolarHBondContact O-CB 3.47Å; Y478-E481 PolarHBondContact O-N 3.24Å; C479-E481 PolarHBondContact O-N 3.37Å; E481-P491 HydrophobicContact CB-CB 4.27Å; E481-P491 HydrophobicContact CB-CG 4.48Å; E481-K542 IonicContact OE1-NZ 3.05Å; E481-K542 PolarHBondContact OE1-NZ 2.88Å; E481-K542 VanDerWaalsContact OE1-NZ 3.08Å; E481-K542 WeakPolarHBondContact OE2-CE 3.41Å; E481-K542 IonicContact OE2-NZ 3.04Å; E481-K542 PolarHBondContact OE2-NZ 3.28Å; E481-L546 HydrophobicContact CG-CD2 4.16Å
482	K	92.2	Very high	93.6	Very high	127 Å²	127	45.7 Å²	45.7	55%	0.552	25%	0.247	S	C	*	.	H	α-helix	trans	-92.3	-7.1	179.8	-58.2	-48.3	-175.7	-154.7	0	114.9	Y478 C479 M480	Y478-K482 PolarHBondContact O-N 3.46Å; Y478-K482 WeakPolarHBondContact OH-CE 3.23Å; C479-K482 PolarHBondContact O-N 2.95Å; C479-K482 VanDerWaalsContact O-N 3.17Å; M480-K482 PolarHBondContact O-N 3.49Å
483	T	92.3	Very high	93.6	Very high	59 Å²	59	46.2 Å²	46.2	36%	0.362	25%	0.253	S	S	.	.	H	α-helix	trans	-125.1	-17.3	-171.5	56.6	0	0	0	0	114.5	K436 C479 M480	K436-T483 WeakPolarHBondContact O-CG2 3.25Å; C479-T483 WeakPolarHBondContact O-CB 3.4Å; C479-T483 VanDerWaalsContact O-CG2 3.28Å; C479-T483 WeakPolarHBondContact O-CG2 3.39Å; C479-T483 PolarHBondContact O-N 2.98Å; C479-T483 VanDerWaalsContact O-N 3.1Å; C479-T483 PolarHBondContact O-OG1 3.36Å; M480-T483 PolarHBondContact O-N 3.1Å
484	L	91.3	Very high	93.5	Very high	59 Å²	59	46.2 Å²	46.2	31%	0.309	25%	0.253	S	S	.	.	S	Bend	trans	-99.1	164.6	172.6	-55.8	179.8	0	0	0	110.7	M480 R490	M480-L484 HydrophobicContact CB-CD1 3.93Å; M480-L484 HydrophobicContact CB-CG 4.37Å; M480-L484 HydrophobicContact CG-CD1 4.22Å; M480-L484 WeakPolarHBondContact O-CB 3.24Å; M480-L484 WeakPolarHBondContact O-CG 3.43Å; M480-L484 PolarHBondContact O-N 2.96Å; L484-R490 HydrophobicContact CD1-CB 3.89Å
485	S	88.2	Confident	93.6	Very high	93 Å²	93	46.3 Å²	46.3	65%	0.65	25%	0.253	S	S	*	.			trans	-57.4	145.8	169.8	-49.5	0	0	0	0	111.3	D487 S488	S485-D487 PolarHBondContact O-N 2.97Å; S485-D487 VanDerWaalsContact O-N 3.14Å; S485-S488 VanDerWaalsContact O-CB 3.23Å; S485-S488 WeakPolarHBondContact O-CB 3.29Å; S485-S488 PolarHBondContact O-N 3.41Å
486	A	84	Confident	93.6	Very high	101 Å²	101	51.6 Å²	51.6	84%	0.835	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-31	-178.9	0	0	0	0	0	113.5	S488	A486-S488 PolarHBondContact O-N 2.67Å
487	D	83.8	Confident	93.7	Very high	149 Å²	149	54.4 Å²	54.4	80%	0.797	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-5.5	178.1	-46.2	-73.6	0	0	0	113.8	S485 S489	S485-D487 PolarHBondContact O-N 2.97Å; S485-D487 VanDerWaalsContact O-N 3.14Å; D487-S489 PolarHBondContact O-N 2.75Å
488	S	92.4	Very high	93.8	Very high	28 Å²	28	54.6 Å²	54.6	20%	0.196	29%	0.29	C	S	.	.			trans	-68	127.7	-175.6	-161.8	0	0	0	0	112.1	S485 A486 R490 P491	S485-S488 VanDerWaalsContact O-CB 3.23Å; S485-S488 WeakPolarHBondContact O-CB 3.29Å; S485-S488 PolarHBondContact O-N 3.41Å; A486-S488 PolarHBondContact O-N 2.67Å; S488-R490 VanDerWaalsContact C-N 3.26Å; S488-R490 PolarHBondContact O-N 3.31Å; S488-P491 VanDerWaalsContact O-CD 3.28Å; S488-P491 WeakPolarHBondContact O-CD 3.36Å
489	S	93.4	Very high	93.9	Very high	14 Å²	14	52.5 Å²	52.5	10%	0.098	28%	0.284	C	S	.	.	S	Bend	trans	-67	-24.8	170.4	53	0	0	0	0	113.6	D487 Y492 S493	D487-S489 PolarHBondContact O-N 2.75Å; S489-Y492 WeakPolarHBondContact O-CB 3.09Å; S489-Y492 PolarHBondContact O-N 3.48Å; S489-S493 PolarHBondContact O-N 2.76Å; S489-S493 PolarHBondContact O-OG 3.22Å
490	R	95.8	Very high	94	Very high	129 Å²	129	56.8 Å²	56.8	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-57.4	-42.7	-169.1	-62.2	179.5	-176.7	166.8	4.2	115.5	I309 L484 S488 Y492 S493 M494	I309-R490 HydrophobicContact CD1-CG 4.24Å; L484-R490 HydrophobicContact CD1-CB 3.89Å; S488-R490 VanDerWaalsContact C-N 3.26Å; S488-R490 PolarHBondContact O-N 3.31Å; R490-Y492 VanDerWaalsContact C-N 3.32Å; R490-Y492 PolarHBondContact O-N 2.89Å; R490-S493 PolarHBondContact O-N 3.02Å; R490-M494 VanDerWaalsContact O-CB 3.23Å; R490-M494 WeakPolarHBondContact O-CB 3.4Å; R490-M494 PolarHBondContact O-N 3Å
491	P	95.9	Very high	94.1	Very high	7 Å²	7	57 Å²	57	5%	0.045	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-40.3	175.2	-19.4	31.9	0	0	0	112.1	M480 E481 S488 M494 L495 L546	M480-P491 HydrophobicContact CB-CB 4.34Å; M480-P491 HydrophobicContact CB-CG 3.97Å; E481-P491 HydrophobicContact CB-CB 4.27Å; E481-P491 HydrophobicContact CB-CG 4.48Å; S488-P491 VanDerWaalsContact O-CD 3.28Å; S488-P491 WeakPolarHBondContact O-CD 3.36Å; P491-M494 PolarHBondContact O-N 3.09Å; P491-L495 WeakPolarHBondContact O-CB 3.44Å; P491-L495 VanDerWaalsContact O-CG 3.31Å; P491-L495 WeakPolarHBondContact O-CG 3.35Å; P491-L495 PolarHBondContact O-N 3.04Å; P491-L546 HydrophobicContact CB-CD1 4.34Å
492	Y	96.6	Very high	94.3	Very high	27 Å²	27	55 Å²	55	11%	0.106	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-48.6	178	179.2	-92.1	0	0	0	111.3	S489 R490 M494 L495 K496 L543 L546 R547	S489-Y492 WeakPolarHBondContact O-CB 3.09Å; S489-Y492 PolarHBondContact O-N 3.48Å; R490-Y492 VanDerWaalsContact C-N 3.32Å; R490-Y492 PolarHBondContact O-N 2.89Å; Y492-M494 VanDerWaalsContact C-N 3.35Å; Y492-M494 PolarHBondContact O-N 3.33Å; Y492-L495 PolarHBondContact O-N 2.87Å; Y492-K496 HydrophobicContact CE1-CD 4.22Å; Y492-K496 VanDerWaalsContact O-CB 3.25Å; Y492-K496 WeakPolarHBondContact O-CB 3.23Å; Y492-K496 PolarHBondContact O-N 2.91Å; Y492-L543 HydrophobicContact CD2-CB 4.41Å; Y492-L543 HydrophobicContact CD2-CD2 3.49Å; Y492-L543 VanDerWaalsContact CD2-CD2 3.49Å; Y492-L543 HydrophobicContact CE2-CB 4Å; Y492-L543 HydrophobicContact CE2-CD2 3.63Å; Y492-L543 HydrophobicContact CE2-CG 4.43Å; Y492-L543 VanDerWaalsContact CE2-O 3.31Å; Y492-L543 WeakPolarHBondContact CE2-O 3.44Å; Y492-L543 HydrophobicContact CG-CD2 4.06Å; Y492-L543 WeakPolarHBondContact O-CD2 3.5Å; Y492-L546 HydrophobicContact CD2-CB 4.23Å; Y492-R547 HydrophobicContact CD2-CG 3.8Å; Y492-R547 HydrophobicContact CE2-CG 3.63Å
493	S	97	Very high	94.6	Very high	23 Å²	23	53.2 Å²	53.2	16%	0.161	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-45.7	175.6	-59.3	0	0	0	0	111.3	D306 S489 R490 L495 K496 E497	D306-S493 PolarHBondContact OD1-OG 3.42Å; S489-S493 PolarHBondContact O-N 2.76Å; S489-S493 PolarHBondContact O-OG 3.22Å; R490-S493 PolarHBondContact O-N 3.02Å; S493-L495 PolarHBondContact O-N 2.92Å; S493-K496 PolarHBondContact O-N 3.47Å; S493-E497 WeakPolarHBondContact O-CG 3.15Å; S493-E497 PolarHBondContact O-N 3Å
494	M	97.6	Very high	94.8	Very high	13 Å²	13	51.4 Å²	51.4	6%	0.064	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-46.9	178.2	-172.5	69.4	-155.1	0	0	112.9	M313 L442 F473 T476 M480 R490 P491 Y492 T498	M313-M494 HydrophobicContact CE-SD 4.44Å; L442-M494 HydrophobicContact CD1-CE 4.18Å; F473-M494 HydrophobicContact CB-CE 3.84Å; F473-M494 HydrophobicContact CD1-CE 3.45Å; F473-M494 VanDerWaalsContact CD1-CE 3.45Å; F473-M494 HydrophobicContact CE1-CE 4.37Å; F473-M494 HydrophobicContact CG-CE 4.03Å; T476-M494 HydrophobicContact CG2-CE 4.01Å; T476-M494 HydrophobicContact CG2-CG 4.4Å; T476-M494 HydrophobicContact CG2-SD 4.3Å; M480-M494 HydrophobicContact SD-CB 4.33Å; M480-M494 HydrophobicContact SD-CG 4.35Å; R490-M494 VanDerWaalsContact O-CB 3.23Å; R490-M494 WeakPolarHBondContact O-CB 3.4Å; R490-M494 PolarHBondContact O-N 3Å; P491-M494 PolarHBondContact O-N 3.09Å; Y492-M494 VanDerWaalsContact C-N 3.35Å; Y492-M494 PolarHBondContact O-N 3.33Å; M494-T498 WeakPolarHBondContact O-CB 3.28Å; M494-T498 PolarHBondContact O-N 3.49Å; M494-T498 PolarHBondContact O-OG1 2.81Å
495	L	97.8	Very high	95	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-71.6	-33.3	179.1	-66.6	179.1	0	0	0	112.2	V474 P491 Y492 S493 T498 C499 L539 K542 L543 L546	V474-L495 HydrophobicContact CB-CD2 4.39Å; V474-L495 HydrophobicContact CG1-CD2 4.12Å; P491-L495 WeakPolarHBondContact O-CB 3.44Å; P491-L495 VanDerWaalsContact O-CG 3.31Å; P491-L495 WeakPolarHBondContact O-CG 3.35Å; P491-L495 PolarHBondContact O-N 3.04Å; Y492-L495 PolarHBondContact O-N 2.87Å; S493-L495 PolarHBondContact O-N 2.92Å; L495-T498 WeakPolarHBondContact O-CB 3.3Å; L495-T498 PolarHBondContact O-N 2.99Å; L495-C499 PolarHBondContact O-N 2.96Å; L495-L539 HydrophobicContact CD2-CD2 4.01Å; L495-K542 HydrophobicContact CD1-CG 3.78Å; L495-L543 HydrophobicContact CB-CD2 3.97Å; L495-L543 HydrophobicContact CB-CG 4.48Å; L495-L546 HydrophobicContact CD1-CD1 3.87Å
496	K	97.3	Very high	95.4	Very high	112 Å²	112	45 Å²	45	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-48.2	175.6	-173	-176.7	178.5	-171.4	0	111.4	Y492 S493 T498 C499 E500 L543	Y492-K496 HydrophobicContact CE1-CD 4.22Å; Y492-K496 VanDerWaalsContact O-CB 3.25Å; Y492-K496 WeakPolarHBondContact O-CB 3.23Å; Y492-K496 PolarHBondContact O-N 2.91Å; S493-K496 PolarHBondContact O-N 3.47Å; K496-T498 VanDerWaalsContact C-N 3.28Å; K496-T498 PolarHBondContact O-N 3.37Å; K496-C499 PolarHBondContact O-N 2.92Å; K496-E500 PolarHBondContact O-N 2.9Å; K496-E500 VanDerWaalsContact O-N 3.09Å; K496-L543 HydrophobicContact CB-CD1 4.41Å; K496-L543 HydrophobicContact CB-CD2 4.05Å
497	E	97.7	Very high	96	Very high	59 Å²	59	44.8 Å²	44.8	28%	0.276	22%	0.222	S	C	.	.	H	α-helix	trans	-59.9	-38.8	173.5	-72	-172.6	154.7	0	0	111.7	S493 E500 L501	S493-E497 WeakPolarHBondContact O-CG 3.15Å; S493-E497 PolarHBondContact O-N 3Å; E497-E500 PolarHBondContact O-N 3.35Å; E497-L501 WeakPolarHBondContact O-CB 3.19Å; E497-L501 PolarHBondContact O-N 3.5Å
498	T	98.3	Very high	96.5	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-39.2	176.6	-59.4	0	0	0	0	112.4	V470 F473 V474 M494 L495 K496 L501 L502 L539	V470-T498 HydrophobicContact CG1-CG2 3.91Å; F473-T498 HydrophobicContact CB-CG2 3.79Å; F473-T498 WeakPolarHBondContact CB-OG1 3.45Å; V474-T498 HydrophobicContact CG2-CG2 3.82Å; M494-T498 WeakPolarHBondContact O-CB 3.28Å; M494-T498 PolarHBondContact O-N 3.49Å; M494-T498 PolarHBondContact O-OG1 2.81Å; L495-T498 WeakPolarHBondContact O-CB 3.3Å; L495-T498 PolarHBondContact O-N 2.99Å; K496-T498 VanDerWaalsContact C-N 3.28Å; K496-T498 PolarHBondContact O-N 3.37Å; T498-L501 PolarHBondContact O-N 3.41Å; T498-L502 PolarHBondContact O-N 3.26Å; T498-L539 HydrophobicContact CG2-CD1 4.29Å
499	C	97	Very high	96.6	Very high	13 Å²	13	42.8 Å²	42.8	9%	0.088	20%	0.203	C	C	.	.	H	α-helix	trans	-67.2	-43.8	176.5	-172.4	0	0	0	0	112.1	L495 K496 L502 K503 L539	L495-C499 PolarHBondContact O-N 2.96Å; K496-C499 PolarHBondContact O-N 2.92Å; C499-L502 PolarHBondContact O-N 3.12Å; C499-K503 WeakPolarHBondContact O-CB 3.29Å; C499-K503 PolarHBondContact O-N 3.48Å; C499-L539 HydrophobicContact CB-CB 4.49Å; C499-L539 HydrophobicContact CB-CD1 4.28Å
500	E	97.1	Very high	96.7	Very high	98 Å²	98	44.5 Å²	44.5	46%	0.458	21%	0.208	S	C	.	.	H	α-helix	trans	-67.7	-34.5	175.6	-72.3	-60.4	129	0	0	112.6	K496 E497 K503 G504	K496-E500 PolarHBondContact O-N 2.9Å; K496-E500 VanDerWaalsContact O-N 3.09Å; E497-E500 PolarHBondContact O-N 3.35Å; E500-K503 WeakPolarHBondContact OE1-CD 3.22Å; E500-K503 IonicContact OE1-NZ 3.96Å; E500-K503 PolarHBondContact OE1-NZ 3.03Å; E500-K503 WeakPolarHBondContact OE2-CD 3.38Å; E500-K503 WeakPolarHBondContact OE2-CE 3.3Å; E500-K503 IonicContact OE2-NZ 3.25Å; E500-K503 PolarHBondContact OE2-NZ 3.35Å; E500-G504 PolarHBondContact O-N 3.27Å
501	L	97.7	Very high	96.6	Very high	39 Å²	39	41.6 Å²	41.6	20%	0.204	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-51.8	169.8	174.4	62.7	0	0	0	110.9	V470 F473 E497 T498 G504 V505	V470-L501 HydrophobicContact CG2-CD2 4.32Å; V470-L501 HydrophobicContact CG2-CG 4.45Å; F473-L501 HydrophobicContact CD2-CD2 3.9Å; F473-L501 HydrophobicContact CE2-CD2 3.75Å; E497-L501 WeakPolarHBondContact O-CB 3.19Å; E497-L501 PolarHBondContact O-N 3.5Å; T498-L501 PolarHBondContact O-N 3.41Å; L501-G504 PolarHBondContact O-N 2.88Å; L501-V505 HydrophobicContact CD1-CG1 4.09Å; L501-V505 WeakPolarHBondContact O-CG2 3.41Å; L501-V505 PolarHBondContact O-N 3.33Å
502	L	98	Very high	96.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-51.1	179.2	175.8	59.8	0	0	0	111.5	L467 V470 T498 C499 G504 V505 S506 V535 Q536	L467-L502 HydrophobicContact CD2-CD1 3.72Å; V470-L502 HydrophobicContact CG1-CB 4.26Å; V470-L502 HydrophobicContact CG1-CD2 4.31Å; V470-L502 HydrophobicContact CG2-CB 4.13Å; V470-L502 HydrophobicContact CG2-CD1 4.39Å; T498-L502 PolarHBondContact O-N 3.26Å; C499-L502 PolarHBondContact O-N 3.12Å; L502-G504 VanDerWaalsContact C-N 3.31Å; L502-G504 PolarHBondContact O-N 3.49Å; L502-V505 VanDerWaalsContact O-CG2 3.3Å; L502-V505 WeakPolarHBondContact O-CG2 3.46Å; L502-V505 PolarHBondContact O-N 3.22Å; L502-S506 VanDerWaalsContact O-CB 3.3Å; L502-S506 WeakPolarHBondContact O-CB 3.3Å; L502-S506 PolarHBondContact O-N 2.9Å; L502-S506 PolarHBondContact O-OG 3.38Å; L502-V535 HydrophobicContact CD2-CB 3.67Å; L502-V535 HydrophobicContact CD2-CG1 3.48Å; L502-V535 VanDerWaalsContact CD2-CG1 3.48Å; L502-Q536 HydrophobicContact CD2-CG 4.01Å
503	K	96.7	Very high	96	Very high	89 Å²	89	44 Å²	44	39%	0.387	22%	0.224	S	C	.	.	H	α-helix	trans	-52.5	-48.4	175.1	176.4	-177.3	167.1	-156.6	0	111.4	C499 E500 Q507	C499-K503 WeakPolarHBondContact O-CB 3.29Å; C499-K503 PolarHBondContact O-N 3.48Å; E500-K503 WeakPolarHBondContact OE1-CD 3.22Å; E500-K503 IonicContact OE1-NZ 3.96Å; E500-K503 PolarHBondContact OE1-NZ 3.03Å; E500-K503 WeakPolarHBondContact OE2-CD 3.38Å; E500-K503 WeakPolarHBondContact OE2-CE 3.3Å; E500-K503 IonicContact OE2-NZ 3.25Å; E500-K503 PolarHBondContact OE2-NZ 3.35Å; K503-Q507 WeakPolarHBondContact O-CB 3.42Å; K503-Q507 PolarHBondContact O-N 3.39Å
504	G	96.7	Very high	95.7	Very high	21 Å²	21	47 Å²	47	22%	0.216	25%	0.25	C	S	.	.	H	α-helix	trans	-67.9	-33.8	-179.3	0	0	0	0	0	115.1	E500 L501 L502 K508	E500-G504 PolarHBondContact O-N 3.27Å; L501-G504 PolarHBondContact O-N 2.88Å; L502-G504 VanDerWaalsContact C-N 3.31Å; L502-G504 PolarHBondContact O-N 3.49Å; G504-K508 VanDerWaalsContact O-CD 3.26Å; G504-K508 WeakPolarHBondContact O-CD 3.36Å; G504-K508 VanDerWaalsContact O-CG 3.22Å; G504-K508 WeakPolarHBondContact O-CG 3.27Å; G504-K508 PolarHBondContact O-N 2.85Å
505	V	96.9	Very high	95.3	Very high	12 Å²	12	52.3 Å²	52.3	7%	0.073	28%	0.283	C	S	.	.	H	α-helix	trans	-80.2	-38.3	175	-61	0	0	0	0	112.1	I463 Y466 L501 L502 K508 Y509	I463-V505 HydrophobicContact CD1-CB 4.2Å; I463-V505 HydrophobicContact CD1-CG2 3.87Å; Y466-V505 HydrophobicContact CD1-CG1 4Å; Y466-V505 HydrophobicContact CD2-CB 3.78Å; Y466-V505 HydrophobicContact CD2-CG1 3.77Å; Y466-V505 HydrophobicContact CD2-CG2 4.28Å; Y466-V505 HydrophobicContact CE1-CG1 4.02Å; Y466-V505 HydrophobicContact CE2-CB 4.13Å; Y466-V505 HydrophobicContact CE2-CG1 3.78Å; Y466-V505 HydrophobicContact CG-CB 4.08Å; Y466-V505 HydrophobicContact CG-CG1 3.9Å; Y466-V505 HydrophobicContact CG-CG2 4.16Å; L501-V505 HydrophobicContact CD1-CG1 4.09Å; L501-V505 WeakPolarHBondContact O-CG2 3.41Å; L501-V505 PolarHBondContact O-N 3.33Å; L502-V505 VanDerWaalsContact O-CG2 3.3Å; L502-V505 WeakPolarHBondContact O-CG2 3.46Å; L502-V505 PolarHBondContact O-N 3.22Å; V505-K508 PolarHBondContact O-N 3.2Å; V505-Y509 WeakPolarHBondContact O-CB 3.43Å; V505-Y509 PolarHBondContact O-N 2.93Å
506	S	96.2	Very high	94.7	Very high	5 Å²	5	54.4 Å²	54.4	4%	0.035	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-47.9	176.2	-64	0	0	0	0	111.3	L502 K508 Y509 F510 S532	L502-S506 VanDerWaalsContact O-CB 3.3Å; L502-S506 WeakPolarHBondContact O-CB 3.3Å; L502-S506 PolarHBondContact O-N 2.9Å; L502-S506 PolarHBondContact O-OG 3.38Å; S506-K508 VanDerWaalsContact C-N 3.32Å; S506-K508 PolarHBondContact O-N 3.11Å; S506-Y509 PolarHBondContact O-N 3.49Å; S506-Y509 VanDerWaalsContact O-N 3.12Å; S506-F510 WeakPolarHBondContact O-CD2 3.33Å; S506-F510 PolarHBondContact O-N 2.95Å; S506-S532 PolarHBondContact OG-OG 2.88Å; S506-S532 VanDerWaalsContact OG-OG 3.1Å
507	Q	95.4	Very high	94.1	Very high	97 Å²	97	56.1 Å²	56.1	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-43.5	176.8	-171.8	-174.6	5.5	0	0	111.7	K503 A511	K503-Q507 WeakPolarHBondContact O-CB 3.42Å; K503-Q507 PolarHBondContact O-N 3.39Å; Q507-A511 VanDerWaalsContact O-CB 3.31Å; Q507-A511 WeakPolarHBondContact O-CB 3.35Å; Q507-A511 PolarHBondContact O-N 3.41Å
508	K	94.7	Very high	93.7	Very high	131 Å²	131	55.6 Å²	55.6	57%	0.57	32%	0.316	S	S	*	.	H	α-helix	trans	-66.2	-36.8	176.1	-72.4	170.3	-170.4	166.5	0	112.7	G504 V505 S506 Q512	G504-K508 VanDerWaalsContact O-CD 3.26Å; G504-K508 WeakPolarHBondContact O-CD 3.36Å; G504-K508 VanDerWaalsContact O-CG 3.22Å; G504-K508 WeakPolarHBondContact O-CG 3.27Å; G504-K508 PolarHBondContact O-N 2.85Å; V505-K508 PolarHBondContact O-N 3.2Å; S506-K508 VanDerWaalsContact C-N 3.32Å; S506-K508 PolarHBondContact O-N 3.11Å; K508-Q512 WeakPolarHBondContact O-CB 3.2Å; K508-Q512 WeakPolarHBondContact O-CG 3.35Å; K508-Q512 PolarHBondContact O-N 2.83Å
509	Y	95	Very high	93.2	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-65.7	-53.1	175.7	177.6	-109	0	0	0	111	K459 S460 I463 V505 S506 A511 Q512 S513 N525 I528	K459-Y509 HydrophobicContact CB-CD2 4.28Å; K459-Y509 HydrophobicContact CB-CE2 4.08Å; K459-Y509 WeakPolarHBondContact O-CD2 3.31Å; K459-Y509 VanDerWaalsContact O-CE2 3.29Å; K459-Y509 WeakPolarHBondContact O-CE2 3.45Å; S460-Y509 PolarHBondContact OG-OH 3.45Å; I463-Y509 HydrophobicContact CB-CD1 4.28Å; I463-Y509 HydrophobicContact CB-CD2 3.79Å; I463-Y509 HydrophobicContact CB-CE2 4.24Å; I463-Y509 HydrophobicContact CB-CG 3.81Å; I463-Y509 HydrophobicContact CG1-CD1 4.07Å; I463-Y509 HydrophobicContact CG1-CD2 4.4Å; I463-Y509 HydrophobicContact CG1-CG 3.9Å; I463-Y509 HydrophobicContact CG2-CD1 3.94Å; I463-Y509 HydrophobicContact CG2-CD2 3.54Å; I463-Y509 HydrophobicContact CG2-CE1 3.86Å; I463-Y509 HydrophobicContact CG2-CE2 3.46Å; I463-Y509 VanDerWaalsContact CG2-CE2 3.46Å; I463-Y509 HydrophobicContact CG2-CG 3.78Å; V505-Y509 WeakPolarHBondContact O-CB 3.43Å; V505-Y509 PolarHBondContact O-N 2.93Å; S506-Y509 PolarHBondContact O-N 3.49Å; S506-Y509 VanDerWaalsContact O-N 3.12Å; Y509-A511 PolarHBondContact O-N 3.38Å; Y509-Q512 CarbonylContact O-C 3.57Å; Y509-Q512 WeakPolarHBondContact O-CA 3.48Å; Y509-Q512 PolarHBondContact O-N 2.75Å; Y509-S513 WeakPolarHBondContact O-CB 3.31Å; Y509-S513 PolarHBondContact O-N 3.06Å; Y509-S513 PolarHBondContact O-OG 3.25Å; Y509-N525 WeakPolarHBondContact CE1-OD1 3.3Å; Y509-N525 PolarHBondContact OH-OD1 3.21Å; Y509-I528 HydrophobicContact CD1-CG2 4.09Å; Y509-I528 HydrophobicContact CE1-CB 4.41Å; Y509-I528 HydrophobicContact CE1-CD1 3.89Å; Y509-I528 HydrophobicContact CE1-CG2 3.98Å
510	F	94.4	Very high	92.9	Very high	50 Å²	50	56.6 Å²	56.6	22%	0.219	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-39.2	-177.6	-62.3	-53.2	0	0	0	112.8	S506 Q512 S513 A514 I528 E529	S506-F510 WeakPolarHBondContact O-CD2 3.33Å; S506-F510 PolarHBondContact O-N 2.95Å; F510-Q512 VanDerWaalsContact C-N 3.26Å; F510-Q512 PolarHBondContact O-N 3.34Å; F510-S513 WeakPolarHBondContact CA-OG 3.49Å; F510-S513 PolarHBondContact O-N 2.92Å; F510-S513 PolarHBondContact O-OG 2.94Å; F510-A514 VanDerWaalsContact O-CB 3.31Å; F510-A514 WeakPolarHBondContact O-CB 3.12Å; F510-A514 PolarHBondContact O-N 3.34Å; F510-I528 HydrophobicContact CE1-CG2 4.26Å; F510-I528 HydrophobicContact CZ-CG2 3.98Å; F510-E529 HydrophobicContact CE1-CB 4.01Å; F510-E529 HydrophobicContact CE2-CB 4.38Å; F510-E529 HydrophobicContact CE2-CG 4.45Å; F510-E529 HydrophobicContact CZ-CB 3.67Å; F510-E529 HydrophobicContact CZ-CG 4.22Å
511	A	93.7	Very high	92.6	Very high	68 Å²	68	52.9 Å²	52.9	56%	0.562	31%	0.306	S	S	*	.	H	α-helix	trans	-61.1	-34	171.8	0	0	0	0	0	112.7	Q507 Y509	Q507-A511 VanDerWaalsContact O-CB 3.31Å; Q507-A511 WeakPolarHBondContact O-CB 3.35Å; Q507-A511 PolarHBondContact O-N 3.41Å; Y509-A511 PolarHBondContact O-N 3.38Å
512	Q	91.1	Very high	92.2	Very high	80 Å²	80	53.3 Å²	53.3	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-84.9	-15.5	177.2	-71.9	-179.7	18.1	0	0	114.4	K459 K508 Y509 F510	K459-Q512 HydrophobicContact CD-CB 4.04Å; K459-Q512 PolarHBondContact NZ-O 3.2Å; K508-Q512 WeakPolarHBondContact O-CB 3.2Å; K508-Q512 WeakPolarHBondContact O-CG 3.35Å; K508-Q512 PolarHBondContact O-N 2.83Å; Y509-Q512 CarbonylContact O-C 3.57Å; Y509-Q512 WeakPolarHBondContact O-CA 3.48Å; Y509-Q512 PolarHBondContact O-N 2.75Å; F510-Q512 VanDerWaalsContact C-N 3.26Å; F510-Q512 PolarHBondContact O-N 3.34Å
513	S	90.3	Very high	91.9	Very high	4 Å²	4	53.4 Å²	53.4	3%	0.028	32%	0.315	C	S	.	.	H	α-helix	trans	-102.7	-22.9	-179.5	75.8	0	0	0	0	113.3	Y509 F510 V515 S516 N525	Y509-S513 WeakPolarHBondContact O-CB 3.31Å; Y509-S513 PolarHBondContact O-N 3.06Å; Y509-S513 PolarHBondContact O-OG 3.25Å; F510-S513 WeakPolarHBondContact CA-OG 3.49Å; F510-S513 PolarHBondContact O-N 2.92Å; F510-S513 PolarHBondContact O-OG 2.94Å; S513-V515 PolarHBondContact O-N 3.49Å; S513-S516 WeakPolarHBondContact O-CB 3.25Å; S513-S516 PolarHBondContact O-N 2.99Å; S513-N525 VanDerWaalsContact CB-OD1 3.22Å; S513-N525 WeakPolarHBondContact CB-OD1 3.31Å; S513-N525 VanDerWaalsContact OG-CG 3.31Å; S513-N525 PolarHBondContact OG-ND2 2.72Å; S513-N525 PolarHBondContact OG-OD1 2.86Å
514	A	89.8	Confident	91.8	Very high	87 Å²	87	49.2 Å²	49.2	72%	0.719	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.2	173	0	0	0	0	0	113.9	F510	F510-A514 VanDerWaalsContact O-CB 3.31Å; F510-A514 WeakPolarHBondContact O-CB 3.12Å; F510-A514 PolarHBondContact O-N 3.34Å
515	V	88.7	Confident	91.7	Very high	125 Å²	125	49.6 Å²	49.6	76%	0.758	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	0.9	174.3	-164.2	0	0	0	0	111.6	S513	S513-V515 PolarHBondContact O-N 3.49Å
516	S	85.5	Confident	91.5	Very high	44 Å²	44	50.2 Å²	50.2	31%	0.308	30%	0.299	S	S	.	.			trans	-87	123.4	179.9	-169.9	0	0	0	0	111.4	S513 D518	S513-S516 WeakPolarHBondContact O-CB 3.25Å; S513-S516 PolarHBondContact O-N 2.99Å; S516-D518 VanDerWaalsContact C-N 3.32Å; S516-D518 PolarHBondContact OG-N 3.45Å
517	V	86.2	Confident	91.5	Very high	148 Å²	148	50 Å²	50	90%	0.897	30%	0.297	S	S	*	.			trans	-86.2	-6.1	172.6	-167	0	0	0	0	111.6	S519	V517-S519 PolarHBondContact O-N 2.91Å
518	D	88	Confident	91.6	Very high	48 Å²	48	45.4 Å²	45.4	26%	0.257	28%	0.276	S	S	.	.			trans	-73.3	118.7	179.6	-178.9	27.5	0	0	0	112.4	R412 S516 Y520 V521 A522	R412-D518 IonicContact CZ-OD1 3.58Å; R412-D518 IonicContact NH1-OD1 3.7Å; R412-D518 IonicContact NH2-OD1 2.69Å; R412-D518 PolarHBondContact NH2-OD1 2.92Å; S516-D518 VanDerWaalsContact C-N 3.32Å; S516-D518 PolarHBondContact OG-N 3.45Å; D518-Y520 PolarHBondContact O-N 2.8Å; D518-Y520 PolarHBondContact OD1-N 3.28Å; D518-Y520 WeakPolarHBondContact OD2-CB 3.3Å; D518-V521 HydrophobicContact CB-CG2 4.22Å; D518-V521 PolarHBondContact O-N 3.33Å; D518-V521 VanDerWaalsContact O-N 3.08Å; D518-A522 PolarHBondContact O-N 3.41Å; D518-A522 VanDerWaalsContact O-N 3.11Å
519	S	87.6	Confident	91.7	Very high	24 Å²	24	41.6 Å²	41.6	17%	0.168	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-25.2	179.8	64.7	0	0	0	0	113.5	R412 V517 A522 F523	R412-S519 VanDerWaalsContact CD-OG 3.28Å; R412-S519 WeakPolarHBondContact CD-OG 3.37Å; R412-S519 PolarHBondContact NE-OG 2.88Å; R412-S519 VanDerWaalsContact NE-OG 3.12Å; R412-S519 PolarHBondContact NH1-OG 3.01Å; R412-S519 PolarHBondContact NH2-OG 3.36Å; V517-S519 PolarHBondContact O-N 2.91Å; S519-A522 PolarHBondContact O-N 3.27Å; S519-F523 VanDerWaalsContact O-CB 3.26Å; S519-F523 WeakPolarHBondContact O-CB 3.45Å; S519-F523 PolarHBondContact O-N 2.96Å
520	Y	90.9	Very high	91.8	Very high	15 Å²	15	41.4 Å²	41.4	6%	0.059	26%	0.259	C	S	.	.	H	α-helix	trans	-68.9	-41.2	175.2	165.7	-109.3	0	0	0	111.7	D518 F523 L524 F714 H715 Q718	D518-Y520 PolarHBondContact O-N 2.8Å; D518-Y520 PolarHBondContact OD1-N 3.28Å; D518-Y520 WeakPolarHBondContact OD2-CB 3.3Å; Y520-F523 PolarHBondContact O-N 3.37Å; Y520-L524 HydrophobicContact CE1-CD1 4.05Å; Y520-L524 HydrophobicContact CE2-CD1 3.8Å; Y520-L524 HydrophobicContact CE2-CG 4.18Å; Y520-L524 PolarHBondContact O-N 3.48Å; Y520-L524 WeakPolarHBondContact OH-CD1 3.3Å; Y520-F714 HydrophobicContact CD2-CE1 4.26Å; Y520-F714 HydrophobicContact CE2-CD1 4.28Å; Y520-F714 AromaticContact CE2-CE1 3.64Å; Y520-F714 HydrophobicContact CE2-CE1 3.64Å; Y520-F714 HydrophobicContact CE2-CZ 4.23Å; Y520-H715 VanDerWaalsContact OH-CA 3.32Å; Y520-H715 WeakPolarHBondContact OH-CA 3.44Å; Y520-H715 WeakPolarHBondContact OH-CB 3.44Å; Y520-H715 PolarHBondContact OH-CD2 3.08Å; Y520-Q718 HydrophobicContact CD2-CB 4.46Å; Y520-Q718 HydrophobicContact CD2-CG 4.21Å; Y520-Q718 HydrophobicContact CE2-CB 3.92Å; Y520-Q718 HydrophobicContact CE2-CG 3.75Å
521	V	91.7	Very high	91.9	Very high	20 Å²	20	39.1 Å²	39.1	12%	0.121	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-42	172.1	178.5	0	0	0	0	110.7	D518 F523 L524 N525	D518-V521 HydrophobicContact CB-CG2 4.22Å; D518-V521 PolarHBondContact O-N 3.33Å; D518-V521 VanDerWaalsContact O-N 3.08Å; V521-F523 PolarHBondContact O-N 3.38Å; V521-L524 PolarHBondContact O-N 3.18Å; V521-N525 WeakPolarHBondContact O-CB 3.42Å; V521-N525 PolarHBondContact O-N 3.31Å; V521-N525 PolarHBondContact O-ND2 3.08Å
522	A	89.5	Confident	92.1	Very high	47 Å²	47	35.9 Å²	35.9	39%	0.388	22%	0.223	S	C	.	.	H	α-helix	trans	-60.9	-44.2	176.3	0	0	0	0	0	112.8	D518 S519 L524 N525	D518-A522 PolarHBondContact O-N 3.41Å; D518-A522 VanDerWaalsContact O-N 3.11Å; S519-A522 PolarHBondContact O-N 3.27Å; A522-L524 VanDerWaalsContact C-N 3.28Å; A522-L524 PolarHBondContact O-N 3.12Å; A522-N525 PolarHBondContact O-N 3.09Å
523	F	91.9	Very high	92.5	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-27.2	177.8	172.2	-95.4	0	0	0	114	H416 L420 S519 Y520 V521 K527 F714	H416-F523 HydrophobicContact CB-CD1 3.91Å; H416-F523 HydrophobicContact CB-CD2 4.25Å; H416-F523 HydrophobicContact CB-CE1 4.03Å; H416-F523 HydrophobicContact CB-CE2 4.35Å; H416-F523 HydrophobicContact CB-CG 4.02Å; H416-F523 HydrophobicContact CB-CZ 4.25Å; L420-F523 HydrophobicContact CB-CE1 4.3Å; L420-F523 HydrophobicContact CB-CZ 4.15Å; L420-F523 HydrophobicContact CD2-CE1 3.84Å; L420-F523 HydrophobicContact CD2-CZ 3.63Å; S519-F523 VanDerWaalsContact O-CB 3.26Å; S519-F523 WeakPolarHBondContact O-CB 3.45Å; S519-F523 PolarHBondContact O-N 2.96Å; Y520-F523 PolarHBondContact O-N 3.37Å; V521-F523 PolarHBondContact O-N 3.38Å; F523-K527 PolarHBondContact O-NZ 2.84Å; F523-K527 VanDerWaalsContact O-NZ 3.13Å; F523-F714 HydrophobicContact CD1-CE1 4.04Å; F523-F714 HydrophobicContact CD1-CZ 4.14Å; F523-F714 AromaticContact CE1-CE1 3.69Å; F523-F714 HydrophobicContact CE1-CE1 3.69Å; F523-F714 AromaticContact CE1-CZ 3.64Å; F523-F714 HydrophobicContact CE1-CZ 3.64Å
524	L	94	Very high	92.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-84.6	-35.5	172.9	-74.1	-177.9	0	0	0	113.1	Y520 V521 A522 S526 K527 I528 L711 F714	Y520-L524 HydrophobicContact CE1-CD1 4.05Å; Y520-L524 HydrophobicContact CE2-CD1 3.8Å; Y520-L524 HydrophobicContact CE2-CG 4.18Å; Y520-L524 PolarHBondContact O-N 3.48Å; Y520-L524 WeakPolarHBondContact OH-CD1 3.3Å; V521-L524 PolarHBondContact O-N 3.18Å; A522-L524 VanDerWaalsContact C-N 3.28Å; A522-L524 PolarHBondContact O-N 3.12Å; L524-S526 VanDerWaalsContact C-N 3.33Å; L524-S526 PolarHBondContact O-N 2.89Å; L524-K527 PolarHBondContact O-N 3.28Å; L524-I528 HydrophobicContact CB-CD1 3.89Å; L524-I528 WeakPolarHBondContact O-CB 3.45Å; L524-I528 WeakPolarHBondContact O-CD1 3.47Å; L524-I528 VanDerWaalsContact O-CG1 3.27Å; L524-I528 WeakPolarHBondContact O-CG1 3.45Å; L524-I528 PolarHBondContact O-N 3.17Å; L524-L711 HydrophobicContact CD2-CD2 3.9Å; L524-F714 HydrophobicContact CD2-CD1 4.14Å; L524-F714 HydrophobicContact CD2-CE1 4.04Å
525	N	93.7	Very high	93.2	Very high	30 Å²	30	29.3 Å²	29.3	16%	0.16	18%	0.176	C	C	.	.	H	α-helix	trans	-52.6	-47	-175.8	-85.2	-24.8	0	0	0	112.6	Y509 S513 V521 A522 I528 E529	Y509-N525 WeakPolarHBondContact CE1-OD1 3.3Å; Y509-N525 PolarHBondContact OH-OD1 3.21Å; S513-N525 VanDerWaalsContact CB-OD1 3.22Å; S513-N525 WeakPolarHBondContact CB-OD1 3.31Å; S513-N525 VanDerWaalsContact OG-CG 3.31Å; S513-N525 PolarHBondContact OG-ND2 2.72Å; S513-N525 PolarHBondContact OG-OD1 2.86Å; V521-N525 WeakPolarHBondContact O-CB 3.42Å; V521-N525 PolarHBondContact O-N 3.31Å; V521-N525 PolarHBondContact O-ND2 3.08Å; A522-N525 PolarHBondContact O-N 3.09Å; N525-I528 PolarHBondContact O-N 3Å; N525-E529 WeakPolarHBondContact O-CB 3.29Å; N525-E529 PolarHBondContact O-N 3.21Å
526	S	93.2	Very high	93.6	Very high	24 Å²	24	24.1 Å²	24.1	17%	0.168	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-48.9	-178.6	55.1	0	0	0	0	112.2	L524 I528 E529 V530 D677	L524-S526 VanDerWaalsContact C-N 3.33Å; L524-S526 PolarHBondContact O-N 2.89Å; S526-I528 PolarHBondContact O-N 3.14Å; S526-E529 PolarHBondContact O-N 3.4Å; S526-V530 WeakPolarHBondContact O-CG2 3.48Å; S526-V530 PolarHBondContact O-N 3.01Å; S526-D677 WeakPolarHBondContact CB-OD1 3.07Å; S526-D677 VanDerWaalsContact CB-OD2 3.29Å; S526-D677 WeakPolarHBondContact CB-OD2 3.46Å; S526-D677 PolarHBondContact OG-OD1 3.09Å; S526-D677 PolarHBondContact OG-OD2 3.21Å
527	K	96.3	Very high	94.2	Very high	1 Å²	1	22 Å²	22	0%	0.004	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-43.8	178.7	-60.7	170.7	-178.3	57.2	0	110.6	L420 F523 L524 L531 E676 D677 F680	L420-K527 HydrophobicContact CD2-CD 4.01Å; F523-K527 PolarHBondContact O-NZ 2.84Å; F523-K527 VanDerWaalsContact O-NZ 3.13Å; L524-K527 PolarHBondContact O-N 3.28Å; K527-L531 VanDerWaalsContact O-CB 3.26Å; K527-L531 WeakPolarHBondContact O-CB 3.41Å; K527-L531 WeakPolarHBondContact O-CD1 3.33Å; K527-L531 WeakPolarHBondContact O-CG 3.39Å; K527-L531 PolarHBondContact O-N 3.39Å; K527-E676 PolarHBondContact NZ-O 3.36Å; K527-D677 HydrophobicContact CG-CB 4.45Å; K527-D677 WeakPolarHBondContact CG-OD1 3.37Å; K527-D677 IonicContact NZ-OD1 3.67Å; K527-D677 PolarHBondContact NZ-OD1 3.48Å; K527-F680 HydrophobicContact CB-CD1 4.21Å; K527-F680 HydrophobicContact CB-CE1 4Å; K527-F680 HydrophobicContact CD-CB 4.27Å; K527-F680 HydrophobicContact CD-CD1 3.92Å; K527-F680 HydrophobicContact CD-CD2 4.36Å; K527-F680 HydrophobicContact CD-CE1 4.32Å; K527-F680 HydrophobicContact CD-CG 3.94Å; K527-F680 HydrophobicContact CG-CD1 3.88Å; K527-F680 HydrophobicContact CG-CE1 4.18Å; K527-F680 HydrophobicContact CG-CG 4.39Å
528	I	97	Very high	94.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.7	-34.7	176.9	-66.4	164.4	0	0	0	111.6	I463 L467 Y509 F510 L524 N525 S526 S532	I463-I528 HydrophobicContact CG1-CG2 3.81Å; I463-I528 HydrophobicContact CG2-CD1 3.81Å; I463-I528 HydrophobicContact CG2-CG2 4.21Å; L467-I528 HydrophobicContact CD1-CG2 4.36Å; Y509-I528 HydrophobicContact CD1-CG2 4.09Å; Y509-I528 HydrophobicContact CE1-CB 4.41Å; Y509-I528 HydrophobicContact CE1-CD1 3.89Å; Y509-I528 HydrophobicContact CE1-CG2 3.98Å; F510-I528 HydrophobicContact CE1-CG2 4.26Å; F510-I528 HydrophobicContact CZ-CG2 3.98Å; L524-I528 HydrophobicContact CB-CD1 3.89Å; L524-I528 WeakPolarHBondContact O-CB 3.45Å; L524-I528 WeakPolarHBondContact O-CD1 3.47Å; L524-I528 VanDerWaalsContact O-CG1 3.27Å; L524-I528 WeakPolarHBondContact O-CG1 3.45Å; L524-I528 PolarHBondContact O-N 3.17Å; N525-I528 PolarHBondContact O-N 3Å; S526-I528 PolarHBondContact O-N 3.14Å; I528-S532 VanDerWaalsContact O-CB 3.23Å; I528-S532 WeakPolarHBondContact O-CB 3.48Å; I528-S532 PolarHBondContact O-N 2.79Å; I528-S532 PolarHBondContact O-OG 2.9Å
529	E	96.9	Very high	95.3	Very high	52 Å²	52	12.9 Å²	12.9	24%	0.243	8%	0.075	C	C	.	.	H	α-helix	trans	-67.9	-51.5	175.3	-173.4	172.9	-158.5	0	0	111.5	F510 N525 S526 L531 S532 L533 K672	F510-E529 HydrophobicContact CE1-CB 4.01Å; F510-E529 HydrophobicContact CE2-CB 4.38Å; F510-E529 HydrophobicContact CE2-CG 4.45Å; F510-E529 HydrophobicContact CZ-CB 3.67Å; F510-E529 HydrophobicContact CZ-CG 4.22Å; N525-E529 WeakPolarHBondContact O-CB 3.29Å; N525-E529 PolarHBondContact O-N 3.21Å; S526-E529 PolarHBondContact O-N 3.4Å; E529-L531 PolarHBondContact O-N 3.47Å; E529-S532 PolarHBondContact O-N 3.45Å; E529-L533 HydrophobicContact CG-CD1 3.85Å; E529-L533 HydrophobicContact CG-CG 4.38Å; E529-L533 WeakPolarHBondContact O-CB 3.48Å; E529-L533 VanDerWaalsContact O-CG 3.27Å; E529-L533 WeakPolarHBondContact O-CG 3.42Å; E529-L533 PolarHBondContact O-N 3.23Å; E529-K672 IonicContact OE1-NZ 3.98Å; E529-K672 PolarHBondContact OE1-NZ 2.95Å; E529-K672 IonicContact OE2-NZ 2.79Å; E529-K672 PolarHBondContact OE2-NZ 3.09Å
530	V	97.3	Very high	95.8	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.6	-43.9	177.7	175.6	0	0	0	0	111.1	S526 L533 R534 K672 M673 F681	S526-V530 WeakPolarHBondContact O-CG2 3.48Å; S526-V530 PolarHBondContact O-N 3.01Å; V530-L533 PolarHBondContact O-N 2.8Å; V530-R534 HydrophobicContact CG1-CG 4.48Å; V530-R534 WeakPolarHBondContact O-CG 3.36Å; V530-R534 PolarHBondContact O-N 3.41Å; V530-K672 HydrophobicContact CG2-CB 4.14Å; V530-M673 HydrophobicContact CG2-CB 4.08Å; V530-M673 HydrophobicContact CG2-CG 4.45Å; V530-F681 HydrophobicContact CB-CE2 3.83Å; V530-F681 HydrophobicContact CB-CZ 3.6Å; V530-F681 HydrophobicContact CG1-CD2 4.44Å; V530-F681 HydrophobicContact CG1-CE1 3.96Å; V530-F681 HydrophobicContact CG1-CE2 3.7Å; V530-F681 HydrophobicContact CG1-CZ 3.43Å; V530-F681 VanDerWaalsContact CG1-CZ 3.43Å; V530-F681 HydrophobicContact CG2-CE2 4.29Å
531	L	97.9	Very high	96.1	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-61.4	-48	174.9	-72.7	168.4	0	0	0	111.8	K527 E529 L533 R534 V535 F680 F681 F703 M704 A707 L711	K527-L531 VanDerWaalsContact O-CB 3.26Å; K527-L531 WeakPolarHBondContact O-CB 3.41Å; K527-L531 WeakPolarHBondContact O-CD1 3.33Å; K527-L531 WeakPolarHBondContact O-CG 3.39Å; K527-L531 PolarHBondContact O-N 3.39Å; E529-L531 PolarHBondContact O-N 3.47Å; L531-L533 VanDerWaalsContact C-N 3.27Å; L531-L533 PolarHBondContact O-N 3.12Å; L531-R534 PolarHBondContact O-N 3.19Å; L531-V535 WeakPolarHBondContact O-CG2 3.17Å; L531-V535 PolarHBondContact O-N 3.2Å; L531-V535 VanDerWaalsContact O-N 3.09Å; L531-F680 HydrophobicContact CD1-CE1 4.2Å; L531-F680 HydrophobicContact CD1-CZ 4.3Å; L531-F681 HydrophobicContact CD2-CE1 3.84Å; L531-F681 HydrophobicContact CD2-CZ 4.41Å; L531-F681 HydrophobicContact CG-CE1 4.02Å; L531-F681 HydrophobicContact CG-CZ 4.08Å; L531-F703 HydrophobicContact CD2-CE1 4Å; L531-M704 HydrophobicContact CB-CE 3.96Å; L531-M704 HydrophobicContact CB-SD 4.2Å; L531-M704 HydrophobicContact CD2-CE 4.1Å; L531-M704 HydrophobicContact CD2-SD 3.53Å; L531-M704 VanDerWaalsContact CD2-SD 3.53Å; L531-M704 HydrophobicContact CG-SD 4.45Å; L531-A707 HydrophobicContact CD1-CB 4.12Å; L531-A707 HydrophobicContact CD2-CB 3.8Å; L531-L711 HydrophobicContact CD1-CD1 3.69Å
532	S	97.9	Very high	96.3	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.007	7%	0.072	C	C	.	.	H	α-helix	trans	-61	-35.2	176.9	-64.5	0	0	0	0	112.4	S506 I528 E529 Q536	S506-S532 PolarHBondContact OG-OG 2.88Å; S506-S532 VanDerWaalsContact OG-OG 3.1Å; I528-S532 VanDerWaalsContact O-CB 3.23Å; I528-S532 WeakPolarHBondContact O-CB 3.48Å; I528-S532 PolarHBondContact O-N 2.79Å; I528-S532 PolarHBondContact O-OG 2.9Å; E529-S532 PolarHBondContact O-N 3.45Å; S532-Q536 WeakPolarHBondContact O-CB 3.4Å; S532-Q536 WeakPolarHBondContact O-CG 3.39Å; S532-Q536 PolarHBondContact O-N 3.3Å; S532-Q536 VanDerWaalsContact O-N 3.1Å; S532-Q536 PolarHBondContact O-NE2 3.02Å
533	L	97.9	Very high	96.7	Very high	15 Å²	15	10.6 Å²	10.6	8%	0.079	5%	0.054	C	C	.	.	H	α-helix	trans	-75.1	-40.8	178.4	-71.5	170.3	0	0	0	112.2	E529 V530 L531 V535 Q536 A537 K665 L668 K672	E529-L533 HydrophobicContact CG-CD1 3.85Å; E529-L533 HydrophobicContact CG-CG 4.38Å; E529-L533 WeakPolarHBondContact O-CB 3.48Å; E529-L533 VanDerWaalsContact O-CG 3.27Å; E529-L533 WeakPolarHBondContact O-CG 3.42Å; E529-L533 PolarHBondContact O-N 3.23Å; V530-L533 PolarHBondContact O-N 2.8Å; L531-L533 VanDerWaalsContact C-N 3.27Å; L531-L533 PolarHBondContact O-N 3.12Å; L533-V535 PolarHBondContact O-N 3.48Å; L533-Q536 PolarHBondContact O-N 3.4Å; L533-A537 WeakPolarHBondContact O-CB 3.44Å; L533-A537 PolarHBondContact O-N 2.87Å; L533-K665 HydrophobicContact CD2-CD 3.75Å; L533-L668 HydrophobicContact CD1-CB 4.2Å; L533-K672 HydrophobicContact CD1-CB 4.4Å; L533-K672 HydrophobicContact CD1-CG 4.19Å
534	R	97.7	Very high	97	Very high	18 Å²	18	12.1 Å²	12.1	7%	0.068	6%	0.06	C	C	.	.	H	α-helix	trans	-59.2	-44	173.4	-75.3	-175	-176.3	-160.4	4.2	111.2	V530 L531 A537 L538 W666 D685 L691	V530-R534 HydrophobicContact CG1-CG 4.48Å; V530-R534 WeakPolarHBondContact O-CG 3.36Å; V530-R534 PolarHBondContact O-N 3.41Å; L531-R534 PolarHBondContact O-N 3.19Å; R534-A537 PolarHBondContact O-N 3Å; R534-L538 PolarHBondContact O-N 3.25Å; R534-W666 HydrophobicContact CB-CZ3 4.42Å; R534-W666 HydrophobicContact CG-CH2 4.48Å; R534-W666 HydrophobicContact CG-CZ3 4.15Å; R534-D685 IonicContact NH1-OD1 2.69Å; R534-D685 PolarHBondContact NH1-OD1 3.27Å; R534-L691 HydrophobicContact CB-CD2 4.21Å
535	V	98.1	Very high	97	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65	-46.9	175.3	-178.9	0	0	0	0	112	V470 I471 L502 L531 L533 A537 L538 L539 L700 M704	V470-V535 HydrophobicContact CG1-CG1 4.26Å; I471-V535 HydrophobicContact CD1-CG1 4.44Å; I471-V535 HydrophobicContact CD1-CG2 4.14Å; L502-V535 HydrophobicContact CD2-CB 3.67Å; L502-V535 HydrophobicContact CD2-CG1 3.48Å; L502-V535 VanDerWaalsContact CD2-CG1 3.48Å; L531-V535 WeakPolarHBondContact O-CG2 3.17Å; L531-V535 PolarHBondContact O-N 3.2Å; L531-V535 VanDerWaalsContact O-N 3.09Å; L533-V535 PolarHBondContact O-N 3.48Å; V535-A537 VanDerWaalsContact C-N 3.29Å; V535-A537 PolarHBondContact O-N 3.24Å; V535-L538 PolarHBondContact O-N 3.06Å; V535-L539 HydrophobicContact CG1-CD1 3.8Å; V535-L539 HydrophobicContact CG1-CG 4.15Å; V535-L539 WeakPolarHBondContact O-CB 3.2Å; V535-L539 WeakPolarHBondContact O-CG 3.45Å; V535-L539 PolarHBondContact O-N 3.23Å; V535-L700 HydrophobicContact CG2-CD1 4.14Å; V535-M704 HydrophobicContact CG2-CE 3.36Å; V535-M704 HydrophobicContact CG2-CG 3.74Å; V535-M704 HydrophobicContact CG2-SD 3.49Å; V535-M704 WeakPolarHBondContact CG2-SD 3.04Å
536	Q	97.6	Very high	97.1	Very high	15 Å²	15	16.2 Å²	16.2	7%	0.07	8%	0.08	C	C	.	.	H	α-helix	trans	-57	-43.3	176.3	-84.4	164.9	81.4	0	0	111.7	L502 S532 L533 C540 K665	L502-Q536 HydrophobicContact CD2-CG 4.01Å; S532-Q536 WeakPolarHBondContact O-CB 3.4Å; S532-Q536 WeakPolarHBondContact O-CG 3.39Å; S532-Q536 PolarHBondContact O-N 3.3Å; S532-Q536 VanDerWaalsContact O-N 3.1Å; S532-Q536 PolarHBondContact O-NE2 3.02Å; L533-Q536 PolarHBondContact O-N 3.4Å; Q536-C540 VanDerWaalsContact O-CB 3.31Å; Q536-C540 WeakPolarHBondContact O-CB 3.41Å; Q536-C540 PolarHBondContact O-N 2.87Å; Q536-C540 PolarHBondContact O-SG 3.31Å; Q536-K665 HydrophobicContact CB-CB 4.37Å; Q536-K665 HydrophobicContact CB-CD 4.18Å; Q536-K665 HydrophobicContact CB-CG 4.16Å
537	A	98.1	Very high	97.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.9	-51.6	-179.9	0	0	0	0	0	112.3	L533 R534 V535 C540 L541 A662 K665 W666	L533-A537 WeakPolarHBondContact O-CB 3.44Å; L533-A537 PolarHBondContact O-N 2.87Å; R534-A537 PolarHBondContact O-N 3Å; V535-A537 VanDerWaalsContact C-N 3.29Å; V535-A537 PolarHBondContact O-N 3.24Å; A537-C540 PolarHBondContact O-N 2.83Å; A537-L541 PolarHBondContact O-N 3.38Å; A537-A662 WeakPolarHBondContact CB-O 3.37Å; A537-A662 WeakPolarHBondContact O-CA 3.32Å; A537-A662 VanDerWaalsContact O-CB 3.3Å; A537-A662 WeakPolarHBondContact O-CB 3.42Å; A537-K665 HydrophobicContact CB-CB 3.85Å; A537-W666 HydrophobicContact CB-CB 3.95Å; A537-W666 HydrophobicContact CB-CE3 3.94Å
538	L	97.9	Very high	97.2	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-71.5	-31.4	-178	-78.7	156.5	0	0	0	112.9	R534 V535 L541 K542 W666 L691 I693 S695 L700	R534-L538 PolarHBondContact O-N 3.25Å; V535-L538 PolarHBondContact O-N 3.06Å; L538-L541 PolarHBondContact O-N 2.92Å; L538-K542 WeakPolarHBondContact O-CB 3.01Å; L538-K542 PolarHBondContact O-N 3.49Å; L538-W666 HydrophobicContact CD1-CZ3 4.02Å; L538-W666 HydrophobicContact CG-CZ3 4.43Å; L538-L691 HydrophobicContact CD1-CD1 4.24Å; L538-L691 HydrophobicContact CD1-CD2 3.62Å; L538-L691 HydrophobicContact CD1-CG 3.95Å; L538-I693 WeakPolarHBondContact CD2-O 3.27Å; L538-S695 VanDerWaalsContact CD2-O 3.28Å; L538-S695 WeakPolarHBondContact CD2-O 3.31Å; L538-L700 HydrophobicContact CB-CD2 3.88Å; L538-L700 HydrophobicContact CD1-CB 4.36Å; L538-L700 HydrophobicContact CD1-CD1 3.83Å; L538-L700 HydrophobicContact CD1-CD2 4.46Å; L538-L700 HydrophobicContact CD1-CG 4.43Å
539	L	97.8	Very high	97.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.1	-40.7	170.4	-72.6	-178.2	0	0	0	112.6	V474 L495 T498 C499 V535 L541 K542 L543	V474-L539 HydrophobicContact CB-CD2 4.48Å; V474-L539 HydrophobicContact CG1-CD2 3.94Å; V474-L539 HydrophobicContact CG2-CD1 3.97Å; V474-L539 HydrophobicContact CG2-CD2 3.73Å; V474-L539 HydrophobicContact CG2-CG 4.31Å; L495-L539 HydrophobicContact CD2-CD2 4.01Å; T498-L539 HydrophobicContact CG2-CD1 4.29Å; C499-L539 HydrophobicContact CB-CB 4.49Å; C499-L539 HydrophobicContact CB-CD1 4.28Å; V535-L539 HydrophobicContact CG1-CD1 3.8Å; V535-L539 HydrophobicContact CG1-CG 4.15Å; V535-L539 WeakPolarHBondContact O-CB 3.2Å; V535-L539 WeakPolarHBondContact O-CG 3.45Å; V535-L539 PolarHBondContact O-N 3.23Å; L539-L541 VanDerWaalsContact C-N 3.32Å; L539-L541 PolarHBondContact O-N 3.35Å; L539-K542 PolarHBondContact O-N 3.18Å; L539-L543 WeakPolarHBondContact O-CB 3.28Å; L539-L543 VanDerWaalsContact O-CG 3.24Å; L539-L543 WeakPolarHBondContact O-CG 3.26Å; L539-L543 PolarHBondContact O-N 3.18Å
540	C	97.8	Very high	97	Very high	12 Å²	12	25.5 Å²	25.5	8%	0.081	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-39.1	172.6	-75.8	0	0	0	0	111.7	Q536 A537 Y544 N658 W661 A662	Q536-C540 VanDerWaalsContact O-CB 3.31Å; Q536-C540 WeakPolarHBondContact O-CB 3.41Å; Q536-C540 PolarHBondContact O-N 2.87Å; Q536-C540 PolarHBondContact O-SG 3.31Å; A537-C540 PolarHBondContact O-N 2.83Å; C540-Y544 PolarHBondContact O-N 3.26Å; C540-N658 WeakPolarHBondContact CB-O 3.46Å; C540-N658 WeakPolarHBondContact O-CB 3.37Å; C540-W661 HydrophobicContact CB-CB 4.34Å; C540-A662 HydrophobicContact CB-CB 3.9Å
541	L	98	Very high	96.9	Very high	23 Å²	23	25.6 Å²	25.6	12%	0.12	13%	0.129	C	C	.	.	H	α-helix	trans	-64.4	-46.5	173.3	-173.9	62.8	0	0	0	111.2	A537 L538 L539 L543 Y544 E545 L659 A662 I693	A537-L541 PolarHBondContact O-N 3.38Å; L538-L541 PolarHBondContact O-N 2.92Å; L539-L541 VanDerWaalsContact C-N 3.32Å; L539-L541 PolarHBondContact O-N 3.35Å; L541-L543 VanDerWaalsContact C-N 3.28Å; L541-L543 PolarHBondContact O-N 3.46Å; L541-Y544 HydrophobicContact CD1-CD1 4.44Å; L541-Y544 CarbonylContact O-C 3.58Å; L541-Y544 WeakPolarHBondContact O-CA 3.46Å; L541-Y544 WeakPolarHBondContact O-CB 3.49Å; L541-Y544 PolarHBondContact O-N 2.98Å; L541-E545 PolarHBondContact O-N 3.27Å; L541-L659 HydrophobicContact CD1-CD1 3.79Å; L541-A662 HydrophobicContact CB-CB 3.91Å; L541-I693 WeakPolarHBondContact CD2-O 3.47Å
542	K	97	Very high	96.8	Very high	18 Å²	18	27.9 Å²	27.9	8%	0.078	14%	0.143	C	C	.	.	H	α-helix	trans	-64.6	-31.9	-179	-168.9	52.5	171.9	167	0	113.4	E481 L495 L538 L539 Y544 E545 L546 I697	E481-K542 IonicContact OE1-NZ 3.05Å; E481-K542 PolarHBondContact OE1-NZ 2.88Å; E481-K542 VanDerWaalsContact OE1-NZ 3.08Å; E481-K542 WeakPolarHBondContact OE2-CE 3.41Å; E481-K542 IonicContact OE2-NZ 3.04Å; E481-K542 PolarHBondContact OE2-NZ 3.28Å; L495-K542 HydrophobicContact CD1-CG 3.78Å; L538-K542 WeakPolarHBondContact O-CB 3.01Å; L538-K542 PolarHBondContact O-N 3.49Å; L539-K542 PolarHBondContact O-N 3.18Å; K542-Y544 VanDerWaalsContact C-N 3.31Å; K542-E545 HydrophobicContact CD-CB 4.18Å; K542-E545 HydrophobicContact CD-CG 4.47Å; K542-E545 WeakPolarHBondContact CD-OE2 3.31Å; K542-E545 WeakPolarHBondContact CE-OE2 3.36Å; K542-E545 IonicContact NZ-OE2 2.68Å; K542-E545 PolarHBondContact NZ-OE2 2.94Å; K542-E545 PolarHBondContact O-N 3.3Å; K542-L546 WeakPolarHBondContact O-CB 2.81Å; K542-L546 VanDerWaalsContact O-CG 3.31Å; K542-L546 WeakPolarHBondContact O-CG 3.32Å; K542-L546 PolarHBondContact O-N 2.95Å; K542-L546 VanDerWaalsContact O-N 3.07Å; K542-I697 HydrophobicContact CB-CD1 4.11Å; K542-I697 HydrophobicContact CD-CG1 4.34Å; K542-I697 HydrophobicContact CG-CD1 4.06Å; K542-I697 HydrophobicContact CG-CG1 4.13Å
543	L	97.1	Very high	96.7	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-28.8	171.1	-71.7	168	0	0	0	112.5	Y492 L495 K496 L539 L541 N658	Y492-L543 HydrophobicContact CD2-CB 4.41Å; Y492-L543 HydrophobicContact CD2-CD2 3.49Å; Y492-L543 VanDerWaalsContact CD2-CD2 3.49Å; Y492-L543 HydrophobicContact CE2-CB 4Å; Y492-L543 HydrophobicContact CE2-CD2 3.63Å; Y492-L543 HydrophobicContact CE2-CG 4.43Å; Y492-L543 VanDerWaalsContact CE2-O 3.31Å; Y492-L543 WeakPolarHBondContact CE2-O 3.44Å; Y492-L543 HydrophobicContact CG-CD2 4.06Å; Y492-L543 WeakPolarHBondContact O-CD2 3.5Å; L495-L543 HydrophobicContact CB-CD2 3.97Å; L495-L543 HydrophobicContact CB-CG 4.48Å; K496-L543 HydrophobicContact CB-CD1 4.41Å; K496-L543 HydrophobicContact CB-CD2 4.05Å; L539-L543 WeakPolarHBondContact O-CB 3.28Å; L539-L543 VanDerWaalsContact O-CG 3.24Å; L539-L543 WeakPolarHBondContact O-CG 3.26Å; L539-L543 PolarHBondContact O-N 3.18Å; L541-L543 VanDerWaalsContact C-N 3.28Å; L541-L543 PolarHBondContact O-N 3.46Å; L543-N658 HydrophobicContact CB-CB 4.41Å
544	Y	97.1	Very high	96.7	Very high	35 Å²	35	30.6 Å²	30.6	14%	0.137	16%	0.157	C	C	.	.	H	α-helix	trans	-72.9	-49.3	169.1	171.1	-101.8	0	0	0	111.6	C540 L541 K542 L546 R547 E548 A551 H655 L656 L659	C540-Y544 PolarHBondContact O-N 3.26Å; L541-Y544 HydrophobicContact CD1-CD1 4.44Å; L541-Y544 CarbonylContact O-C 3.58Å; L541-Y544 WeakPolarHBondContact O-CA 3.46Å; L541-Y544 WeakPolarHBondContact O-CB 3.49Å; L541-Y544 PolarHBondContact O-N 2.98Å; K542-Y544 VanDerWaalsContact C-N 3.31Å; Y544-L546 VanDerWaalsContact C-N 3.32Å; Y544-L546 PolarHBondContact O-N 3.45Å; Y544-R547 CarbonylContact O-C 3.58Å; Y544-R547 VanDerWaalsContact O-C 3.28Å; Y544-R547 WeakPolarHBondContact O-CA 3.21Å; Y544-R547 PolarHBondContact O-N 3.49Å; Y544-E548 HydrophobicContact CE1-CB 4.4Å; Y544-E548 HydrophobicContact CE1-CG 4.15Å; Y544-E548 PolarHBondContact O-N 3.46Å; Y544-A551 HydrophobicContact CE2-CB 4.19Å; Y544-H655 WeakPolarHBondContact CD2-O 3.45Å; Y544-L656 HydrophobicContact CE2-CD2 4.39Å; Y544-L659 HydrophobicContact CD1-CB 4.35Å; Y544-L659 HydrophobicContact CD1-CD1 4.04Å; Y544-L659 HydrophobicContact CD1-CD2 4.42Å; Y544-L659 HydrophobicContact CD2-CB 3.93Å; Y544-L659 HydrophobicContact CD2-CD2 4.49Å; Y544-L659 HydrophobicContact CE1-CD1 4.33Å; Y544-L659 HydrophobicContact CE1-CD2 4.09Å; Y544-L659 HydrophobicContact CE2-CB 4.4Å; Y544-L659 HydrophobicContact CE2-CD2 4.17Å; Y544-L659 HydrophobicContact CG-CB 3.9Å; Y544-L659 HydrophobicContact CG-CD1 4.41Å
545	E	95.8	Very high	96.6	Very high	81 Å²	81	35.3 Å²	35.3	38%	0.379	18%	0.176	S	C	.	.	H	α-helix	trans	-51.4	-47.9	177.3	-70.3	171.8	-144.5	0	0	112.1	L541 K542 R547 E548	L541-E545 PolarHBondContact O-N 3.27Å; K542-E545 HydrophobicContact CD-CB 4.18Å; K542-E545 HydrophobicContact CD-CG 4.47Å; K542-E545 WeakPolarHBondContact CD-OE2 3.31Å; K542-E545 WeakPolarHBondContact CE-OE2 3.36Å; K542-E545 IonicContact NZ-OE2 2.68Å; K542-E545 PolarHBondContact NZ-OE2 2.94Å; K542-E545 PolarHBondContact O-N 3.3Å; E545-R547 PolarHBondContact O-N 3.26Å; E545-E548 WeakPolarHBondContact O-CB 3.49Å; E545-E548 PolarHBondContact O-N 2.92Å; E545-E548 VanDerWaalsContact O-N 3.14Å
546	L	95.4	Very high	96.5	Very high	36 Å²	36	42.5 Å²	42.5	19%	0.188	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-5.4	178.2	-72.4	173.4	0	0	0	114	E481 P491 Y492 L495 K542 Y544	E481-L546 HydrophobicContact CG-CD2 4.16Å; P491-L546 HydrophobicContact CB-CD1 4.34Å; Y492-L546 HydrophobicContact CD2-CB 4.23Å; L495-L546 HydrophobicContact CD1-CD1 3.87Å; K542-L546 WeakPolarHBondContact O-CB 2.81Å; K542-L546 VanDerWaalsContact O-CG 3.31Å; K542-L546 WeakPolarHBondContact O-CG 3.32Å; K542-L546 PolarHBondContact O-N 2.95Å; K542-L546 VanDerWaalsContact O-N 3.07Å; Y544-L546 VanDerWaalsContact C-N 3.32Å; Y544-L546 PolarHBondContact O-N 3.45Å
547	R	95.5	Very high	96.4	Very high	31 Å²	31	46.1 Å²	46.1	12%	0.117	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.1	10.2	178.6	-63.2	-66.4	178	-108.3	19	112.9	Y492 Y544 E545 S549 Q550 A551	Y492-R547 HydrophobicContact CD2-CG 3.8Å; Y492-R547 HydrophobicContact CE2-CG 3.63Å; Y544-R547 CarbonylContact O-C 3.58Å; Y544-R547 VanDerWaalsContact O-C 3.28Å; Y544-R547 WeakPolarHBondContact O-CA 3.21Å; Y544-R547 PolarHBondContact O-N 3.49Å; E545-R547 PolarHBondContact O-N 3.26Å; R547-S549 PolarHBondContact O-N 2.93Å; R547-Q550 WeakPolarHBondContact O-CB 3.41Å; R547-Q550 PolarHBondContact O-N 3.09Å; R547-Q550 VanDerWaalsContact O-N 3.13Å; R547-A551 PolarHBondContact O-N 3.45Å
548	E	95.1	Very high	96.2	Very high	75 Å²	75	46.7 Å²	46.7	35%	0.35	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-42.8	-175.1	-178.2	174.7	-173.6	0	0	111.7	Y544 E545 Q550 A551 V552	Y544-E548 HydrophobicContact CE1-CB 4.4Å; Y544-E548 HydrophobicContact CE1-CG 4.15Å; Y544-E548 PolarHBondContact O-N 3.46Å; E545-E548 WeakPolarHBondContact O-CB 3.49Å; E545-E548 PolarHBondContact O-N 2.92Å; E545-E548 VanDerWaalsContact O-N 3.14Å; E548-Q550 VanDerWaalsContact C-N 3.3Å; E548-Q550 PolarHBondContact O-N 3.21Å; E548-A551 PolarHBondContact O-N 2.92Å; E548-A551 VanDerWaalsContact O-N 3.12Å; E548-V552 HydrophobicContact CG-CG2 4.45Å; E548-V552 WeakPolarHBondContact O-CG2 3.26Å; E548-V552 PolarHBondContact O-N 3.24Å
549	S	94.6	Very high	96.1	Very high	81 Å²	81	48.1 Å²	48.1	57%	0.566	23%	0.233	S	C	*	.	H	α-helix	trans	-58.2	-40.1	174.5	58.4	0	0	0	0	112.6	R547 N553	R547-S549 PolarHBondContact O-N 2.93Å; S549-N553 WeakPolarHBondContact O-CB 3.33Å; S549-N553 PolarHBondContact O-N 2.93Å; S549-N553 PolarHBondContact O-ND2 3.3Å
550	Q	94.6	Very high	95.9	Very high	85 Å²	85	53.7 Å²	53.7	40%	0.397	26%	0.259	S	S	.	.	H	α-helix	trans	-69	-41.3	175	-65	-176	-11.2	0	0	111.1	R547 E548 N553 N554	R547-Q550 WeakPolarHBondContact O-CB 3.41Å; R547-Q550 PolarHBondContact O-N 3.09Å; R547-Q550 VanDerWaalsContact O-N 3.13Å; E548-Q550 VanDerWaalsContact C-N 3.3Å; E548-Q550 PolarHBondContact O-N 3.21Å; Q550-N553 PolarHBondContact O-N 3.02Å; Q550-N554 VanDerWaalsContact O-CB 3.29Å; Q550-N554 WeakPolarHBondContact O-CB 3.22Å; Q550-N554 VanDerWaalsContact O-CG 3.26Å; Q550-N554 PolarHBondContact O-N 3.07Å
551	A	95.8	Very high	95.7	Very high	2 Å²	2	55.2 Å²	55.2	2%	0.017	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-36.7	177.3	0	0	0	0	0	113.5	Y544 R547 E548 Y555 Q652 H655	Y544-A551 HydrophobicContact CE2-CB 4.19Å; R547-A551 PolarHBondContact O-N 3.45Å; E548-A551 PolarHBondContact O-N 2.92Å; E548-A551 VanDerWaalsContact O-N 3.12Å; A551-Y555 VanDerWaalsContact O-CB 3.31Å; A551-Y555 WeakPolarHBondContact O-CB 3.41Å; A551-Y555 PolarHBondContact O-N 3.32Å; A551-Q652 VanDerWaalsContact CA-OE1 3.25Å; A551-Q652 PolarHBondContact O-NE2 3.42Å; A551-Q652 VanDerWaalsContact O-NE2 3.1Å; A551-Q652 PolarHBondContact O-OE1 2.99Å; A551-H655 HydrophobicContact CB-CB 3.98Å
552	V	96.4	Very high	95.4	Very high	48 Å²	48	58.4 Å²	58.4	29%	0.291	28%	0.277	S	S	.	.	H	α-helix	trans	-71	-40.3	174.3	172.8	0	0	0	0	110.9	E548 R556	E548-V552 HydrophobicContact CG-CG2 4.45Å; E548-V552 WeakPolarHBondContact O-CG2 3.26Å; E548-V552 PolarHBondContact O-N 3.24Å; V552-R556 WeakPolarHBondContact O-CG 3.32Å; V552-R556 PolarHBondContact O-N 3.14Å; V552-R556 VanDerWaalsContact O-N 3.09Å
553	N	96.1	Very high	95.1	Very high	62 Å²	62	62.4 Å²	62.4	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-47.4	175	-72.1	-18.1	0	0	0	112	S549 Q550 Y555 R556 H557	S549-N553 WeakPolarHBondContact O-CB 3.33Å; S549-N553 PolarHBondContact O-N 2.93Å; S549-N553 PolarHBondContact O-ND2 3.3Å; Q550-N553 PolarHBondContact O-N 3.02Å; N553-Y555 PolarHBondContact O-N 2.67Å; N553-R556 PolarHBondContact O-N 2.95Å; N553-R556 PolarHBondContact OD1-NH2 2.91Å; N553-H557 PolarHBondContact O-CD2 3.49Å; N553-H557 PolarHBondContact O-N 2.88Å; N553-H557 VanDerWaalsContact O-N 3.1Å
554	N	96.4	Very high	94.8	Very high	12 Å²	12	65.8 Å²	65.8	6%	0.064	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-45.3	178.2	-75.2	-6.5	0	0	0	111.1	Q550 R556 H557 I558 M648 Q651 Q652	Q550-N554 VanDerWaalsContact O-CB 3.29Å; Q550-N554 WeakPolarHBondContact O-CB 3.22Å; Q550-N554 VanDerWaalsContact O-CG 3.26Å; Q550-N554 PolarHBondContact O-N 3.07Å; N554-R556 PolarHBondContact O-N 2.88Å; N554-H557 PolarHBondContact O-N 3.29Å; N554-I558 HydrophobicContact CB-CD1 4.49Å; N554-I558 VanDerWaalsContact O-CB 3.3Å; N554-I558 WeakPolarHBondContact O-CB 3.47Å; N554-I558 WeakPolarHBondContact O-CD1 3.46Å; N554-I558 VanDerWaalsContact O-CG1 3.23Å; N554-I558 WeakPolarHBondContact O-CG1 3.48Å; N554-I558 PolarHBondContact O-N 3.07Å; N554-M648 VanDerWaalsContact OD1-CE 3.31Å; N554-M648 WeakPolarHBondContact OD1-CE 3.42Å; N554-Q651 WeakPolarHBondContact ND2-CB 3.27Å; N554-Q651 PolarHBondContact ND2-OE1 2.72Å; N554-Q652 HydrophobicContact CB-CB 4.47Å
555	Y	96.1	Very high	94.3	Very high	116 Å²	116	66.4 Å²	66.4	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-56.1	-44.5	173.5	176.6	-104.8	0	0	0	113.3	L204 A551 N553 S559	L204-Y555 HydrophobicContact CD2-CD1 4.39Å; L204-Y555 HydrophobicContact CD2-CE1 3.73Å; A551-Y555 VanDerWaalsContact O-CB 3.31Å; A551-Y555 WeakPolarHBondContact O-CB 3.41Å; A551-Y555 PolarHBondContact O-N 3.32Å; N553-Y555 PolarHBondContact O-N 2.67Å; Y555-S559 VanDerWaalsContact O-CB 3.27Å; Y555-S559 WeakPolarHBondContact O-CB 3.33Å; Y555-S559 PolarHBondContact O-N 3.36Å; Y555-S559 PolarHBondContact O-OG 2.69Å
556	R	96.6	Very high	93.6	Very high	152 Å²	152	69.6 Å²	69.6	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-62.1	-47.7	179.1	-74.2	-169.8	-65.4	167.2	-2	112.1	V552 N553 N554 S559 Q560	V552-R556 WeakPolarHBondContact O-CG 3.32Å; V552-R556 PolarHBondContact O-N 3.14Å; V552-R556 VanDerWaalsContact O-N 3.09Å; N553-R556 PolarHBondContact O-N 2.95Å; N553-R556 PolarHBondContact OD1-NH2 2.91Å; N554-R556 PolarHBondContact O-N 2.88Å; R556-S559 PolarHBondContact O-N 3.5Å; R556-Q560 WeakPolarHBondContact O-CB 3.32Å; R556-Q560 PolarHBondContact O-N 3.06Å
557	H	95.2	Very high	92.9	Very high	90 Å²	90	74.7 Å²	74.7	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-69.5	-39.1	179.8	-70.5	-61.6	0	0	0	113.2	N553 N554 S559 Q560 Y561 M648	N553-H557 PolarHBondContact O-CD2 3.49Å; N553-H557 PolarHBondContact O-N 2.88Å; N553-H557 VanDerWaalsContact O-N 3.1Å; N554-H557 PolarHBondContact O-N 3.29Å; H557-S559 VanDerWaalsContact C-N 3.34Å; H557-Q560 PolarHBondContact O-N 3.48Å; H557-Y561 WeakPolarHBondContact O-CB 3.38Å; H557-Y561 PolarHBondContact O-N 3.46Å; H557-M648 HydrophobicContact CB-CE 3.47Å; H557-M648 VanDerWaalsContact CB-CE 3.47Å; H557-M648 HydrophobicContact CB-SD 4.47Å
558	I	95.1	Very high	91.7	Very high	12 Å²	12	75 Å²	75	6%	0.062	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-45.2	172.6	-73.8	165.1	0	0	0	110.4	N554 Q560 Y561 H562 M648 Y649 Q652	N554-I558 HydrophobicContact CB-CD1 4.49Å; N554-I558 VanDerWaalsContact O-CB 3.3Å; N554-I558 WeakPolarHBondContact O-CB 3.47Å; N554-I558 WeakPolarHBondContact O-CD1 3.46Å; N554-I558 VanDerWaalsContact O-CG1 3.23Å; N554-I558 WeakPolarHBondContact O-CG1 3.48Å; N554-I558 PolarHBondContact O-N 3.07Å; I558-Q560 PolarHBondContact O-N 3.48Å; I558-Y561 PolarHBondContact O-N 2.91Å; I558-H562 PolarHBondContact O-N 3.3Å; I558-M648 HydrophobicContact CD1-CB 4.26Å; I558-M648 HydrophobicContact CG1-CB 4.34Å; I558-Y649 HydrophobicContact CB-CE1 4.4Å; I558-Y649 HydrophobicContact CD1-CD1 3.81Å; I558-Y649 HydrophobicContact CD1-CE1 4.14Å; I558-Y649 HydrophobicContact CD1-CG 4.28Å; I558-Y649 HydrophobicContact CG1-CD1 4.26Å; I558-Y649 HydrophobicContact CG1-CE1 4.15Å; I558-Y649 HydrophobicContact CG2-CD1 4.17Å; I558-Y649 HydrophobicContact CG2-CE1 3.39Å; I558-Q652 HydrophobicContact CD1-CB 4.09Å; I558-Q652 HydrophobicContact CD1-CG 4.36Å
559	S	94.5	Very high	89.9	Confident	34 Å²	34	73.6 Å²	73.6	24%	0.238	39%	0.386	C	S	.	.	H	α-helix	trans	-63.5	-40.7	177.3	-59.4	0	0	0	0	112.1	Y555 R556 H557 H562 L563	Y555-S559 VanDerWaalsContact O-CB 3.27Å; Y555-S559 WeakPolarHBondContact O-CB 3.33Å; Y555-S559 PolarHBondContact O-N 3.36Å; Y555-S559 PolarHBondContact O-OG 2.69Å; R556-S559 PolarHBondContact O-N 3.5Å; H557-S559 VanDerWaalsContact C-N 3.34Å; S559-H562 PolarHBondContact O-N 3.38Å; S559-L563 WeakPolarHBondContact O-CG 3.39Å; S559-L563 PolarHBondContact O-N 2.99Å
560	Q	94.5	Very high	87.8	Confident	118 Å²	118	77.5 Å²	77.5	55%	0.551	40%	0.401	S	S	*	.	H	α-helix	trans	-63.7	-44.7	175.2	-172.2	-179.6	5.8	0	0	111.8	R556 H557 I558 H562 L563 T564	R556-Q560 WeakPolarHBondContact O-CB 3.32Å; R556-Q560 PolarHBondContact O-N 3.06Å; H557-Q560 PolarHBondContact O-N 3.48Å; I558-Q560 PolarHBondContact O-N 3.48Å; Q560-H562 VanDerWaalsContact C-N 3.33Å; Q560-H562 PolarHBondContact O-N 3.04Å; Q560-L563 WeakPolarHBondContact O-CB 3.44Å; Q560-L563 PolarHBondContact O-N 3.21Å; Q560-L563 VanDerWaalsContact O-N 3.08Å; Q560-T564 PolarHBondContact O-N 3.28Å; Q560-T564 PolarHBondContact O-OG1 2.86Å
561	Y	93.1	Very high	85.6	Confident	44 Å²	44	84.2 Å²	84.2	17%	0.173	42%	0.422	C	S	.	.	H	α-helix	trans	-60.3	-40.6	173.8	170	-99	0	0	0	112	H557 I558 L563 T564 A565 V640 I641 P642 V645	H557-Y561 WeakPolarHBondContact O-CB 3.38Å; H557-Y561 PolarHBondContact O-N 3.46Å; I558-Y561 PolarHBondContact O-N 2.91Å; Y561-L563 PolarHBondContact O-N 2.97Å; Y561-T564 PolarHBondContact O-N 3.17Å; Y561-T564 PolarHBondContact O-OG1 3.28Å; Y561-A565 WeakPolarHBondContact O-CB 3.38Å; Y561-A565 PolarHBondContact O-N 2.95Å; Y561-V640 PolarHBondContact OH-O 3.41Å; Y561-I641 HydrophobicContact CE1-CG2 4.47Å; Y561-P642 HydrophobicContact CE2-CG 4.04Å; Y561-P642 WeakPolarHBondContact OH-CD 3.24Å; Y561-V645 HydrophobicContact CD1-CG1 3.73Å; Y561-V645 HydrophobicContact CD2-CG2 4.08Å; Y561-V645 HydrophobicContact CE1-CG1 4.13Å; Y561-V645 HydrophobicContact CG-CG1 3.97Å; Y561-V645 HydrophobicContact CG-CG2 4.17Å
562	H	91.1	Very high	83	Confident	89 Å²	89	92.3 Å²	92.3	41%	0.412	46%	0.46	S	S	.	.	H	α-helix	trans	-65.3	-18.9	174.2	-80.7	-41.6	0	0	0	114.7	I558 S559 Q560 K566 Y649	I558-H562 PolarHBondContact O-N 3.3Å; S559-H562 PolarHBondContact O-N 3.38Å; Q560-H562 VanDerWaalsContact C-N 3.33Å; Q560-H562 PolarHBondContact O-N 3.04Å; H562-K566 VanDerWaalsContact O-CD 3.23Å; H562-K566 WeakPolarHBondContact O-CD 3.48Å; H562-K566 VanDerWaalsContact O-CE 3.27Å; H562-K566 WeakPolarHBondContact O-CE 3.31Å; H562-K566 VanDerWaalsContact O-CG 3.31Å; H562-K566 WeakPolarHBondContact O-CG 3.41Å; H562-Y649 PolarHBondContact CE1-OH 3.22Å; H562-Y649 PolarHBondContact NE2-OH 2.98Å
563	L	92.1	Very high	80.4	Confident	103 Å²	103	96.4 Å²	96.4	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-84.6	-53.5	173	-67.9	168.9	0	0	0	110.2	S559 Q560 Y561 A565 K566 E567	S559-L563 WeakPolarHBondContact O-CG 3.39Å; S559-L563 PolarHBondContact O-N 2.99Å; Q560-L563 WeakPolarHBondContact O-CB 3.44Å; Q560-L563 PolarHBondContact O-N 3.21Å; Q560-L563 VanDerWaalsContact O-N 3.08Å; Y561-L563 PolarHBondContact O-N 2.97Å; L563-A565 VanDerWaalsContact C-N 3.29Å; L563-A565 PolarHBondContact O-N 3.22Å; L563-K566 WeakPolarHBondContact O-CB 3.49Å; L563-K566 PolarHBondContact O-N 3.3Å; L563-E567 PolarHBondContact O-N 2.94Å; L563-E567 VanDerWaalsContact O-N 3.15Å
564	T	90.5	Very high	77.5	Confident	75 Å²	75	99.1 Å²	99.1	46%	0.46	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-32.5	-179.1	58	0	0	0	0	112.9	Q560 Y561 K566 E567 G568	Q560-T564 PolarHBondContact O-N 3.28Å; Q560-T564 PolarHBondContact O-OG1 2.86Å; Y561-T564 PolarHBondContact O-N 3.17Å; Y561-T564 PolarHBondContact O-OG1 3.28Å; T564-K566 VanDerWaalsContact C-N 3.3Å; T564-K566 PolarHBondContact O-N 3.48Å; T564-E567 PolarHBondContact O-N 2.67Å; T564-G568 PolarHBondContact O-N 3.1Å
565	A	85.8	Confident	74.8	Confident	48 Å²	48	103.9 Å²	103.9	40%	0.397	55%	0.547	S	S	.	.	H	α-helix	trans	-66.9	-27.1	173.7	0	0	0	0	0	113.4	Y561 L563 G569	Y561-A565 WeakPolarHBondContact O-CB 3.38Å; Y561-A565 PolarHBondContact O-N 2.95Å; L563-A565 VanDerWaalsContact C-N 3.29Å; L563-A565 PolarHBondContact O-N 3.22Å; A565-G569 PolarHBondContact O-N 3.4Å
566	K	81.5	Confident	72.1	Confident	149 Å²	149	103.1 Å²	103.1	65%	0.648	57%	0.565	S	S	*	*	H	α-helix	trans	-75.6	-44.7	172.8	-69.8	167.9	-172.3	165.6	0	110.9	H562 L563 T564 G568 G569	H562-K566 VanDerWaalsContact O-CD 3.23Å; H562-K566 WeakPolarHBondContact O-CD 3.48Å; H562-K566 VanDerWaalsContact O-CE 3.27Å; H562-K566 WeakPolarHBondContact O-CE 3.31Å; H562-K566 VanDerWaalsContact O-CG 3.31Å; H562-K566 WeakPolarHBondContact O-CG 3.41Å; L563-K566 WeakPolarHBondContact O-CB 3.49Å; L563-K566 PolarHBondContact O-N 3.3Å; T564-K566 VanDerWaalsContact C-N 3.3Å; T564-K566 PolarHBondContact O-N 3.48Å; K566-G568 VanDerWaalsContact C-N 3.27Å; K566-G568 PolarHBondContact O-N 3.37Å; K566-G569 PolarHBondContact O-N 3.04Å; K566-G569 VanDerWaalsContact O-N 3.14Å
567	E	81.6	Confident	69.6	Low	143 Å²	143	101.8 Å²	101.8	67%	0.668	57%	0.569	S	S	*	*	H	α-helix	trans	-64.3	-31.1	177.9	-66.3	169.9	179.8	0	0	112.6	L563 T564	L563-E567 PolarHBondContact O-N 2.94Å; L563-E567 VanDerWaalsContact O-N 3.15Å; T564-E567 PolarHBondContact O-N 2.67Å
568	G	69	Low	67.4	Low	36 Å²	36	103.1 Å²	103.1	37%	0.371	59%	0.586	S	S	.	*	H	α-helix	trans	-77.6	-23.4	172.8	0	0	0	0	0	114.9	T564 K566 D570 R571	T564-G568 PolarHBondContact O-N 3.1Å; K566-G568 VanDerWaalsContact C-N 3.27Å; K566-G568 PolarHBondContact O-N 3.37Å; G568-D570 VanDerWaalsContact C-N 3.34Å; G568-D570 PolarHBondContact O-N 3.37Å; G568-R571 PolarHBondContact O-N 3.02Å
569	G	58.2	Low	65	Low	47 Å²	47	112.3 Å²	112.3	49%	0.485	62%	0.622	S	S	.	*	H	α-helix	trans	-59.8	-38.4	-171.7	0	0	0	0	0	114.2	A565 K566 R571	A565-G569 PolarHBondContact O-N 3.4Å; K566-G569 PolarHBondContact O-N 3.04Å; K566-G569 VanDerWaalsContact O-N 3.14Å; G569-R571 PolarHBondContact O-N 3Å; G569-R571 VanDerWaalsContact O-N 3.15Å
570	D	49.6	Very low	62.8	Low	162 Å²	162	117.6 Å²	117.6	87%	0.866	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-3.8	179.5	-70.4	-26.4	0	0	0	113.9	G568	G568-D570 VanDerWaalsContact C-N 3.34Å; G568-D570 PolarHBondContact O-N 3.37Å
571	R	47.9	Very low	60	Low	226 Å²	226	115.8 Å²	115.8	85%	0.853	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-9	-177.1	-69.9	-173.7	172.6	-174.3	-1.1	115.4	G568 G569	G568-R571 PolarHBondContact O-N 3.02Å; G569-R571 PolarHBondContact O-N 3Å; G569-R571 VanDerWaalsContact O-N 3.15Å
572	Q	42.3	Very low	57.6	Low	172 Å²	172	119.8 Å²	119.8	80%	0.804	70%	0.699	S	S	*	*	S	Bend	trans	-141.2	76.3	-177.1	-73	-171.5	-32.6	0	0	113.2
573	C	41.3	Very low	55.2	Low	134 Å²	134	118.5 Å²	118.5	91%	0.905	71%	0.71	S	S	*	*	S	Bend	trans	-167.7	-28.7	149.9	-116.9	0	0	0	0	113.2	S575	C573-S575 PolarHBondContact O-N 3.12Å
574	S	36.1	Very low	53	Low	120 Å²	120	118.7 Å²	118.7	84%	0.839	72%	0.72	S	S	*	*	S	Bend	trans	-70.1	120.7	169.1	-60.9	0	0	0	0	110	A576	S574-A576 PolarHBondContact O-N 3.25Å; S574-A576 VanDerWaalsContact O-N 3.15Å
575	S	39.3	Very low	51	Low	111 Å²	111	124.4 Å²	124.4	78%	0.776	74%	0.741	S	S	*	*			trans	-65.4	113.3	172.1	43.2	0	0	0	0	109.9	C573 N577	C573-S575 PolarHBondContact O-N 3.12Å; S575-N577 VanDerWaalsContact C-N 3.32Å; S575-N577 PolarHBondContact O-N 2.88Å
576	A	38.4	Very low	48.9	Very low	101 Å²	101	125.3 Å²	125.3	84%	0.835	76%	0.755	S	S	*	*			trans	-67.1	93	170.7	0	0	0	0	0	108.8	S574 P578	S574-A576 PolarHBondContact O-N 3.25Å; S574-A576 VanDerWaalsContact O-N 3.15Å; A576-P578 VanDerWaalsContact O-CD 3.29Å; A576-P578 WeakPolarHBondContact O-CD 3.31Å
577	N	44.5	Very low	47.2	Very low	123 Å²	123	125.7 Å²	125.7	66%	0.658	76%	0.764	S	S	*	*			trans	-98.5	99	177	-171.5	25.4	0	0	0	108.8	S575 Y579	S575-N577 VanDerWaalsContact C-N 3.32Å; S575-N577 PolarHBondContact O-N 2.88Å; N577-Y579 PolarHBondContact O-N 3.2Å
578	P	48.8	Very low	45.6	Very low	118 Å²	118	127.6 Å²	127.6	77%	0.766	77%	0.773	S	S	*	*			trans	-80.9	51.7	-170.2	36	-38.4	0	0	0	111.9	A576	A576-P578 VanDerWaalsContact O-CD 3.29Å; A576-P578 WeakPolarHBondContact O-CD 3.31Å
579	Y	44.4	Very low	44.4	Very low	206 Å²	206	134.5 Å²	134.5	81%	0.808	80%	0.796	S	S	*	*			trans	-145.5	65.6	-174.7	-113.1	-83.5	0	0	0	112.6	N577	N577-Y579 PolarHBondContact O-N 3.2Å
580	V	48.3	Very low	43.7	Very low	145 Å²	145	140.9 Å²	140.9	88%	0.879	81%	0.813	S	S	*	*			trans	-125.3	124.9	156.2	-177.4	0	0	0	0	106.6
581	G	36.1	Very low	43.3	Very low	80 Å²	80	137.4 Å²	137.4	83%	0.825	80%	0.801	S	S	*	*			trans	-82.9	150.8	-161.7	0	0	0	0	0	115.2
582	S	43.4	Very low	43.2	Very low	127 Å²	127	135.6 Å²	135.6	89%	0.888	80%	0.802	S	S	*	*			trans	-114.2	125	148.9	-173	0	0	0	0	107.4
583	G	40.1	Very low	43.1	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	79%	0.791	S	S	*	*			trans	-103.5	169.8	-179.2	0	0	0	0	0	113.4
584	S	45.4	Very low	43.4	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	79%	0.787	S	S	*	*			trans	72.3	133.9	167.5	-59.4	0	0	0	0	119.1
585	H	49.5	Very low	43.6	Very low	195 Å²	195	135.7 Å²	135.7	90%	0.903	79%	0.785	S	S	*	*			trans	68.8	133.4	170.5	-48.8	-67.6	0	0	0	116.7
586	G	41.6	Very low	43.6	Very low	67 Å²	67	134 Å²	134	69%	0.691	77%	0.773	S	S	*	*			cis	-176.1	165.5	-5.1	0	0	0	0	0	112.5
587	D	45.9	Very low	43.6	Very low	156 Å²	156	135.5 Å²	135.5	83%	0.834	77%	0.772	S	S	*	*			trans	-78.6	128.6	-166.9	-55.5	-93.5	0	0	0	116.6
588	Q	46.7	Very low	43.5	Very low	183 Å²	183	137.1 Å²	137.1	86%	0.855	78%	0.779	S	S	*	*			trans	-175.5	114.8	141.9	-103.5	151.8	89.1	0	0	107.3
589	Q	44.4	Very low	43.1	Very low	182 Å²	182	135.8 Å²	135.8	85%	0.85	78%	0.778	S	S	*	*				84.1	141.1	51	-155.5	179.8	41.8	0	0	113.3
590	Q	42.8	Very low	43	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	78%	0.776	S	S	*	*			trans	72.4	146.5	-172.8	-58.7	-174.7	-37.6	0	0	117
591	S	41.8	Very low	42.9	Very low	88 Å²	88	130.7 Å²	130.7	62%	0.615	78%	0.776	S	S	*	*				158.9	112.4	-51.6	57.1	0	0	0	0	109.4
592	H	45.3	Very low	43.1	Very low	189 Å²	189	130 Å²	130	88%	0.875	77%	0.769	S	S	*	*			trans	-179.7	158.8	157.7	-86.2	-52.2	0	0	0	109
593	S	42.1	Very low	43.3	Very low	80 Å²	80	129.5 Å²	129.5	56%	0.559	77%	0.765	S	S	*	*				176.6	143.5	-64.6	49.5	0	0	0	0	109.3
594	Q	45.8	Very low	43.6	Very low	176 Å²	176	130.8 Å²	130.8	82%	0.822	76%	0.764	S	S	*	*			trans	73.8	159.4	174.1	-46.4	171.8	7.9	0	0	115
595	H	41.4	Very low	43.6	Very low	171 Å²	171	136 Å²	136	79%	0.792	77%	0.768	S	S	*	*			cis	-170.2	170.5	-13.2	-115.5	-141.8	0	0	0	108.1
596	S	39	Very low	43.3	Very low	75 Å²	75	133.2 Å²	133.2	52%	0.524	76%	0.755	S	S	.	*			cis	-173.5	111.1	-29.9	55.3	0	0	0	0	113.6
597	T	39.3	Very low	43.3	Very low	134 Å²	134	134.9 Å²	134.9	82%	0.822	75%	0.752	S	S	*	*			trans	64	158.1	145	-15.5	0	0	0	0	123.1
598	I	41.9	Very low	43.2	Very low	156 Å²	156	132.6 Å²	132.6	80%	0.8	75%	0.748	S	S	*	*			trans	102.5	103.2	150.3	-66.7	159.3	0	0	0	121.7
599	A	39.9	Very low	43.4	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	75%	0.748	S	S	*	*			trans	64.1	138.1	131	0	0	0	0	0	126.1	I601	A599-I601 HydrophobicContact CB-CD1 4.42Å
600	G	43	Very low	43.3	Very low	76 Å²	76	125 Å²	125	78%	0.784	74%	0.743	S	S	*	*			trans	-153.7	145.3	162.5	0	0	0	0	0	110
601	I	45.1	Very low	43.5	Very low	169 Å²	169	125.8 Å²	125.8	87%	0.867	75%	0.747	S	S	*	*			trans	-147.3	144.7	-154.7	-80.8	149.1	0	0	0	114.8	A599	A599-I601 HydrophobicContact CB-CD1 4.42Å
602	G	41	Very low	43.6	Very low	66 Å²	66	129.7 Å²	129.7	68%	0.68	76%	0.76	S	S	*	*			trans	105	158.5	165	0	0	0	0	0	115.5
603	S	48	Very low	43.7	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	75%	0.752	S	S	*	*			cis	-174.5	163.1	-8.8	-79.8	0	0	0	0	108.9
604	S	46.6	Very low	44	Very low	91 Å²	91	127.2 Å²	127.2	64%	0.636	76%	0.761	S	S	*	*			cis	-179	151.4	-23.1	-85.2	0	0	0	0	111.2
605	R	43.7	Very low	43.9	Very low	217 Å²	217	123.3 Å²	123.3	82%	0.819	76%	0.76	S	S	*	*			trans	70.8	160.5	158.5	-65.3	167.6	-174.4	-94.2	2.9	117
606	Q	44	Very low	44.2	Very low	135 Å²	135	123.1 Å²	123.1	63%	0.631	76%	0.763	S	S	*	*			cis	-174.8	166.6	-9.8	-106.3	-177	-112.2	0	0	109
607	T	41.9	Very low	44.3	Very low	102 Å²	102	123.4 Å²	123.4	63%	0.626	77%	0.77	S	S	*	*			cis	-169.6	129.5	-27.7	21.4	0	0	0	0	113.5
608	S	44.1	Very low	44.9	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	77%	0.774	S	S	*	*			trans	85.9	-178.4	132.8	-43.9	0	0	0	0	121.4
609	P	50.8	Low	45	Very low	132 Å²	132	124.2 Å²	124.2	86%	0.857	77%	0.773	S	S	*	*				-144.9	-171.4	-102.8	44.1	-21.8	0	0	0	118.7
610	G	42.8	Very low	45.7	Very low	72 Å²	72	125.6 Å²	125.6	74%	0.742	77%	0.774	S	S	*	*			trans	119.2	151.2	163.4	0	0	0	0	0	115.5
611	E	45.1	Very low	46.2	Very low	199 Å²	199	127.5 Å²	127.5	93%	0.93	77%	0.771	S	S	*	*			cis	-149.8	-176	-8.5	-76.8	-164.5	100.4	0	0	111.1
612	L	44.8	Very low	46.3	Very low	169 Å²	169	125.2 Å²	125.2	89%	0.885	77%	0.767	S	S	*	*			trans	-111.4	-164.9	-173.3	-74.6	168.1	0	0	0	111.3
613	P	48.4	Very low	47	Very low	109 Å²	109	127.6 Å²	127.6	71%	0.708	77%	0.773	S	S	*	*			cis	-145.5	-174.2	3.5	43.3	-22.1	0	0	0	119.3
614	S	48.1	Very low	46.9	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	77%	0.771	S	S	*	*			trans	102.4	105.6	140.3	-67.6	0	0	0	0	123.9
615	A	43.5	Very low	46.9	Very low	95 Å²	95	128 Å²	128	79%	0.785	78%	0.778	S	S	*	*			trans	63.6	158.9	135.7	0	0	0	0	0	120.1
616	I	47.2	Very low	46.8	Very low	167 Å²	167	123.4 Å²	123.4	86%	0.856	78%	0.779	S	S	*	*			cis	-127.1	157.1	9.1	-66.2	169.1	0	0	0	110
617	A	42	Very low	46.9	Very low	81 Å²	81	122.4 Å²	122.4	67%	0.669	79%	0.788	S	S	*	*			trans	-96.4	150.6	-175.5	0	0	0	0	0	115.3
618	H	50.1	Low	47.1	Very low	196 Å²	196	124.5 Å²	124.5	91%	0.907	80%	0.801	S	S	*	*			trans	-147.7	143.2	143.9	-82.6	-62.3	0	0	0	109.4
619	S	44.8	Very low	47.1	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	80%	0.799	S	S	*	*			trans	-96.5	159.5	-173.5	54.6	0	0	0	0	112.8
620	P	55	Low	47.1	Very low	119 Å²	119	120 Å²	120	77%	0.773	78%	0.783	S	S	*	*				-134.8	136.1	94.5	36.7	-26.2	0	0	0	115.8
621	T	54.3	Low	47.3	Very low	116 Å²	116	122.1 Å²	122.1	71%	0.712	79%	0.787	S	S	*	*			trans	18.6	103.8	147	-32.5	0	0	0	0	120
622	P	45.4	Very low	47.7	Very low	121 Å²	121	120 Å²	120	79%	0.786	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81.3	130.8	154.5	32.7	-30.3	0	0	0	110.6	P624	P622-P624 WeakPolarHBondContact O-CD 3.49Å
623	S	55.7	Low	48.5	Very low	115 Å²	115	117.3 Å²	117.3	80%	0.804	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-95.8	116.9	173	-65.4	0	0	0	0	110.8
624	P	46	Very low	49.2	Very low	119 Å²	119	116.6 Å²	116.6	77%	0.773	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-96.5	153.2	179.1	36.3	-33.3	0	0	0	113.6	P622	P622-P624 WeakPolarHBondContact O-CD 3.49Å
625	A	46.9	Very low	50.3	Low	95 Å²	95	114.3 Å²	114.3	79%	0.785	75%	0.749	S	S	*	*			trans	71.5	160.5	157.6	0	0	0	0	0	120.3
626	S	42	Very low	51.2	Low	121 Å²	121	116.6 Å²	116.6	85%	0.846	76%	0.756	S	S	*	*			trans	75.6	73.8	157.3	-57.1	0	0	0	0	120
627	S	45.3	Very low	52.6	Low	115 Å²	115	110 Å²	110	80%	0.804	73%	0.73	S	S	*	*			trans	-145.5	82.8	143.6	61.6	0	0	0	0	111.4
628	T	47.7	Very low	54.4	Low	146 Å²	146	111.1 Å²	111.1	90%	0.896	72%	0.723	S	S	*	*			trans	-73.1	130.6	173.3	34.3	0	0	0	0	111.9
629	G	43.6	Very low	55.9	Low	71 Å²	71	105.7 Å²	105.7	73%	0.732	70%	0.704	S	S	*	*			trans	76.2	36.8	150.4	0	0	0	0	0	117.4	S631	G629-S631 PolarHBondContact O-N 3.28Å
630	S	50.5	Low	57.8	Low	75 Å²	75	105.8 Å²	105.8	52%	0.524	70%	0.7	S	S	.	*			trans	-70.4	85.7	157.3	52.1	0	0	0	0	109.6	H632	S630-H632 PolarHBondContact O-CD2 3.03Å; S630-H632 PolarHBondContact O-N 3.48Å; S630-H632 PolarHBondContact O-NE2 3.3Å; S630-H632 PolarHBondContact OG-CE1 2.89Å; S630-H632 PolarHBondContact OG-NE2 3.47Å
631	S	48	Very low	59.4	Low	116 Å²	116	103 Å²	103	81%	0.811	68%	0.677	S	S	*	*			trans	-63.2	91	163	-68	0	0	0	0	108.2	G629 S633	G629-S631 PolarHBondContact O-N 3.28Å; S631-S633 PolarHBondContact O-N 3.1Å
632	H	53	Low	61.3	Low	155 Å²	155	100.1 Å²	100.1	72%	0.718	66%	0.661	S	S	*	*			trans	-66.5	86.3	175.7	-59.3	-75.1	0	0	0	108.9	S630 L634	S630-H632 PolarHBondContact O-CD2 3.03Å; S630-H632 PolarHBondContact O-N 3.48Å; S630-H632 PolarHBondContact O-NE2 3.3Å; S630-H632 PolarHBondContact OG-CE1 2.89Å; S630-H632 PolarHBondContact OG-NE2 3.47Å; H632-L634 PolarHBondContact O-N 2.86Å
633	S	61.1	Low	63.6	Low	113 Å²	113	100 Å²	100	79%	0.79	65%	0.65	S	S	*	*			trans	-56.9	107.7	165.6	54.8	0	0	0	0	107.5	S631	S631-S633 PolarHBondContact O-N 3.1Å
634	L	63.3	Low	65.4	Low	94 Å²	94	99.2 Å²	99.2	49%	0.492	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-53.1	145.3	172.7	-64.5	172.9	0	0	0	108.9	H632 L638 V640	H632-L634 PolarHBondContact O-N 2.86Å; L634-L638 HydrophobicContact CB-CB 4.13Å; L634-L638 HydrophobicContact CB-CD1 4.41Å; L634-V640 HydrophobicContact CD1-CG2 3.53Å
635	A	70.2	Confident	67.8	Low	60 Å²	60	94.1 Å²	94.1	50%	0.496	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-52.5	132.3	179.4	0	0	0	0	0	109.9	G637 L638	A635-G637 PolarHBondContact O-N 2.95Å; A635-L638 HydrophobicContact CB-CD1 3.91Å; A635-L638 HydrophobicContact CB-CG 4.22Å; A635-L638 PolarHBondContact O-N 3.25Å
636	P	62.9	Low	70	Confident	143 Å²	143	92.7 Å²	92.7	93%	0.929	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	116.2	-177.8	-28.2	35.4	0	0	0	111.3
637	G	77.6	Confident	72.6	Confident	29 Å²	29	90.4 Å²	90.4	30%	0.299	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	105.7	9.9	-170.5	0	0	0	0	0	115.6	L29 A635	L29-G637 WeakPolarHBondContact CD1-O 3.04Å; A635-G637 PolarHBondContact O-N 2.95Å
638	L	79.3	Confident	75	Confident	103 Å²	103	86.6 Å²	86.6	54%	0.539	53%	0.529	S	S	.	.			trans	-100	139.9	163.3	-64.6	178.8	0	0	0	111	L634 A635	L634-L638 HydrophobicContact CB-CB 4.13Å; L634-L638 HydrophobicContact CB-CD1 4.41Å; A635-L638 HydrophobicContact CB-CD1 3.91Å; A635-L638 HydrophobicContact CB-CG 4.22Å; A635-L638 PolarHBondContact O-N 3.25Å
639	V	80.4	Confident	77.3	Confident	83 Å²	83	82.9 Å²	82.9	50%	0.503	50%	0.499	S	S	.	.			trans	-125.2	134.7	174.8	168.3	0	0	0	0	109.3	L29 I641	L29-V639 HydrophobicContact CD1-CB 4.46Å; L29-V639 HydrophobicContact CD1-CG2 3.7Å; L29-V639 HydrophobicContact CD2-CG2 3.69Å; L29-V639 HydrophobicContact CG-CG2 4.38Å; V639-I641 HydrophobicContact CG1-CG1 4.28Å; V639-I641 PolarHBondContact O-N 3.36Å
640	V	85	Confident	79.8	Confident	112 Å²	112	85.3 Å²	85.3	68%	0.679	49%	0.489	S	S	*	.			trans	-79.5	115	175.3	-175.8	0	0	0	0	109.5	Y561 L634	Y561-V640 PolarHBondContact OH-O 3.41Å; L634-V640 HydrophobicContact CD1-CG2 3.53Å
641	I	90.2	Very high	81.9	Confident	60 Å²	60	86.1 Å²	86.1	31%	0.308	49%	0.485	S	S	.	.			trans	-106.2	130.9	176.7	-59.9	176.1	0	0	0	108.6	Y561 V639 V645 E646 Y649	Y561-I641 HydrophobicContact CE1-CG2 4.47Å; V639-I641 HydrophobicContact CG1-CG1 4.28Å; V639-I641 PolarHBondContact O-N 3.36Å; I641-V645 HydrophobicContact CG2-CB 3.92Å; I641-V645 HydrophobicContact CG2-CG1 4.08Å; I641-E646 HydrophobicContact CG2-CB 4.44Å; I641-Y649 HydrophobicContact CD1-CE2 4.3Å; I641-Y649 HydrophobicContact CG2-CE2 4.14Å
642	P	93.7	Very high	84.2	Confident	56 Å²	56	81.6 Å²	81.6	36%	0.364	45%	0.451	S	S	.	.			trans	-61	139.6	174.6	-25.4	35.8	0	0	0	112.7	Y561 N644 V645 E646	Y561-P642 HydrophobicContact CE2-CG 4.04Å; Y561-P642 WeakPolarHBondContact OH-CD 3.24Å; P642-N644 VanDerWaalsContact CB-OD1 3.25Å; P642-N644 WeakPolarHBondContact CB-OD1 3.48Å; P642-N644 PolarHBondContact O-N 2.95Å; P642-N644 VanDerWaalsContact O-N 3.12Å; P642-V645 HydrophobicContact CB-CG2 4.19Å; P642-V645 HydrophobicContact CG-CG2 4.42Å; P642-V645 WeakPolarHBondContact O-CA 3.36Å; P642-V645 WeakPolarHBondContact O-CB 3.26Å; P642-V645 PolarHBondContact O-N 3.46Å; P642-E646 PolarHBondContact O-N 3.4Å
643	Q	93.5	Very high	86.3	Confident	118 Å²	118	79.1 Å²	79.1	55%	0.551	44%	0.442	S	S	*	.	H	α-helix	trans	-54.7	-35.7	-173.3	-168.8	63.6	65.4	0	0	114.2	E646 N647	Q643-E646 PolarHBondContact NE2-OE2 2.92Å; Q643-E646 PolarHBondContact O-N 2.72Å; Q643-N647 PolarHBondContact NE2-OD1 2.95Å; Q643-N647 WeakPolarHBondContact O-CB 3.4Å; Q643-N647 PolarHBondContact O-N 3.1Å; Q643-N647 PolarHBondContact O-OD1 2.93Å
644	N	94.4	Very high	87.9	Confident	100 Å²	100	76.4 Å²	76.4	54%	0.535	42%	0.423	S	S	.	.	H	α-helix	trans	-65	-41.7	175.5	62.5	-42.8	0	0	0	111.6	P642 N647 M648	P642-N644 VanDerWaalsContact CB-OD1 3.25Å; P642-N644 WeakPolarHBondContact CB-OD1 3.48Å; P642-N644 PolarHBondContact O-N 2.95Å; P642-N644 VanDerWaalsContact O-N 3.12Å; N644-N647 PolarHBondContact O-N 3.02Å; N644-M648 WeakPolarHBondContact O-CG 3.45Å; N644-M648 PolarHBondContact O-N 3.4Å
645	V	94.7	Very high	89.4	Confident	12 Å²	12	72.4 Å²	72.4	7%	0.073	40%	0.402	C	S	.	.	H	α-helix	trans	-69	-39	177	-172.2	0	0	0	0	110.6	Y561 I641 P642 N647 M648 Y649	Y561-V645 HydrophobicContact CD1-CG1 3.73Å; Y561-V645 HydrophobicContact CD2-CG2 4.08Å; Y561-V645 HydrophobicContact CE1-CG1 4.13Å; Y561-V645 HydrophobicContact CG-CG1 3.97Å; Y561-V645 HydrophobicContact CG-CG2 4.17Å; I641-V645 HydrophobicContact CG2-CB 3.92Å; I641-V645 HydrophobicContact CG2-CG1 4.08Å; P642-V645 HydrophobicContact CB-CG2 4.19Å; P642-V645 HydrophobicContact CG-CG2 4.42Å; P642-V645 WeakPolarHBondContact O-CA 3.36Å; P642-V645 WeakPolarHBondContact O-CB 3.26Å; P642-V645 PolarHBondContact O-N 3.46Å; V645-N647 PolarHBondContact O-N 2.83Å; V645-M648 PolarHBondContact O-N 3.39Å; V645-Y649 HydrophobicContact CG1-CD2 4.13Å; V645-Y649 HydrophobicContact CG1-CE2 3.6Å; V645-Y649 WeakPolarHBondContact O-CD2 3.38Å; V645-Y649 PolarHBondContact O-N 2.97Å
646	E	94.6	Very high	90.7	Very high	65 Å²	65	73.1 Å²	73.1	30%	0.304	40%	0.397	S	S	.	.	H	α-helix	trans	-58.2	-47.2	172.8	-159.4	-149.2	145.8	0	0	111.9	I641 P642 Q643 M648 Y649 K650	I641-E646 HydrophobicContact CG2-CB 4.44Å; P642-E646 PolarHBondContact O-N 3.4Å; Q643-E646 PolarHBondContact NE2-OE2 2.92Å; Q643-E646 PolarHBondContact O-N 2.72Å; E646-M648 VanDerWaalsContact C-N 3.28Å; E646-M648 PolarHBondContact O-N 2.68Å; E646-Y649 WeakPolarHBondContact O-CB 3.44Å; E646-Y649 PolarHBondContact O-N 3.47Å; E646-K650 PolarHBondContact O-N 3.34Å; E646-K650 WeakPolarHBondContact OE1-CE 3.3Å; E646-K650 IonicContact OE1-NZ 2.61Å; E646-K650 PolarHBondContact OE1-NZ 3.34Å
647	N	95.9	Very high	92.3	Very high	73 Å²	73	70.3 Å²	70.3	39%	0.39	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-35.5	176.8	-68.1	-5.2	0	0	0	111.8	Q643 N644 V645 K650 Q651	Q643-N647 PolarHBondContact NE2-OD1 2.95Å; Q643-N647 WeakPolarHBondContact O-CB 3.4Å; Q643-N647 PolarHBondContact O-N 3.1Å; Q643-N647 PolarHBondContact O-OD1 2.93Å; N644-N647 PolarHBondContact O-N 3.02Å; V645-N647 PolarHBondContact O-N 2.83Å; N647-K650 PolarHBondContact O-N 2.85Å; N647-Q651 WeakPolarHBondContact O-CG 3.34Å; N647-Q651 PolarHBondContact O-N 3.12Å
648	M	95.4	Very high	93.2	Very high	35 Å²	35	70 Å²	70	17%	0.172	36%	0.363	C	S	.	.	H	α-helix	trans	-68.6	-36	174.5	-68.1	168	90.6	0	0	112.3	N554 H557 I558 N644 V645 E646 Q652	N554-M648 VanDerWaalsContact OD1-CE 3.31Å; N554-M648 WeakPolarHBondContact OD1-CE 3.42Å; H557-M648 HydrophobicContact CB-CE 3.47Å; H557-M648 VanDerWaalsContact CB-CE 3.47Å; H557-M648 HydrophobicContact CB-SD 4.47Å; I558-M648 HydrophobicContact CD1-CB 4.26Å; I558-M648 HydrophobicContact CG1-CB 4.34Å; N644-M648 WeakPolarHBondContact O-CG 3.45Å; N644-M648 PolarHBondContact O-N 3.4Å; V645-M648 PolarHBondContact O-N 3.39Å; E646-M648 VanDerWaalsContact C-N 3.28Å; E646-M648 PolarHBondContact O-N 2.68Å; M648-Q652 WeakPolarHBondContact O-CB 3.42Å; M648-Q652 PolarHBondContact O-N 2.91Å
649	Y	95.6	Very high	94	Very high	68 Å²	68	66.6 Å²	66.6	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-62.8	-45.1	169.7	-72.4	-68.4	0	0	0	111.7	I558 H562 I641 V645 E646 Q651 Q652 L653	I558-Y649 HydrophobicContact CB-CE1 4.4Å; I558-Y649 HydrophobicContact CD1-CD1 3.81Å; I558-Y649 HydrophobicContact CD1-CE1 4.14Å; I558-Y649 HydrophobicContact CD1-CG 4.28Å; I558-Y649 HydrophobicContact CG1-CD1 4.26Å; I558-Y649 HydrophobicContact CG1-CE1 4.15Å; I558-Y649 HydrophobicContact CG2-CD1 4.17Å; I558-Y649 HydrophobicContact CG2-CE1 3.39Å; H562-Y649 PolarHBondContact CE1-OH 3.22Å; H562-Y649 PolarHBondContact NE2-OH 2.98Å; I641-Y649 HydrophobicContact CD1-CE2 4.3Å; I641-Y649 HydrophobicContact CG2-CE2 4.14Å; V645-Y649 HydrophobicContact CG1-CD2 4.13Å; V645-Y649 HydrophobicContact CG1-CE2 3.6Å; V645-Y649 WeakPolarHBondContact O-CD2 3.38Å; V645-Y649 PolarHBondContact O-N 2.97Å; E646-Y649 WeakPolarHBondContact O-CB 3.44Å; E646-Y649 PolarHBondContact O-N 3.47Å; Y649-Q651 PolarHBondContact O-N 3.35Å; Y649-Q652 PolarHBondContact O-N 3.03Å; Y649-L653 WeakPolarHBondContact O-CB 3.28Å; Y649-L653 PolarHBondContact O-N 3.47Å
650	K	96.4	Very high	94.8	Very high	121 Å²	121	66.3 Å²	66.3	53%	0.526	34%	0.339	S	S	.	.	H	α-helix	trans	-59.1	-45	177.6	-74.1	169.5	167	168.2	0	111.6	E646 N647 S654	E646-K650 PolarHBondContact O-N 3.34Å; E646-K650 WeakPolarHBondContact OE1-CE 3.3Å; E646-K650 IonicContact OE1-NZ 2.61Å; E646-K650 PolarHBondContact OE1-NZ 3.34Å; N647-K650 PolarHBondContact O-N 2.85Å; K650-S654 WeakPolarHBondContact O-CB 3.45Å; K650-S654 PolarHBondContact O-N 3.2Å; K650-S654 VanDerWaalsContact O-N 3.09Å
651	Q	95.9	Very high	95.4	Very high	92 Å²	92	65.1 Å²	65.1	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-47.6	173.1	-72.8	176.5	-1.2	0	0	112.2	N554 N647 Y649 L653 S654 H655	N554-Q651 WeakPolarHBondContact ND2-CB 3.27Å; N554-Q651 PolarHBondContact ND2-OE1 2.72Å; N647-Q651 WeakPolarHBondContact O-CG 3.34Å; N647-Q651 PolarHBondContact O-N 3.12Å; Y649-Q651 PolarHBondContact O-N 3.35Å; Q651-L653 VanDerWaalsContact C-N 3.34Å; Q651-L653 PolarHBondContact O-N 2.91Å; Q651-S654 WeakPolarHBondContact O-CB 3.34Å; Q651-S654 PolarHBondContact O-N 2.92Å; Q651-S654 VanDerWaalsContact O-N 3.12Å; Q651-H655 PolarHBondContact O-CD2 3.04Å; Q651-H655 VanDerWaalsContact O-CG 3.28Å; Q651-H655 PolarHBondContact O-N 3.49Å
652	Q	96.4	Very high	95.8	Very high	22 Å²	22	62.2 Å²	62.2	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-58.4	-45.6	-179.8	-171.5	66.2	4.5	0	0	111.8	A551 N554 I558 M648 Y649 H655 L656	A551-Q652 VanDerWaalsContact CA-OE1 3.25Å; A551-Q652 PolarHBondContact O-NE2 3.42Å; A551-Q652 VanDerWaalsContact O-NE2 3.1Å; A551-Q652 PolarHBondContact O-OE1 2.99Å; N554-Q652 HydrophobicContact CB-CB 4.47Å; I558-Q652 HydrophobicContact CD1-CB 4.09Å; I558-Q652 HydrophobicContact CD1-CG 4.36Å; M648-Q652 WeakPolarHBondContact O-CB 3.42Å; M648-Q652 PolarHBondContact O-N 2.91Å; Y649-Q652 PolarHBondContact O-N 3.03Å; Q652-H655 PolarHBondContact O-N 3.13Å; Q652-L656 HydrophobicContact CG-CD1 3.99Å; Q652-L656 WeakPolarHBondContact O-CB 3.33Å; Q652-L656 VanDerWaalsContact O-CG 3.32Å; Q652-L656 WeakPolarHBondContact O-CG 3.38Å; Q652-L656 PolarHBondContact O-N 3.46Å
653	L	96	Very high	96	Very high	103 Å²	103	62.4 Å²	62.4	54%	0.539	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-44.7	175.8	-177.5	59.5	0	0	0	110.8	Y649 Q651 H655 L656 H657	Y649-L653 WeakPolarHBondContact O-CB 3.28Å; Y649-L653 PolarHBondContact O-N 3.47Å; Q651-L653 VanDerWaalsContact C-N 3.34Å; Q651-L653 PolarHBondContact O-N 2.91Å; L653-H655 PolarHBondContact O-N 3.43Å; L653-L656 PolarHBondContact O-N 3.44Å; L653-H657 WeakPolarHBondContact O-CB 3.38Å; L653-H657 PolarHBondContact O-N 3.33Å
654	S	95.1	Very high	96.2	Very high	56 Å²	56	60.4 Å²	60.4	39%	0.392	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-43.5	177	-171.7	0	0	0	0	113	K650 Q651	K650-S654 WeakPolarHBondContact O-CB 3.45Å; K650-S654 PolarHBondContact O-N 3.2Å; K650-S654 VanDerWaalsContact O-N 3.09Å; Q651-S654 WeakPolarHBondContact O-CB 3.34Å; Q651-S654 PolarHBondContact O-N 2.92Å; Q651-S654 VanDerWaalsContact O-N 3.12Å
655	H	94.8	Very high	96.3	Very high	10 Å²	10	57.5 Å²	57.5	5%	0.046	28%	0.279	C	S	.	.	H	α-helix	trans	-69.3	-45.7	177.2	-56.2	-32.3	0	0	0	112.2	Y544 A551 Q651 Q652 L653 H657 N658 L659	Y544-H655 WeakPolarHBondContact CD2-O 3.45Å; A551-H655 HydrophobicContact CB-CB 3.98Å; Q651-H655 PolarHBondContact O-CD2 3.04Å; Q651-H655 VanDerWaalsContact O-CG 3.28Å; Q651-H655 PolarHBondContact O-N 3.49Å; Q652-H655 PolarHBondContact O-N 3.13Å; L653-H655 PolarHBondContact O-N 3.43Å; H655-H657 VanDerWaalsContact C-N 3.29Å; H655-H657 PolarHBondContact O-N 2.95Å; H655-N658 WeakPolarHBondContact O-CB 3.47Å; H655-N658 PolarHBondContact O-N 3.23Å; H655-L659 PolarHBondContact O-N 2.62Å
656	L	96.9	Very high	96.5	Very high	74 Å²	74	58.3 Å²	58.3	39%	0.387	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-27.9	178	-67.1	176.9	0	0	0	112.7	Y544 Q652 L653 N658 L659 M660	Y544-L656 HydrophobicContact CE2-CD2 4.39Å; Q652-L656 HydrophobicContact CG-CD1 3.99Å; Q652-L656 WeakPolarHBondContact O-CB 3.33Å; Q652-L656 VanDerWaalsContact O-CG 3.32Å; Q652-L656 WeakPolarHBondContact O-CG 3.38Å; Q652-L656 PolarHBondContact O-N 3.46Å; L653-L656 PolarHBondContact O-N 3.44Å; L656-N658 VanDerWaalsContact C-N 3.32Å; L656-N658 PolarHBondContact O-N 3.3Å; L656-L659 PolarHBondContact O-N 2.94Å; L656-M660 WeakPolarHBondContact O-CB 3.41Å; L656-M660 PolarHBondContact O-N 3.14Å
657	H	96	Very high	96.6	Very high	84 Å²	84	59.3 Å²	59.3	39%	0.389	29%	0.288	S	S	.	.	H	α-helix	trans	-61.1	-40.1	174	-168.7	88.7	0	0	0	111.6	L653 H655 M660 W661	L653-H657 WeakPolarHBondContact O-CB 3.38Å; L653-H657 PolarHBondContact O-N 3.33Å; H655-H657 VanDerWaalsContact C-N 3.29Å; H655-H657 PolarHBondContact O-N 2.95Å; H657-M660 PolarHBondContact O-N 3.16Å; H657-W661 AromaticContact CD2-CD1 3.39Å; H657-W661 AromaticContact CD2-NE1 3.49Å; H657-W661 PolarHBondContact CD2-NE1 3Å; H657-W661 AromaticContact CE1-CD1 3.97Å; H657-W661 AromaticContact CE1-NE1 3.35Å; H657-W661 PolarHBondContact CE1-NE1 2.8Å; H657-W661 VanDerWaalsContact CE1-NE1 3.35Å; H657-W661 AromaticContact CG-CD1 3.95Å; H657-W661 AromaticContact NE2-CD1 3.39Å; H657-W661 AromaticContact NE2-NE1 2.92Å; H657-W661 PolarHBondContact NE2-NE1 3.21Å; H657-W661 PolarHBondContact O-N 3.06Å
658	N	96.6	Very high	96.7	Very high	23 Å²	23	59 Å²	59	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-48.9	173.6	-71.8	-29.9	0	0	0	111.3	C540 L543 H655 L656 M660 W661 A662	C540-N658 WeakPolarHBondContact CB-O 3.46Å; C540-N658 WeakPolarHBondContact O-CB 3.37Å; L543-N658 HydrophobicContact CB-CB 4.41Å; H655-N658 WeakPolarHBondContact O-CB 3.47Å; H655-N658 PolarHBondContact O-N 3.23Å; L656-N658 VanDerWaalsContact C-N 3.32Å; L656-N658 PolarHBondContact O-N 3.3Å; N658-M660 PolarHBondContact O-N 3.12Å; N658-W661 PolarHBondContact O-N 3.27Å; N658-A662 PolarHBondContact O-N 3.05Å
659	L	97.2	Very high	96.8	Very high	31 Å²	31	57.4 Å²	57.4	16%	0.162	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-43.8	177.6	-178.6	61.6	0	0	0	112.4	L541 Y544 H655 L656 W661 A662 H663	L541-L659 HydrophobicContact CD1-CD1 3.79Å; Y544-L659 HydrophobicContact CD1-CB 4.35Å; Y544-L659 HydrophobicContact CD1-CD1 4.04Å; Y544-L659 HydrophobicContact CD1-CD2 4.42Å; Y544-L659 HydrophobicContact CD2-CB 3.93Å; Y544-L659 HydrophobicContact CD2-CD2 4.49Å; Y544-L659 HydrophobicContact CE1-CD1 4.33Å; Y544-L659 HydrophobicContact CE1-CD2 4.09Å; Y544-L659 HydrophobicContact CE2-CB 4.4Å; Y544-L659 HydrophobicContact CE2-CD2 4.17Å; Y544-L659 HydrophobicContact CG-CB 3.9Å; Y544-L659 HydrophobicContact CG-CD1 4.41Å; H655-L659 PolarHBondContact O-N 2.62Å; L656-L659 PolarHBondContact O-N 2.94Å; L659-W661 PolarHBondContact O-N 2.84Å; L659-A662 WeakPolarHBondContact O-CB 3.34Å; L659-A662 PolarHBondContact O-N 3.26Å; L659-H663 PolarHBondContact O-CD2 2.94Å; L659-H663 PolarHBondContact O-N 2.95Å
660	M	97.7	Very high	96.7	Very high	78 Å²	78	58.4 Å²	58.4	38%	0.384	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-46.8	175.4	-179.2	-169.3	68	0	0	111.6	L656 H657 N658 A662 L664	L656-M660 WeakPolarHBondContact O-CB 3.41Å; L656-M660 PolarHBondContact O-N 3.14Å; H657-M660 PolarHBondContact O-N 3.16Å; N658-M660 PolarHBondContact O-N 3.12Å; M660-A662 VanDerWaalsContact C-N 3.33Å; M660-A662 PolarHBondContact O-N 3.45Å; M660-L664 WeakPolarHBondContact O-CB 3.49Å; M660-L664 PolarHBondContact O-N 3.15Å
661	W	97.1	Very high	96.7	Very high	86 Å²	86	59.7 Å²	59.7	33%	0.326	30%	0.297	S	S	.	.	H	α-helix	trans	-66.8	-32.8	176.8	-82	115.5	0	0	0	112.9	C540 H657 N658 L659 L664 K665	C540-W661 HydrophobicContact CB-CB 4.34Å; H657-W661 AromaticContact CD2-CD1 3.39Å; H657-W661 AromaticContact CD2-NE1 3.49Å; H657-W661 PolarHBondContact CD2-NE1 3Å; H657-W661 AromaticContact CE1-CD1 3.97Å; H657-W661 AromaticContact CE1-NE1 3.35Å; H657-W661 PolarHBondContact CE1-NE1 2.8Å; H657-W661 VanDerWaalsContact CE1-NE1 3.35Å; H657-W661 AromaticContact CG-CD1 3.95Å; H657-W661 AromaticContact NE2-CD1 3.39Å; H657-W661 AromaticContact NE2-NE1 2.92Å; H657-W661 PolarHBondContact NE2-NE1 3.21Å; H657-W661 PolarHBondContact O-N 3.06Å; N658-W661 PolarHBondContact O-N 3.27Å; L659-W661 PolarHBondContact O-N 2.84Å; W661-L664 HydrophobicContact CE3-CB 4.37Å; W661-L664 HydrophobicContact CE3-CD2 3.76Å; W661-L664 HydrophobicContact CE3-CG 4.23Å; W661-L664 HydrophobicContact CH2-CD2 4.28Å; W661-L664 HydrophobicContact CZ3-CD2 3.57Å; W661-L664 HydrophobicContact CZ3-CG 4.25Å; W661-L664 PolarHBondContact O-N 3.37Å; W661-K665 HydrophobicContact CE3-CD 4.36Å; W661-K665 VanDerWaalsContact CE3-CE 3.5Å; W661-K665 HydrophobicContact CE3-CG 4.24Å; W661-K665 VanDerWaalsContact O-CB 3.25Å; W661-K665 WeakPolarHBondContact O-CB 3.26Å; W661-K665 WeakPolarHBondContact O-CG 3.34Å; W661-K665 PolarHBondContact O-N 3.26Å
662	A	97.8	Very high	96.6	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-56.5	-55.8	175	0	0	0	0	0	111.2	A537 C540 L541 N658 L659 M660 L664 K665 W666	A537-A662 WeakPolarHBondContact CB-O 3.37Å; A537-A662 WeakPolarHBondContact O-CA 3.32Å; A537-A662 VanDerWaalsContact O-CB 3.3Å; A537-A662 WeakPolarHBondContact O-CB 3.42Å; C540-A662 HydrophobicContact CB-CB 3.9Å; L541-A662 HydrophobicContact CB-CB 3.91Å; N658-A662 PolarHBondContact O-N 3.05Å; L659-A662 WeakPolarHBondContact O-CB 3.34Å; L659-A662 PolarHBondContact O-N 3.26Å; M660-A662 VanDerWaalsContact C-N 3.33Å; M660-A662 PolarHBondContact O-N 3.45Å; A662-L664 PolarHBondContact O-N 2.87Å; A662-K665 PolarHBondContact O-N 3.15Å; A662-W666 WeakPolarHBondContact O-CB 3.31Å; A662-W666 PolarHBondContact O-N 3.09Å
663	H	97.8	Very high	96.5	Very high	60 Å²	60	61.2 Å²	61.2	28%	0.278	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-41.4	177	-71.1	-73.7	0	0	0	112.7	L659 W666 N667 I693	L659-H663 PolarHBondContact O-CD2 2.94Å; L659-H663 PolarHBondContact O-N 2.95Å; H663-W666 PolarHBondContact O-N 3.37Å; H663-N667 WeakPolarHBondContact O-CB 3.25Å; H663-N667 PolarHBondContact O-N 3.11Å; H663-N667 PolarHBondContact O-ND2 2.88Å; H663-I693 HydrophobicContact CB-CD1 4.46Å; H663-I693 WeakPolarHBondContact ND1-CD1 3.18Å
664	L	97.8	Very high	96.3	Very high	75 Å²	75	59.2 Å²	59.2	39%	0.393	30%	0.295	S	S	.	.	H	α-helix	trans	-66.2	-44.2	179.9	-179	54.9	0	0	0	112.2	M660 W661 A662 L668	M660-L664 WeakPolarHBondContact O-CB 3.49Å; M660-L664 PolarHBondContact O-N 3.15Å; W661-L664 HydrophobicContact CE3-CB 4.37Å; W661-L664 HydrophobicContact CE3-CD2 3.76Å; W661-L664 HydrophobicContact CE3-CG 4.23Å; W661-L664 HydrophobicContact CH2-CD2 4.28Å; W661-L664 HydrophobicContact CZ3-CD2 3.57Å; W661-L664 HydrophobicContact CZ3-CG 4.25Å; W661-L664 PolarHBondContact O-N 3.37Å; A662-L664 PolarHBondContact O-N 2.87Å; L664-L668 HydrophobicContact CD1-CD1 4.13Å; L664-L668 HydrophobicContact CD1-CG 4.29Å; L664-L668 HydrophobicContact CG-CD1 4.1Å; L664-L668 WeakPolarHBondContact O-CB 3.38Å; L664-L668 WeakPolarHBondContact O-CG 3.49Å; L664-L668 PolarHBondContact O-N 2.83Å
665	K	97.5	Very high	96.1	Very high	40 Å²	40	64.7 Å²	64.7	17%	0.174	31%	0.312	C	S	.	.	H	α-helix	trans	-67	-37.7	176.4	-65.3	-73.9	177.7	168.1	0	111.4	L533 Q536 A537 W661 A662 L668 S669	L533-K665 HydrophobicContact CD2-CD 3.75Å; Q536-K665 HydrophobicContact CB-CB 4.37Å; Q536-K665 HydrophobicContact CB-CD 4.18Å; Q536-K665 HydrophobicContact CB-CG 4.16Å; A537-K665 HydrophobicContact CB-CB 3.85Å; W661-K665 HydrophobicContact CE3-CD 4.36Å; W661-K665 VanDerWaalsContact CE3-CE 3.5Å; W661-K665 HydrophobicContact CE3-CG 4.24Å; W661-K665 VanDerWaalsContact O-CB 3.25Å; W661-K665 WeakPolarHBondContact O-CB 3.26Å; W661-K665 WeakPolarHBondContact O-CG 3.34Å; W661-K665 PolarHBondContact O-N 3.26Å; A662-K665 PolarHBondContact O-N 3.15Å; K665-L668 PolarHBondContact O-N 3.21Å; K665-S669 PolarHBondContact O-N 2.56Å
666	W	98.1	Very high	95.7	Very high	29 Å²	29	68.7 Å²	68.7	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-61.6	-52.9	174.8	-170.6	-96.3	0	0	0	111.4	R534 A537 L538 A662 H663 L668 S669 V670 L691 I693	R534-W666 HydrophobicContact CB-CZ3 4.42Å; R534-W666 HydrophobicContact CG-CH2 4.48Å; R534-W666 HydrophobicContact CG-CZ3 4.15Å; A537-W666 HydrophobicContact CB-CB 3.95Å; A537-W666 HydrophobicContact CB-CE3 3.94Å; L538-W666 HydrophobicContact CD1-CZ3 4.02Å; L538-W666 HydrophobicContact CG-CZ3 4.43Å; A662-W666 WeakPolarHBondContact O-CB 3.31Å; A662-W666 PolarHBondContact O-N 3.09Å; H663-W666 PolarHBondContact O-N 3.37Å; W666-L668 VanDerWaalsContact C-N 3.29Å; W666-L668 PolarHBondContact O-N 3Å; W666-S669 WeakPolarHBondContact O-CA 3.31Å; W666-S669 WeakPolarHBondContact O-CB 3.46Å; W666-S669 PolarHBondContact O-N 3.19Å; W666-S669 PolarHBondContact O-OG 3.33Å; W666-V670 PolarHBondContact O-N 2.74Å; W666-V670 VanDerWaalsContact O-N 3.1Å; W666-L691 HydrophobicContact CH2-CB 4.39Å; W666-L691 HydrophobicContact CH2-CD2 4.47Å; W666-L691 HydrophobicContact CH2-CG 4.27Å; W666-L691 WeakPolarHBondContact CH2-O 3.39Å; W666-L691 HydrophobicContact CZ3-CD2 4.41Å; W666-I693 HydrophobicContact CB-CD1 3.63Å; W666-I693 HydrophobicContact CB-CG1 3.97Å; W666-I693 HydrophobicContact CD2-CB 3.65Å; W666-I693 HydrophobicContact CD2-CD1 4.46Å; W666-I693 HydrophobicContact CD2-CG1 3.94Å; W666-I693 HydrophobicContact CE3-CB 4.02Å; W666-I693 HydrophobicContact CE3-CG1 4.12Å; W666-I693 HydrophobicContact CG-CB 3.83Å; W666-I693 HydrophobicContact CG-CD1 3.82Å; W666-I693 HydrophobicContact CG-CG1 3.83Å
667	N	97.7	Very high	95.5	Very high	86 Å²	86	65.2 Å²	65.2	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-35.5	179.2	-69.9	-18.3	0	0	0	112.2	H663 V670 K671	H663-N667 WeakPolarHBondContact O-CB 3.25Å; H663-N667 PolarHBondContact O-N 3.11Å; H663-N667 PolarHBondContact O-ND2 2.88Å; N667-V670 PolarHBondContact O-N 3.4Å; N667-K671 WeakPolarHBondContact O-CB 3.38Å; N667-K671 WeakPolarHBondContact O-CG 3.43Å; N667-K671 PolarHBondContact O-N 3.49Å
668	L	97.1	Very high	95.4	Very high	67 Å²	67	65.6 Å²	65.6	35%	0.351	32%	0.315	S	S	.	.	H	α-helix	trans	-65.8	-38.7	170.9	-74.5	168.5	0	0	0	112.2	L533 L664 K665 W666 V670 K671 K672	L533-L668 HydrophobicContact CD1-CB 4.2Å; L664-L668 HydrophobicContact CD1-CD1 4.13Å; L664-L668 HydrophobicContact CD1-CG 4.29Å; L664-L668 HydrophobicContact CG-CD1 4.1Å; L664-L668 WeakPolarHBondContact O-CB 3.38Å; L664-L668 WeakPolarHBondContact O-CG 3.49Å; L664-L668 PolarHBondContact O-N 2.83Å; K665-L668 PolarHBondContact O-N 3.21Å; W666-L668 VanDerWaalsContact C-N 3.29Å; W666-L668 PolarHBondContact O-N 3Å; L668-V670 VanDerWaalsContact C-N 3.32Å; L668-V670 PolarHBondContact O-N 2.92Å; L668-K671 PolarHBondContact O-N 2.87Å; L668-K672 VanDerWaalsContact O-CB 3.28Å; L668-K672 WeakPolarHBondContact O-CB 3.4Å; L668-K672 WeakPolarHBondContact O-CG 3.35Å; L668-K672 PolarHBondContact O-N 3.39Å
669	S	96.7	Very high	95.2	Very high	1 Å²	1	69 Å²	69	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-40.1	176.7	82.9	0	0	0	0	111.9	K665 W666 K672 M673	K665-S669 PolarHBondContact O-N 2.56Å; W666-S669 WeakPolarHBondContact O-CA 3.31Å; W666-S669 WeakPolarHBondContact O-CB 3.46Å; W666-S669 PolarHBondContact O-N 3.19Å; W666-S669 PolarHBondContact O-OG 3.33Å; S669-K672 PolarHBondContact O-N 3.46Å; S669-M673 PolarHBondContact O-N 3.24Å
670	V	95.4	Very high	95.2	Very high	89 Å²	89	67.7 Å²	67.7	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-67.9	-48.6	175.1	179.4	0	0	0	0	110.5	W666 N667 L668 K672 M673	W666-V670 PolarHBondContact O-N 2.74Å; W666-V670 VanDerWaalsContact O-N 3.1Å; N667-V670 PolarHBondContact O-N 3.4Å; L668-V670 VanDerWaalsContact C-N 3.32Å; L668-V670 PolarHBondContact O-N 2.92Å; V670-K672 PolarHBondContact O-N 2.93Å; V670-M673 PolarHBondContact O-N 3.34Å
671	K	95.8	Very high	95.2	Very high	148 Å²	148	64 Å²	64	64%	0.643	31%	0.305	S	S	*	.	H	α-helix	trans	-66.5	-15.7	178	-71.6	-171.6	177.3	-168.5	0	114.2	I246 N667 L668	I246-K671 PolarHBondContact O-NZ 3.05Å; N667-K671 WeakPolarHBondContact O-CB 3.38Å; N667-K671 WeakPolarHBondContact O-CG 3.43Å; N667-K671 PolarHBondContact O-N 3.49Å; L668-K671 PolarHBondContact O-N 2.87Å
672	K	94	Very high	95.1	Very high	86 Å²	86	62.7 Å²	62.7	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-96.3	-11.5	175.6	-77.3	-54.5	-163.9	83.8	0	114.7	E529 V530 L533 L668 S669 V670 T674	E529-K672 IonicContact OE1-NZ 3.98Å; E529-K672 PolarHBondContact OE1-NZ 2.95Å; E529-K672 IonicContact OE2-NZ 2.79Å; E529-K672 PolarHBondContact OE2-NZ 3.09Å; V530-K672 HydrophobicContact CG2-CB 4.14Å; L533-K672 HydrophobicContact CD1-CB 4.4Å; L533-K672 HydrophobicContact CD1-CG 4.19Å; L668-K672 VanDerWaalsContact O-CB 3.28Å; L668-K672 WeakPolarHBondContact O-CB 3.4Å; L668-K672 WeakPolarHBondContact O-CG 3.35Å; L668-K672 PolarHBondContact O-N 3.39Å; S669-K672 PolarHBondContact O-N 3.46Å; V670-K672 PolarHBondContact O-N 2.93Å; K672-T674 PolarHBondContact O-N 3.12Å
673	M	93.7	Very high	95	Very high	60 Å²	60	65 Å²	65	30%	0.296	32%	0.323	S	S	.	.			trans	-73.5	118.6	177.5	-159.6	170.7	87.1	0	0	109.8	V530 S669 V670 D677 E678 F681	V530-M673 HydrophobicContact CG2-CB 4.08Å; V530-M673 HydrophobicContact CG2-CG 4.45Å; S669-M673 PolarHBondContact O-N 3.24Å; V670-M673 PolarHBondContact O-N 3.34Å; M673-D677 HydrophobicContact CG-CB 3.97Å; M673-E678 HydrophobicContact CE-CG 4.02Å; M673-F681 HydrophobicContact CG-CD2 3.68Å; M673-F681 HydrophobicContact CG-CE2 4.11Å; M673-F681 HydrophobicContact SD-CB 3.79Å; M673-F681 HydrophobicContact SD-CD2 3.45Å; M673-F681 WeakPolarHBondContact SD-CD2 3.29Å; M673-F681 HydrophobicContact SD-CE2 4.25Å; M673-F681 HydrophobicContact SD-CG 3.72Å
674	T	91.6	Very high	95	Very high	60 Å²	60	62.2 Å²	62.2	37%	0.368	31%	0.31	S	S	.	.			trans	-89.8	164.9	178.2	75.6	0	0	0	0	111.2	K672 E676 D677 E678	K672-T674 PolarHBondContact O-N 3.12Å; T674-E676 PolarHBondContact O-N 2.95Å; T674-E676 VanDerWaalsContact O-N 3.14Å; T674-E676 PolarHBondContact OG1-N 2.9Å; T674-D677 VanDerWaalsContact CB-OD2 3.32Å; T674-D677 WeakPolarHBondContact CB-OD2 3.47Å; T674-D677 WeakPolarHBondContact CG2-OD2 3.49Å; T674-D677 PolarHBondContact N-OD2 3.48Å; T674-D677 WeakPolarHBondContact O-CA 3.28Å; T674-D677 WeakPolarHBondContact O-CB 3.23Å; T674-D677 PolarHBondContact O-N 3.31Å; T674-D677 VanDerWaalsContact OG1-CG 3.25Å; T674-D677 PolarHBondContact OG1-N 3.1Å; T674-D677 PolarHBondContact OG1-OD2 2.85Å; T674-E678 PolarHBondContact O-N 3.32Å; T674-E678 VanDerWaalsContact O-N 3.11Å
675	K	90.2	Very high	94.9	Very high	171 Å²	171	60.1 Å²	60.1	74%	0.743	30%	0.299	S	S	*	.	H	α-helix	trans	-59.6	-23.6	174.2	-60.6	-166.2	172.1	-171	0	113.7	D677	K675-D677 VanDerWaalsContact C-N 3.31Å
676	E	87.6	Confident	94.8	Very high	95 Å²	95	62.6 Å²	62.6	44%	0.444	32%	0.322	S	S	.	.	H	α-helix	trans	-82.4	-10.6	174.8	-56.3	-177.2	174.3	0	0	112.8	M413 K527 T674	M413-E676 WeakPolarHBondContact CE-OE2 3.23Å; K527-E676 PolarHBondContact NZ-O 3.36Å; T674-E676 PolarHBondContact O-N 2.95Å; T674-E676 VanDerWaalsContact O-N 3.14Å; T674-E676 PolarHBondContact OG1-N 2.9Å
677	D	92.7	Very high	94.7	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-98.7	-24.5	173.6	-51.9	-55.4	0	0	0	112.2	S526 K527 M673 T674 K675 Q679 F680 F681	S526-D677 WeakPolarHBondContact CB-OD1 3.07Å; S526-D677 VanDerWaalsContact CB-OD2 3.29Å; S526-D677 WeakPolarHBondContact CB-OD2 3.46Å; S526-D677 PolarHBondContact OG-OD1 3.09Å; S526-D677 PolarHBondContact OG-OD2 3.21Å; K527-D677 HydrophobicContact CG-CB 4.45Å; K527-D677 WeakPolarHBondContact CG-OD1 3.37Å; K527-D677 IonicContact NZ-OD1 3.67Å; K527-D677 PolarHBondContact NZ-OD1 3.48Å; M673-D677 HydrophobicContact CG-CB 3.97Å; T674-D677 VanDerWaalsContact CB-OD2 3.32Å; T674-D677 WeakPolarHBondContact CB-OD2 3.47Å; T674-D677 WeakPolarHBondContact CG2-OD2 3.49Å; T674-D677 PolarHBondContact N-OD2 3.48Å; T674-D677 WeakPolarHBondContact O-CA 3.28Å; T674-D677 WeakPolarHBondContact O-CB 3.23Å; T674-D677 PolarHBondContact O-N 3.31Å; T674-D677 VanDerWaalsContact OG1-CG 3.25Å; T674-D677 PolarHBondContact OG1-N 3.1Å; T674-D677 PolarHBondContact OG1-OD2 2.85Å; K675-D677 VanDerWaalsContact C-N 3.31Å; D677-Q679 PolarHBondContact O-N 3.1Å; D677-F680 WeakPolarHBondContact O-CB 3.41Å; D677-F680 PolarHBondContact O-N 3.39Å; D677-F681 HydrophobicContact CB-CD2 3.82Å; D677-F681 HydrophobicContact CB-CE2 3.88Å; D677-F681 WeakPolarHBondContact O-CD2 3.36Å; D677-F681 PolarHBondContact O-N 3.2Å
678	E	93.3	Very high	94.5	Very high	93 Å²	93	59.2 Å²	59.2	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-49.4	-43.4	178.1	-76.2	171.3	-160.2	0	0	112.3	M673 T674 F680 F681 A682	M673-E678 HydrophobicContact CE-CG 4.02Å; T674-E678 PolarHBondContact O-N 3.32Å; T674-E678 VanDerWaalsContact O-N 3.11Å; E678-F680 VanDerWaalsContact C-N 3.35Å; E678-F680 PolarHBondContact O-N 2.97Å; E678-F681 PolarHBondContact O-N 2.84Å; E678-A682 WeakPolarHBondContact O-CB 3.37Å; E678-A682 PolarHBondContact O-N 3.4Å
679	Q	93.6	Very high	94.2	Very high	95 Å²	95	60.3 Å²	60.3	44%	0.444	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-36	178.1	-64.1	177.7	-4.2	0	0	113.2	S417 L421 D677 H683	S417-Q679 PolarHBondContact OG-OE1 2.86Å; L421-Q679 HydrophobicContact CD1-CB 4.43Å; L421-Q679 HydrophobicContact CD2-CB 4.46Å; D677-Q679 PolarHBondContact O-N 3.1Å; Q679-H683 WeakPolarHBondContact O-CB 3.31Å; Q679-H683 PolarHBondContact O-N 2.85Å
680	F	96.2	Very high	94.1	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.009	34%	0.335	C	S	.	.	H	α-helix	trans	-74	-44.8	177.8	168.1	-101.4	0	0	0	111.1	L420 K527 L531 D677 E678 H683 L684 A707 W710 L711	L420-F680 HydrophobicContact CD2-CB 4.29Å; L420-F680 HydrophobicContact CD2-CD2 3.67Å; L420-F680 HydrophobicContact CD2-CE2 4.35Å; L420-F680 HydrophobicContact CD2-CG 4.25Å; L420-F680 HydrophobicContact CG-CD2 4.28Å; K527-F680 HydrophobicContact CB-CD1 4.21Å; K527-F680 HydrophobicContact CB-CE1 4Å; K527-F680 HydrophobicContact CD-CB 4.27Å; K527-F680 HydrophobicContact CD-CD1 3.92Å; K527-F680 HydrophobicContact CD-CD2 4.36Å; K527-F680 HydrophobicContact CD-CE1 4.32Å; K527-F680 HydrophobicContact CD-CG 3.94Å; K527-F680 HydrophobicContact CG-CD1 3.88Å; K527-F680 HydrophobicContact CG-CE1 4.18Å; K527-F680 HydrophobicContact CG-CG 4.39Å; L531-F680 HydrophobicContact CD1-CE1 4.2Å; L531-F680 HydrophobicContact CD1-CZ 4.3Å; D677-F680 WeakPolarHBondContact O-CB 3.41Å; D677-F680 PolarHBondContact O-N 3.39Å; E678-F680 VanDerWaalsContact C-N 3.35Å; E678-F680 PolarHBondContact O-N 2.97Å; F680-H683 PolarHBondContact O-N 3.47Å; F680-L684 HydrophobicContact CD1-CD1 4.16Å; F680-L684 HydrophobicContact CE1-CD1 3.6Å; F680-L684 HydrophobicContact CE2-CD1 4.22Å; F680-L684 HydrophobicContact CZ-CD1 3.64Å; F680-L684 PolarHBondContact O-N 3.03Å; F680-L684 VanDerWaalsContact O-N 3.1Å; F680-A707 HydrophobicContact CZ-CB 4.42Å; F680-W710 HydrophobicContact CD2-CD2 4.09Å; F680-W710 AromaticContact CD2-CE3 3.64Å; F680-W710 HydrophobicContact CD2-CE3 3.64Å; F680-W710 AromaticContact CD2-CH2 3.57Å; F680-W710 HydrophobicContact CD2-CH2 3.57Å; F680-W710 HydrophobicContact CD2-CZ2 4Å; F680-W710 AromaticContact CD2-CZ3 3.37Å; F680-W710 HydrophobicContact CD2-CZ3 3.37Å; F680-W710 AromaticContact CE2-CD2 3.8Å; F680-W710 HydrophobicContact CE2-CD2 3.8Å; F680-W710 AromaticContact CE2-CE3 3.42Å; F680-W710 HydrophobicContact CE2-CE3 3.42Å; F680-W710 VanDerWaalsContact CE2-CE3 3.42Å; F680-W710 HydrophobicContact CE2-CG 4.5Å; F680-W710 HydrophobicContact CE2-CH2 4.24Å; F680-W710 AromaticContact CE2-CZ3 3.68Å; F680-W710 HydrophobicContact CE2-CZ3 3.68Å; F680-W710 HydrophobicContact CG-CH2 4.41Å; F680-W710 HydrophobicContact CG-CZ3 4.25Å; F680-W710 HydrophobicContact CZ-CE3 4.43Å; F680-L711 HydrophobicContact CE2-CD2 3.78Å; F680-L711 HydrophobicContact CE2-CG 4.12Å; F680-L711 HydrophobicContact CZ-CD1 4.08Å; F680-L711 HydrophobicContact CZ-CD2 3.85Å; F680-L711 HydrophobicContact CZ-CG 3.91Å
681	F	96.8	Very high	94.1	Very high	1 Å²	1	59.4 Å²	59.4	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-71.6	-41.8	179.7	-74.2	-67.5	0	0	0	112.5	V530 L531 M673 D677 E678 H683 L684 D685 F703	V530-F681 HydrophobicContact CB-CE2 3.83Å; V530-F681 HydrophobicContact CB-CZ 3.6Å; V530-F681 HydrophobicContact CG1-CD2 4.44Å; V530-F681 HydrophobicContact CG1-CE1 3.96Å; V530-F681 HydrophobicContact CG1-CE2 3.7Å; V530-F681 HydrophobicContact CG1-CZ 3.43Å; V530-F681 VanDerWaalsContact CG1-CZ 3.43Å; V530-F681 HydrophobicContact CG2-CE2 4.29Å; L531-F681 HydrophobicContact CD2-CE1 3.84Å; L531-F681 HydrophobicContact CD2-CZ 4.41Å; L531-F681 HydrophobicContact CG-CE1 4.02Å; L531-F681 HydrophobicContact CG-CZ 4.08Å; M673-F681 HydrophobicContact CG-CD2 3.68Å; M673-F681 HydrophobicContact CG-CE2 4.11Å; M673-F681 HydrophobicContact SD-CB 3.79Å; M673-F681 HydrophobicContact SD-CD2 3.45Å; M673-F681 WeakPolarHBondContact SD-CD2 3.29Å; M673-F681 HydrophobicContact SD-CE2 4.25Å; M673-F681 HydrophobicContact SD-CG 3.72Å; D677-F681 HydrophobicContact CB-CD2 3.82Å; D677-F681 HydrophobicContact CB-CE2 3.88Å; D677-F681 WeakPolarHBondContact O-CD2 3.36Å; D677-F681 PolarHBondContact O-N 3.2Å; E678-F681 PolarHBondContact O-N 2.84Å; F681-H683 VanDerWaalsContact C-N 3.27Å; F681-H683 PolarHBondContact O-N 3.43Å; F681-L684 HydrophobicContact CD1-CD1 4.16Å; F681-L684 HydrophobicContact CE1-CD1 4.35Å; F681-L684 WeakPolarHBondContact O-CB 3.46Å; F681-L684 PolarHBondContact O-N 2.91Å; F681-L684 VanDerWaalsContact O-N 3.11Å; F681-D685 WeakPolarHBondContact O-CB 3.37Å; F681-D685 PolarHBondContact O-N 3.2Å; F681-D685 VanDerWaalsContact O-OD2 3.13Å; F681-F703 HydrophobicContact CD1-CZ 4.19Å
682	A	95.6	Very high	94.1	Very high	58 Å²	58	57.4 Å²	57.4	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-34.4	174.4	0	0	0	0	0	112.6	E678 S686	E678-A682 WeakPolarHBondContact O-CB 3.37Å; E678-A682 PolarHBondContact O-N 3.4Å; A682-S686 WeakPolarHBondContact O-CB 3.23Å; A682-S686 PolarHBondContact O-N 2.83Å; A682-S686 PolarHBondContact O-OG 2.74Å; A682-S686 VanDerWaalsContact O-OG 3.13Å
683	H	96.5	Very high	94.2	Very high	50 Å²	50	54.6 Å²	54.6	23%	0.231	29%	0.293	C	S	.	.	H	α-helix	trans	-67	-46.1	172.2	-168.5	91.6	0	0	0	111.4	P425 Q679 F680 F681 S686 V687 W710	P425-H683 PolarHBondContact O-NE2 3.29Å; Q679-H683 WeakPolarHBondContact O-CB 3.31Å; Q679-H683 PolarHBondContact O-N 2.85Å; F680-H683 PolarHBondContact O-N 3.47Å; F681-H683 VanDerWaalsContact C-N 3.27Å; F681-H683 PolarHBondContact O-N 3.43Å; H683-S686 PolarHBondContact O-N 3.45Å; H683-S686 PolarHBondContact O-OG 3.36Å; H683-V687 WeakPolarHBondContact NE2-CG2 3.23Å; H683-V687 WeakPolarHBondContact O-CB 3.21Å; H683-V687 WeakPolarHBondContact O-CG2 3.42Å; H683-V687 PolarHBondContact O-N 2.83Å; H683-V687 VanDerWaalsContact O-N 3.1Å; H683-W710 HydrophobicContact CB-CH2 3.76Å; H683-W710 HydrophobicContact CB-CZ3 3.94Å; H683-W710 AromaticContact CD2-CH2 3.9Å; H683-W710 AromaticContact CD2-CZ3 3.76Å; H683-W710 AromaticContact CG-CH2 3.89Å
684	L	96.7	Very high	94.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-47.9	174.3	-74.5	172.2	0	0	0	112.4	F680 F681 S686 V687 C688 F703 T706 A707 W710	F680-L684 HydrophobicContact CD1-CD1 4.16Å; F680-L684 HydrophobicContact CE1-CD1 3.6Å; F680-L684 HydrophobicContact CE2-CD1 4.22Å; F680-L684 HydrophobicContact CZ-CD1 3.64Å; F680-L684 PolarHBondContact O-N 3.03Å; F680-L684 VanDerWaalsContact O-N 3.1Å; F681-L684 HydrophobicContact CD1-CD1 4.16Å; F681-L684 HydrophobicContact CE1-CD1 4.35Å; F681-L684 WeakPolarHBondContact O-CB 3.46Å; F681-L684 PolarHBondContact O-N 2.91Å; F681-L684 VanDerWaalsContact O-N 3.11Å; L684-S686 VanDerWaalsContact C-N 3.26Å; L684-S686 PolarHBondContact O-N 3.15Å; L684-V687 PolarHBondContact O-N 2.72Å; L684-V687 VanDerWaalsContact O-N 3.08Å; L684-C688 WeakPolarHBondContact O-CB 3.38Å; L684-C688 PolarHBondContact O-N 2.85Å; L684-F703 HydrophobicContact CB-CD2 4.42Å; L684-F703 HydrophobicContact CB-CE1 4.47Å; L684-F703 HydrophobicContact CB-CE2 3.62Å; L684-F703 HydrophobicContact CB-CZ 3.64Å; L684-F703 HydrophobicContact CD1-CE1 4Å; L684-F703 HydrophobicContact CD1-CZ 3.86Å; L684-F703 HydrophobicContact CG-CZ 4.37Å; L684-T706 HydrophobicContact CD2-CG2 4.2Å; L684-A707 HydrophobicContact CD1-CB 3.63Å; L684-A707 HydrophobicContact CD2-CB 3.93Å; L684-A707 HydrophobicContact CG-CB 4.46Å; L684-W710 HydrophobicContact CD2-CE3 3.89Å; L684-W710 HydrophobicContact CD2-CZ3 4.24Å; L684-W710 HydrophobicContact CG-CE3 4.07Å; L684-W710 HydrophobicContact CG-CZ3 3.98Å
685	D	96.6	Very high	94.5	Very high	31 Å²	31	54.9 Å²	54.9	17%	0.166	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-34.7	-179.6	-67.3	-34.1	0	0	0	110.7	R534 F681 V689 P690 L691 F703	R534-D685 IonicContact NH1-OD1 2.69Å; R534-D685 PolarHBondContact NH1-OD1 3.27Å; F681-D685 WeakPolarHBondContact O-CB 3.37Å; F681-D685 PolarHBondContact O-N 3.2Å; F681-D685 VanDerWaalsContact O-OD2 3.13Å; D685-V689 CarbonylContact O-C 3.12Å; D685-V689 VanDerWaalsContact O-CA 3.28Å; D685-V689 WeakPolarHBondContact O-CA 3.27Å; D685-V689 PolarHBondContact O-N 3.02Å; D685-P690 HydrophobicContact CB-CB 3.92Å; D685-P690 HydrophobicContact CB-CG 4.04Å; D685-P690 WeakPolarHBondContact O-CD 3.3Å; D685-P690 WeakPolarHBondContact OD1-CA 3.45Å; D685-L691 PolarHBondContact OD1-N 3.38Å; D685-F703 WeakPolarHBondContact OD1-CE2 3.3Å
686	S	95.8	Very high	94.7	Very high	93 Å²	93	49.2 Å²	49.2	65%	0.65	28%	0.281	S	S	*	.	H	α-helix	trans	-77	-21.9	174.5	67.4	0	0	0	0	114.9	A682 H683 L684	A682-S686 WeakPolarHBondContact O-CB 3.23Å; A682-S686 PolarHBondContact O-N 2.83Å; A682-S686 PolarHBondContact O-OG 2.74Å; A682-S686 VanDerWaalsContact O-OG 3.13Å; H683-S686 PolarHBondContact O-N 3.45Å; H683-S686 PolarHBondContact O-OG 3.36Å; L684-S686 VanDerWaalsContact C-N 3.26Å; L684-S686 PolarHBondContact O-N 3.15Å
687	V	96	Very high	95	Very high	32 Å²	32	45.2 Å²	45.2	19%	0.194	26%	0.263	C	S	.	.	H	α-helix	trans	-94.6	-32	-179.5	170	0	0	0	0	112.7	A428 H683 L684 T706	A428-V687 HydrophobicContact CB-CG1 4.28Å; A428-V687 VanDerWaalsContact N-CG1 3.26Å; H683-V687 WeakPolarHBondContact NE2-CG2 3.23Å; H683-V687 WeakPolarHBondContact O-CB 3.21Å; H683-V687 WeakPolarHBondContact O-CG2 3.42Å; H683-V687 PolarHBondContact O-N 2.83Å; H683-V687 VanDerWaalsContact O-N 3.1Å; L684-V687 PolarHBondContact O-N 2.72Å; L684-V687 VanDerWaalsContact O-N 3.08Å; V687-T706 HydrophobicContact CG1-CG2 4.42Å
688	C	93.1	Very high	95	Very high	12 Å²	12	47.1 Å²	47.1	8%	0.081	28%	0.276	C	S	.	.	H	α-helix	trans	-116.3	2.2	-170.3	-66.1	0	0	0	0	115	L684 F703 T706	L684-C688 WeakPolarHBondContact O-CB 3.38Å; L684-C688 PolarHBondContact O-N 2.85Å; C688-F703 HydrophobicContact CB-CB 4.28Å; C688-F703 HydrophobicContact CB-CD2 3.86Å; C688-F703 HydrophobicContact CB-CG 4.48Å; C688-T706 VanDerWaalsContact SG-CB 3.58Å; C688-T706 PolarHBondContact SG-OG1 2.96Å
689	V	91.4	Very high	95.1	Very high	89 Å²	89	45.9 Å²	45.9	54%	0.539	27%	0.27	S	S	.	.			trans	73.5	139.8	-159.3	-172.7	0	0	0	0	111.2	D685 L691	D685-V689 CarbonylContact O-C 3.12Å; D685-V689 VanDerWaalsContact O-CA 3.28Å; D685-V689 WeakPolarHBondContact O-CA 3.27Å; D685-V689 PolarHBondContact O-N 3.02Å; V689-L691 PolarHBondContact O-N 3.46Å
690	P	94.1	Very high	95.3	Very high	62 Å²	62	41.4 Å²	41.4	40%	0.403	25%	0.249	S	C	.	.			trans	-62.3	129.6	177.6	-20.3	31.3	0	0	0	111.8	D685	D685-P690 HydrophobicContact CB-CB 3.92Å; D685-P690 HydrophobicContact CB-CG 4.04Å; D685-P690 WeakPolarHBondContact O-CD 3.3Å; D685-P690 WeakPolarHBondContact OD1-CA 3.45Å
691	L	95.7	Very high	95.3	Very high	9 Å²	9	41.3 Å²	41.3	5%	0.047	25%	0.249	C	C	.	.			trans	-76.1	134.9	-179.5	-159	72.3	0	0	0	111	R534 L538 W666 D685 V689 E699 L700 F703	R534-L691 HydrophobicContact CB-CD2 4.21Å; L538-L691 HydrophobicContact CD1-CD1 4.24Å; L538-L691 HydrophobicContact CD1-CD2 3.62Å; L538-L691 HydrophobicContact CD1-CG 3.95Å; W666-L691 HydrophobicContact CH2-CB 4.39Å; W666-L691 HydrophobicContact CH2-CD2 4.47Å; W666-L691 HydrophobicContact CH2-CG 4.27Å; W666-L691 WeakPolarHBondContact CH2-O 3.39Å; W666-L691 HydrophobicContact CZ3-CD2 4.41Å; D685-L691 PolarHBondContact OD1-N 3.38Å; V689-L691 PolarHBondContact O-N 3.46Å; L691-E699 HydrophobicContact CD1-CB 4.31Å; L691-L700 HydrophobicContact CD1-CB 4.5Å; L691-L700 HydrophobicContact CD2-CD1 4.12Å; L691-F703 HydrophobicContact CB-CD2 4.2Å; L691-F703 HydrophobicContact CB-CE2 4.28Å; L691-F703 HydrophobicContact CB-CG 4.44Å; L691-F703 HydrophobicContact CD1-CB 4.4Å; L691-F703 HydrophobicContact CD2-CD1 4.29Å
692	H	95.7	Very high	95.3	Very high	106 Å²	106	42.5 Å²	42.5	49%	0.491	26%	0.256	S	S	.	.			trans	-119.9	163.2	176.8	-64	-18.7	0	0	0	110.8	T694 S695	H692-T694 PolarHBondContact O-N 2.92Å; H692-S695 PolarHBondContact N-OG 3.03Å; H692-S695 WeakPolarHBondContact O-CB 3.37Å; H692-S695 PolarHBondContact O-N 2.82Å; H692-S695 PolarHBondContact O-OG 3.49Å
693	I	96	Very high	95.4	Very high	27 Å²	27	39.8 Å²	39.8	14%	0.138	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.3	177.7	-162.4	178.2	0	0	0	112.2	L538 L541 H663 W666	L538-I693 WeakPolarHBondContact CD2-O 3.27Å; L541-I693 WeakPolarHBondContact CD2-O 3.47Å; H663-I693 HydrophobicContact CB-CD1 4.46Å; H663-I693 WeakPolarHBondContact ND1-CD1 3.18Å; W666-I693 HydrophobicContact CB-CD1 3.63Å; W666-I693 HydrophobicContact CB-CG1 3.97Å; W666-I693 HydrophobicContact CD2-CB 3.65Å; W666-I693 HydrophobicContact CD2-CD1 4.46Å; W666-I693 HydrophobicContact CD2-CG1 3.94Å; W666-I693 HydrophobicContact CE3-CB 4.02Å; W666-I693 HydrophobicContact CE3-CG1 4.12Å; W666-I693 HydrophobicContact CG-CB 3.83Å; W666-I693 HydrophobicContact CG-CD1 3.82Å; W666-I693 HydrophobicContact CG-CG1 3.83Å
694	T	94.7	Very high	95.4	Very high	113 Å²	113	37.5 Å²	37.5	69%	0.693	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	11.1	175.7	57.8	0	0	0	0	113.2	H692	H692-T694 PolarHBondContact O-N 2.92Å
695	S	96.1	Very high	95.5	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.091	22%	0.224	C	C	.	.			trans	-66.1	145.4	175.7	-75.4	0	0	0	0	111	L538 H692	L538-S695 VanDerWaalsContact CD2-O 3.28Å; L538-S695 WeakPolarHBondContact CD2-O 3.31Å; H692-S695 PolarHBondContact N-OG 3.03Å; H692-S695 WeakPolarHBondContact O-CB 3.37Å; H692-S695 PolarHBondContact O-N 2.82Å; H692-S695 PolarHBondContact O-OG 3.49Å
696	S	94.3	Very high	95.5	Very high	52 Å²	52	36.5 Å²	36.5	36%	0.364	22%	0.218	S	C	.	.			trans	-64.2	158.9	176.5	69.2	0	0	0	0	112.3	S698 E699 L700	S696-S698 PolarHBondContact O-N 2.74Å; S696-S698 VanDerWaalsContact O-N 3.17Å; S696-S698 PolarHBondContact OG-N 3.37Å; S696-E699 VanDerWaalsContact CB-OE2 3.24Å; S696-E699 WeakPolarHBondContact CB-OE2 3.44Å; S696-E699 PolarHBondContact N-OE2 3.1Å; S696-E699 PolarHBondContact O-N 3.42Å; S696-E699 WeakPolarHBondContact OG-CG 3.39Å; S696-E699 PolarHBondContact OG-N 3.01Å; S696-E699 PolarHBondContact OG-OE2 3.47Å; S696-L700 PolarHBondContact O-N 3.06Å
697	I	94.5	Very high	95.6	Very high	12 Å²	12	32 Å²	32	6%	0.062	19%	0.187	C	C	.	.	H	α-helix	trans	-57.6	-27.3	168.8	-61.6	-61.1	0	0	0	111.6	V474 Y478 K542 L700 C701	V474-I697 HydrophobicContact CG1-CD1 4.29Å; V474-I697 HydrophobicContact CG1-CG2 3.62Å; Y478-I697 HydrophobicContact CD2-CB 4.01Å; Y478-I697 HydrophobicContact CD2-CG1 4.37Å; Y478-I697 HydrophobicContact CD2-CG2 4.14Å; Y478-I697 HydrophobicContact CE2-CB 4.42Å; Y478-I697 HydrophobicContact CG-CB 4.3Å; Y478-I697 HydrophobicContact CG-CG2 3.95Å; K542-I697 HydrophobicContact CB-CD1 4.11Å; K542-I697 HydrophobicContact CD-CG1 4.34Å; K542-I697 HydrophobicContact CG-CD1 4.06Å; K542-I697 HydrophobicContact CG-CG1 4.13Å; I697-L700 HydrophobicContact CD1-CD2 4.04Å; I697-C701 VanDerWaalsContact O-CB 3.3Å; I697-C701 WeakPolarHBondContact O-CB 3.29Å; I697-C701 PolarHBondContact O-N 3.21Å; I697-C701 PolarHBondContact O-SG 3.21Å
698	S	93.3	Very high	95.7	Very high	39 Å²	39	30.8 Å²	30.8	27%	0.273	18%	0.18	S	C	.	.	H	α-helix	trans	-66	-47.5	177.3	-170	0	0	0	0	112.4	S696 C701 T702	S696-S698 PolarHBondContact O-N 2.74Å; S696-S698 VanDerWaalsContact O-N 3.17Å; S696-S698 PolarHBondContact OG-N 3.37Å; S698-C701 PolarHBondContact O-N 3.15Å; S698-T702 WeakPolarHBondContact O-CB 3.23Å; S698-T702 PolarHBondContact O-N 3.27Å; S698-T702 PolarHBondContact O-OG1 3.45Å
699	E	95	Very high	95.9	Very high	68 Å²	68	31.2 Å²	31.2	32%	0.318	18%	0.181	S	C	.	.	H	α-helix	trans	-66.1	-45.5	176.2	-68	155.1	116.6	0	0	110.7	L691 S696 C701 T702 F703	L691-E699 HydrophobicContact CD1-CB 4.31Å; S696-E699 VanDerWaalsContact CB-OE2 3.24Å; S696-E699 WeakPolarHBondContact CB-OE2 3.44Å; S696-E699 PolarHBondContact N-OE2 3.1Å; S696-E699 PolarHBondContact O-N 3.42Å; S696-E699 WeakPolarHBondContact OG-CG 3.39Å; S696-E699 PolarHBondContact OG-N 3.01Å; S696-E699 PolarHBondContact OG-OE2 3.47Å; E699-C701 PolarHBondContact O-N 3.04Å; E699-T702 PolarHBondContact O-N 3.08Å; E699-F703 WeakPolarHBondContact O-CB 3.31Å; E699-F703 PolarHBondContact O-N 2.89Å
700	L	96.9	Very high	96.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-52.6	-51.7	174.2	172.9	64.1	0	0	0	111.7	V535 L538 L691 S696 I697 T702 M704	V535-L700 HydrophobicContact CG2-CD1 4.14Å; L538-L700 HydrophobicContact CB-CD2 3.88Å; L538-L700 HydrophobicContact CD1-CB 4.36Å; L538-L700 HydrophobicContact CD1-CD1 3.83Å; L538-L700 HydrophobicContact CD1-CD2 4.46Å; L538-L700 HydrophobicContact CD1-CG 4.43Å; L691-L700 HydrophobicContact CD1-CB 4.5Å; L691-L700 HydrophobicContact CD2-CD1 4.12Å; S696-L700 PolarHBondContact O-N 3.06Å; I697-L700 HydrophobicContact CD1-CD2 4.04Å; L700-T702 PolarHBondContact O-N 3.3Å; L700-M704 HydrophobicContact CD1-CG 3.66Å; L700-M704 HydrophobicContact CG-CG 4.42Å; L700-M704 WeakPolarHBondContact O-CB 3.24Å; L700-M704 WeakPolarHBondContact O-CG 3.1Å; L700-M704 PolarHBondContact O-N 3.35Å
701	C	96.6	Very high	96.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-40.1	-177.4	-70.1	0	0	0	0	112.1	M433 I471 L475 I697 S698 E699 L705	M433-C701 HydrophobicContact CE-CB 3.93Å; I471-C701 HydrophobicContact CG2-CB 3.7Å; L475-C701 HydrophobicContact CD1-CB 4.45Å; L475-C701 HydrophobicContact CD2-CB 3.85Å; L475-C701 HydrophobicContact CG-CB 4.19Å; I697-C701 VanDerWaalsContact O-CB 3.3Å; I697-C701 WeakPolarHBondContact O-CB 3.29Å; I697-C701 PolarHBondContact O-N 3.21Å; I697-C701 PolarHBondContact O-SG 3.21Å; S698-C701 PolarHBondContact O-N 3.15Å; E699-C701 PolarHBondContact O-N 3.04Å; C701-L705 WeakPolarHBondContact O-CB 3.4Å; C701-L705 WeakPolarHBondContact O-CG 3.1Å; C701-L705 PolarHBondContact O-N 2.91Å
702	T	96.5	Very high	96.3	Very high	27 Å²	27	27.4 Å²	27.4	17%	0.166	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-48.3	177.6	-59.5	0	0	0	0	111.6	A428 S698 E699 L700 T706	A428-T702 HydrophobicContact CB-CG2 3.86Å; S698-T702 WeakPolarHBondContact O-CB 3.23Å; S698-T702 PolarHBondContact O-N 3.27Å; S698-T702 PolarHBondContact O-OG1 3.45Å; E699-T702 PolarHBondContact O-N 3.08Å; L700-T702 PolarHBondContact O-N 3.3Å; T702-T706 WeakPolarHBondContact O-CB 3.49Å; T702-T706 PolarHBondContact O-N 2.94Å; T702-T706 VanDerWaalsContact O-N 3.14Å; T702-T706 PolarHBondContact O-OG1 3.01Å
703	F	97.7	Very high	96.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.5	-50.9	175.9	-172.8	-84.6	0	0	0	111.3	L531 F681 L684 D685 C688 L691 E699 T706 A707	L531-F703 HydrophobicContact CD2-CE1 4Å; F681-F703 HydrophobicContact CD1-CZ 4.19Å; L684-F703 HydrophobicContact CB-CD2 4.42Å; L684-F703 HydrophobicContact CB-CE1 4.47Å; L684-F703 HydrophobicContact CB-CE2 3.62Å; L684-F703 HydrophobicContact CB-CZ 3.64Å; L684-F703 HydrophobicContact CD1-CE1 4Å; L684-F703 HydrophobicContact CD1-CZ 3.86Å; L684-F703 HydrophobicContact CG-CZ 4.37Å; D685-F703 WeakPolarHBondContact OD1-CE2 3.3Å; C688-F703 HydrophobicContact CB-CB 4.28Å; C688-F703 HydrophobicContact CB-CD2 3.86Å; C688-F703 HydrophobicContact CB-CG 4.48Å; L691-F703 HydrophobicContact CB-CD2 4.2Å; L691-F703 HydrophobicContact CB-CE2 4.28Å; L691-F703 HydrophobicContact CB-CG 4.44Å; L691-F703 HydrophobicContact CD1-CB 4.4Å; L691-F703 HydrophobicContact CD2-CD1 4.29Å; E699-F703 WeakPolarHBondContact O-CB 3.31Å; E699-F703 PolarHBondContact O-N 2.89Å; F703-T706 PolarHBondContact O-N 3.17Å; F703-A707 WeakPolarHBondContact O-CB 3.5Å; F703-A707 PolarHBondContact O-N 3.36Å
704	M	97.6	Very high	96.2	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-72.7	-36.8	-173.3	-72.6	-67.3	-48.5	0	0	114	L467 I471 L531 V535 L700 A707 A708	L467-M704 HydrophobicContact CD2-CE 4.18Å; I471-M704 HydrophobicContact CD1-CB 3.51Å; I471-M704 HydrophobicContact CD1-CG 3.84Å; I471-M704 HydrophobicContact CG1-CB 3.63Å; I471-M704 HydrophobicContact CG1-CG 4.47Å; L531-M704 HydrophobicContact CB-CE 3.96Å; L531-M704 HydrophobicContact CB-SD 4.2Å; L531-M704 HydrophobicContact CD2-CE 4.1Å; L531-M704 HydrophobicContact CD2-SD 3.53Å; L531-M704 VanDerWaalsContact CD2-SD 3.53Å; L531-M704 HydrophobicContact CG-SD 4.45Å; V535-M704 HydrophobicContact CG2-CE 3.36Å; V535-M704 HydrophobicContact CG2-CG 3.74Å; V535-M704 HydrophobicContact CG2-SD 3.49Å; V535-M704 WeakPolarHBondContact CG2-SD 3.04Å; L700-M704 HydrophobicContact CD1-CG 3.66Å; L700-M704 HydrophobicContact CG-CG 4.42Å; L700-M704 WeakPolarHBondContact O-CB 3.24Å; L700-M704 WeakPolarHBondContact O-CG 3.1Å; L700-M704 PolarHBondContact O-N 3.35Å; M704-A707 PolarHBondContact O-N 3.38Å; M704-A708 VanDerWaalsContact O-CB 3.27Å; M704-A708 WeakPolarHBondContact O-CB 3.44Å; M704-A708 PolarHBondContact O-N 3.45Å
705	L	97.3	Very high	96.2	Very high	5 Å²	5	21.8 Å²	21.8	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-71	-35.1	174.2	-71.4	169.4	0	0	0	111.6	L429 V431 E468 I471 Y472 L475 C701 A708 D709	L429-L705 HydrophobicContact CD2-CB 3.77Å; V431-L705 HydrophobicContact CG1-CD1 4.37Å; V431-L705 HydrophobicContact CG2-CD1 3.76Å; E468-L705 HydrophobicContact CG-CD2 3.89Å; I471-L705 HydrophobicContact CB-CD2 4.11Å; I471-L705 HydrophobicContact CB-CG 4.17Å; I471-L705 HydrophobicContact CG2-CD1 3.9Å; I471-L705 HydrophobicContact CG2-CD2 4.16Å; I471-L705 HydrophobicContact CG2-CG 3.72Å; Y472-L705 HydrophobicContact CE1-CD1 3.87Å; Y472-L705 HydrophobicContact CE1-CD2 4.2Å; Y472-L705 HydrophobicContact CE2-CD2 4.1Å; L475-L705 HydrophobicContact CD1-CD1 4.22Å; C701-L705 WeakPolarHBondContact O-CB 3.4Å; C701-L705 WeakPolarHBondContact O-CG 3.1Å; C701-L705 PolarHBondContact O-N 2.91Å; L705-A708 PolarHBondContact O-N 3.16Å; L705-D709 WeakPolarHBondContact O-CB 3.5Å; L705-D709 PolarHBondContact O-N 3.4Å
706	T	97.7	Very high	96	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-63.9	-44.2	172.4	-55.2	0	0	0	0	111.1	P425 L429 L684 V687 C688 T702 F703 W710	P425-T706 HydrophobicContact CB-CG2 4.13Å; P425-T706 HydrophobicContact CG-CG2 3.72Å; L429-T706 PolarHBondContact N-OG1 3.19Å; L684-T706 HydrophobicContact CD2-CG2 4.2Å; V687-T706 HydrophobicContact CG1-CG2 4.42Å; C688-T706 VanDerWaalsContact SG-CB 3.58Å; C688-T706 PolarHBondContact SG-OG1 2.96Å; T702-T706 WeakPolarHBondContact O-CB 3.49Å; T702-T706 PolarHBondContact O-N 2.94Å; T702-T706 VanDerWaalsContact O-N 3.14Å; T702-T706 PolarHBondContact O-OG1 3.01Å; F703-T706 PolarHBondContact O-N 3.17Å; T706-W710 WeakPolarHBondContact O-CB 3.14Å; T706-W710 PolarHBondContact O-N 3.49Å
707	A	97.8	Very high	95.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-45.8	174.8	0	0	0	0	0	112.9	L531 F680 L684 F703 M704 W710 L711	L531-A707 HydrophobicContact CD1-CB 4.12Å; L531-A707 HydrophobicContact CD2-CB 3.8Å; F680-A707 HydrophobicContact CZ-CB 4.42Å; L684-A707 HydrophobicContact CD1-CB 3.63Å; L684-A707 HydrophobicContact CD2-CB 3.93Å; L684-A707 HydrophobicContact CG-CB 4.46Å; F703-A707 WeakPolarHBondContact O-CB 3.5Å; F703-A707 PolarHBondContact O-N 3.36Å; M704-A707 PolarHBondContact O-N 3.38Å; A707-W710 PolarHBondContact O-N 3Å; A707-L711 WeakPolarHBondContact O-CB 3.44Å; A707-L711 VanDerWaalsContact O-CG 3.32Å; A707-L711 WeakPolarHBondContact O-CG 3.29Å; A707-L711 PolarHBondContact O-N 3.14Å
708	A	97.4	Very high	95.6	Very high	5 Å²	5	22 Å²	22	4%	0.041	11%	0.112	C	C	.	.	H	α-helix	trans	-63.6	-43.6	179.2	0	0	0	0	0	111.8	I464 E468 M704 L705 L711 R712	I464-A708 WeakPolarHBondContact CG2-O 3.5Å; E468-A708 HydrophobicContact CB-CB 4.3Å; M704-A708 VanDerWaalsContact O-CB 3.27Å; M704-A708 WeakPolarHBondContact O-CB 3.44Å; M704-A708 PolarHBondContact O-N 3.45Å; L705-A708 PolarHBondContact O-N 3.16Å; A708-L711 PolarHBondContact O-N 3.31Å; A708-R712 WeakPolarHBondContact O-CB 3.19Å; A708-R712 PolarHBondContact O-N 3.39Å
709	D	96.8	Very high	95.1	Very high	22 Å²	22	22.8 Å²	22.8	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-67.2	-40.6	176.7	-172.9	46.4	0	0	0	112.2	L705 R712 R713	L705-D709 WeakPolarHBondContact O-CB 3.5Å; L705-D709 PolarHBondContact O-N 3.4Å; D709-R712 WeakPolarHBondContact O-CB 3.38Å; D709-R712 PolarHBondContact O-N 2.92Å; D709-R712 IonicContact OD1-CZ 2.75Å; D709-R712 IonicContact OD1-NE 3.75Å; D709-R712 PolarHBondContact OD1-NE 2.72Å; D709-R712 IonicContact OD1-NH2 2.72Å; D709-R712 PolarHBondContact OD1-NH2 2.62Å; D709-R713 VanDerWaalsContact O-CG 3.28Å; D709-R713 WeakPolarHBondContact O-CG 3.18Å; D709-R713 PolarHBondContact O-N 3.33Å; D709-R713 IonicContact OD1-NE 3.33Å; D709-R713 IonicContact OD2-CZ 2.72Å; D709-R713 IonicContact OD2-NE 2.67Å; D709-R713 PolarHBondContact OD2-NE 3.41Å; D709-R713 IonicContact OD2-NH2 2.72Å; D709-R713 PolarHBondContact OD2-NH2 2.78Å
710	W	97.4	Very high	94.3	Very high	3 Å²	3	26.6 Å²	26.6	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-49.3	174.4	-178	13.8	0	0	0	111.7	L420 L421 M423 A424 P425 F680 H683 L684 T706 A707 R712 R713 F714	L420-W710 HydrophobicContact CD1-CD2 4.42Å; L420-W710 HydrophobicContact CD1-CG 4.48Å; L420-W710 HydrophobicContact CD1-CZ2 4.21Å; L420-W710 HydrophobicContact CG-CZ2 3.84Å; L420-W710 WeakPolarHBondContact O-CZ2 3.49Å; L420-W710 PolarHBondContact O-NE1 3.43Å; L421-W710 HydrophobicContact CD2-CH2 4.22Å; L421-W710 HydrophobicContact CD2-CZ2 4.25Å; M423-W710 VanDerWaalsContact O-CD1 3.26Å; M423-W710 PolarHBondContact O-NE1 3.31Å; A424-W710 HydrophobicContact CB-CH2 3.96Å; A424-W710 HydrophobicContact CB-CZ2 3.49Å; A424-W710 VanDerWaalsContact CB-CZ2 3.49Å; P425-W710 VanDerWaalsContact CD-CD2 3.48Å; P425-W710 HydrophobicContact CG-CB 4.48Å; P425-W710 HydrophobicContact CG-CD2 4.43Å; P425-W710 HydrophobicContact CG-CE3 4.25Å; F680-W710 HydrophobicContact CD2-CD2 4.09Å; F680-W710 AromaticContact CD2-CE3 3.64Å; F680-W710 HydrophobicContact CD2-CE3 3.64Å; F680-W710 AromaticContact CD2-CH2 3.57Å; F680-W710 HydrophobicContact CD2-CH2 3.57Å; F680-W710 HydrophobicContact CD2-CZ2 4Å; F680-W710 AromaticContact CD2-CZ3 3.37Å; F680-W710 HydrophobicContact CD2-CZ3 3.37Å; F680-W710 AromaticContact CE2-CD2 3.8Å; F680-W710 HydrophobicContact CE2-CD2 3.8Å; F680-W710 AromaticContact CE2-CE3 3.42Å; F680-W710 HydrophobicContact CE2-CE3 3.42Å; F680-W710 VanDerWaalsContact CE2-CE3 3.42Å; F680-W710 HydrophobicContact CE2-CG 4.5Å; F680-W710 HydrophobicContact CE2-CH2 4.24Å; F680-W710 AromaticContact CE2-CZ3 3.68Å; F680-W710 HydrophobicContact CE2-CZ3 3.68Å; F680-W710 HydrophobicContact CG-CH2 4.41Å; F680-W710 HydrophobicContact CG-CZ3 4.25Å; F680-W710 HydrophobicContact CZ-CE3 4.43Å; H683-W710 HydrophobicContact CB-CH2 3.76Å; H683-W710 HydrophobicContact CB-CZ3 3.94Å; H683-W710 AromaticContact CD2-CH2 3.9Å; H683-W710 AromaticContact CD2-CZ3 3.76Å; H683-W710 AromaticContact CG-CH2 3.89Å; L684-W710 HydrophobicContact CD2-CE3 3.89Å; L684-W710 HydrophobicContact CD2-CZ3 4.24Å; L684-W710 HydrophobicContact CG-CE3 4.07Å; L684-W710 HydrophobicContact CG-CZ3 3.98Å; T706-W710 WeakPolarHBondContact O-CB 3.14Å; T706-W710 PolarHBondContact O-N 3.49Å; A707-W710 PolarHBondContact O-N 3Å; W710-R712 VanDerWaalsContact C-N 3.3Å; W710-R712 PolarHBondContact O-N 2.93Å; W710-R713 PolarHBondContact O-N 3.04Å; W710-F714 WeakPolarHBondContact O-CB 3.21Å; W710-F714 PolarHBondContact O-N 3.15Å
711	L	97.3	Very high	93	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-36.6	176.5	-67.8	176.7	0	0	0	112.1	L420 I464 L524 L531 F680 A707 A708 F714 H715	L420-L711 HydrophobicContact CD1-CD2 4.22Å; I464-L711 HydrophobicContact CD1-CB 3.94Å; I464-L711 HydrophobicContact CG1-CB 4.24Å; I464-L711 HydrophobicContact CG2-CB 4.49Å; L524-L711 HydrophobicContact CD2-CD2 3.9Å; L531-L711 HydrophobicContact CD1-CD1 3.69Å; F680-L711 HydrophobicContact CE2-CD2 3.78Å; F680-L711 HydrophobicContact CE2-CG 4.12Å; F680-L711 HydrophobicContact CZ-CD1 4.08Å; F680-L711 HydrophobicContact CZ-CD2 3.85Å; F680-L711 HydrophobicContact CZ-CG 3.91Å; A707-L711 WeakPolarHBondContact O-CB 3.44Å; A707-L711 VanDerWaalsContact O-CG 3.32Å; A707-L711 WeakPolarHBondContact O-CG 3.29Å; A707-L711 PolarHBondContact O-N 3.14Å; A708-L711 PolarHBondContact O-N 3.31Å; L711-F714 PolarHBondContact O-N 3.37Å; L711-H715 VanDerWaalsContact O-CB 3.28Å; L711-H715 WeakPolarHBondContact O-CB 3.12Å; L711-H715 PolarHBondContact O-N 2.88Å
712	R	95.5	Very high	91.2	Very high	75 Å²	75	36.1 Å²	36.1	28%	0.283	18%	0.178	S	C	.	.	H	α-helix	trans	-65.9	-42.6	175.1	-174.4	175.8	67.1	179.3	6	112.4	L461 I464 E468 A708 D709 W710 S716	L461-R712 HydrophobicContact CD1-CG 4.31Å; I464-R712 HydrophobicContact CG2-CB 3.97Å; E468-R712 IonicContact OE1-CZ 3.35Å; E468-R712 IonicContact OE1-NH1 2.7Å; E468-R712 PolarHBondContact OE1-NH1 2.61Å; E468-R712 IonicContact OE2-CZ 2.72Å; E468-R712 IonicContact OE2-NH1 2.67Å; E468-R712 PolarHBondContact OE2-NH1 2.89Å; A708-R712 WeakPolarHBondContact O-CB 3.19Å; A708-R712 PolarHBondContact O-N 3.39Å; D709-R712 WeakPolarHBondContact O-CB 3.38Å; D709-R712 PolarHBondContact O-N 2.92Å; D709-R712 IonicContact OD1-CZ 2.75Å; D709-R712 IonicContact OD1-NE 3.75Å; D709-R712 PolarHBondContact OD1-NE 2.72Å; D709-R712 IonicContact OD1-NH2 2.72Å; D709-R712 PolarHBondContact OD1-NH2 2.62Å; W710-R712 VanDerWaalsContact C-N 3.3Å; W710-R712 PolarHBondContact O-N 2.93Å; R712-S716 VanDerWaalsContact O-CB 3.32Å; R712-S716 WeakPolarHBondContact O-CB 3.24Å; R712-S716 PolarHBondContact O-N 3.33Å; R712-S716 PolarHBondContact O-OG 3.41Å
713	R	95	Very high	88.9	Confident	121 Å²	121	38.1 Å²	38.1	46%	0.457	20%	0.204	S	C	.	.	H	α-helix	trans	-63	-46	174.1	-70.8	174	-166.5	-152.6	7.8	111.3	M423 D709 W710 S716 A717	M423-R713 HydrophobicContact CE-CB 4.02Å; D709-R713 VanDerWaalsContact O-CG 3.28Å; D709-R713 WeakPolarHBondContact O-CG 3.18Å; D709-R713 PolarHBondContact O-N 3.33Å; D709-R713 IonicContact OD1-NE 3.33Å; D709-R713 IonicContact OD2-CZ 2.72Å; D709-R713 IonicContact OD2-NE 2.67Å; D709-R713 PolarHBondContact OD2-NE 3.41Å; D709-R713 IonicContact OD2-NH2 2.72Å; D709-R713 PolarHBondContact OD2-NH2 2.78Å; W710-R713 PolarHBondContact O-N 3.04Å; R713-S716 WeakPolarHBondContact O-CB 3.5Å; R713-S716 PolarHBondContact O-N 2.97Å; R713-A717 PolarHBondContact O-N 3.41Å
714	F	95.1	Very high	86.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-45.5	176.8	171.7	-110.4	0	0	0	112.2	H416 C419 L420 Y520 F523 L524 W710 L711 S716 A717 Q718	H416-F714 HydrophobicContact CB-CZ 4.22Å; H416-F714 WeakPolarHBondContact O-CE2 3.44Å; H416-F714 WeakPolarHBondContact O-CZ 3.14Å; C419-F714 HydrophobicContact CB-CE2 4.03Å; L420-F714 VanDerWaalsContact CA-CD2 3.49Å; L420-F714 HydrophobicContact CB-CD2 3.86Å; L420-F714 HydrophobicContact CB-CE2 3.75Å; L420-F714 HydrophobicContact CB-CG 4.32Å; L420-F714 HydrophobicContact CB-CZ 4.15Å; L420-F714 HydrophobicContact CD1-CB 3.67Å; L420-F714 HydrophobicContact CD1-CD1 3.83Å; L420-F714 HydrophobicContact CD1-CD2 3.94Å; L420-F714 HydrophobicContact CD1-CE1 4.4Å; L420-F714 HydrophobicContact CD1-CE2 4.5Å; L420-F714 HydrophobicContact CD1-CG 3.55Å; Y520-F714 HydrophobicContact CD2-CE1 4.26Å; Y520-F714 HydrophobicContact CE2-CD1 4.28Å; Y520-F714 AromaticContact CE2-CE1 3.64Å; Y520-F714 HydrophobicContact CE2-CE1 3.64Å; Y520-F714 HydrophobicContact CE2-CZ 4.23Å; F523-F714 HydrophobicContact CD1-CE1 4.04Å; F523-F714 HydrophobicContact CD1-CZ 4.14Å; F523-F714 AromaticContact CE1-CE1 3.69Å; F523-F714 HydrophobicContact CE1-CE1 3.69Å; F523-F714 AromaticContact CE1-CZ 3.64Å; F523-F714 HydrophobicContact CE1-CZ 3.64Å; L524-F714 HydrophobicContact CD2-CD1 4.14Å; L524-F714 HydrophobicContact CD2-CE1 4.04Å; W710-F714 WeakPolarHBondContact O-CB 3.21Å; W710-F714 PolarHBondContact O-N 3.15Å; L711-F714 PolarHBondContact O-N 3.37Å; F714-S716 VanDerWaalsContact C-N 3.33Å; F714-S716 PolarHBondContact O-N 2.99Å; F714-A717 WeakPolarHBondContact O-CB 3.44Å; F714-A717 PolarHBondContact O-N 3.45Å; F714-A717 VanDerWaalsContact O-N 3.12Å; F714-Q718 HydrophobicContact CD2-CG 4.19Å; F714-Q718 HydrophobicContact CE1-CG 4.23Å; F714-Q718 HydrophobicContact CE2-CG 3.86Å; F714-Q718 VanDerWaalsContact CE2-NE2 3.28Å; F714-Q718 HydrophobicContact CZ-CG 3.87Å; F714-Q718 WeakPolarHBondContact O-CG 3.46Å; F714-Q718 PolarHBondContact O-N 3.03Å
715	H	94	Very high	83.9	Confident	7 Å²	7	52.9 Å²	52.9	3%	0.032	28%	0.275	C	S	.	.	H	α-helix	trans	-57.4	-45.3	172.6	-179.4	-64	0	0	0	112	D458 I464 Y520 L711 A717 Q718 S719	D458-H715 IonicContact OD1-CD2 3.14Å; D458-H715 IonicContact OD1-CE1 3.21Å; D458-H715 IonicContact OD1-NE2 2.78Å; D458-H715 PolarHBondContact OD1-NE2 3.12Å; D458-H715 IonicContact OD2-CE1 3.08Å; D458-H715 PolarHBondContact OD2-CE1 3.14Å; D458-H715 IonicContact OD2-NE2 2.69Å; D458-H715 PolarHBondContact OD2-NE2 3.19Å; I464-H715 HydrophobicContact CD1-CB 4.42Å; Y520-H715 VanDerWaalsContact OH-CA 3.32Å; Y520-H715 WeakPolarHBondContact OH-CA 3.44Å; Y520-H715 WeakPolarHBondContact OH-CB 3.44Å; Y520-H715 PolarHBondContact OH-CD2 3.08Å; L711-H715 VanDerWaalsContact O-CB 3.28Å; L711-H715 WeakPolarHBondContact O-CB 3.12Å; L711-H715 PolarHBondContact O-N 2.88Å; H715-A717 PolarHBondContact O-N 3.3Å; H715-Q718 PolarHBondContact O-N 2.95Å; H715-S719 WeakPolarHBondContact O-CB 3.48Å; H715-S719 PolarHBondContact O-N 2.97Å; H715-S719 PolarHBondContact O-OG 3.16Å
716	S	92.7	Very high	81.1	Confident	47 Å²	47	59 Å²	59	33%	0.329	32%	0.317	S	S	.	.	H	α-helix	trans	-64.7	-20.2	177.1	-58.7	0	0	0	0	113.9	R712 R713 F714 K720	R712-S716 VanDerWaalsContact O-CB 3.32Å; R712-S716 WeakPolarHBondContact O-CB 3.24Å; R712-S716 PolarHBondContact O-N 3.33Å; R712-S716 PolarHBondContact O-OG 3.41Å; R713-S716 WeakPolarHBondContact O-CB 3.5Å; R713-S716 PolarHBondContact O-N 2.97Å; F714-S716 VanDerWaalsContact C-N 3.33Å; F714-S716 PolarHBondContact O-N 2.99Å; S716-K720 WeakPolarHBondContact O-CD 3.45Å; S716-K720 WeakPolarHBondContact O-CE 3.45Å; S716-K720 VanDerWaalsContact O-CG 3.24Å; S716-K720 WeakPolarHBondContact O-CG 3.25Å
717	A	91.6	Very high	77.9	Confident	21 Å²	21	61.8 Å²	61.8	17%	0.174	35%	0.346	C	S	.	.	H	α-helix	trans	-85.9	-47.1	172	0	0	0	0	0	111.5	M423 R713 F714 H715 S719 K720 N721	M423-A717 HydrophobicContact CE-CB 4.47Å; R713-A717 PolarHBondContact O-N 3.41Å; F714-A717 WeakPolarHBondContact O-CB 3.44Å; F714-A717 PolarHBondContact O-N 3.45Å; F714-A717 VanDerWaalsContact O-N 3.12Å; H715-A717 PolarHBondContact O-N 3.3Å; A717-S719 PolarHBondContact O-N 2.81Å; A717-K720 PolarHBondContact O-N 3.5Å; A717-N721 PolarHBondContact O-N 2.97Å; A717-N721 VanDerWaalsContact O-N 3.13Å; A717-N721 PolarHBondContact O-ND2 2.94Å
718	Q	87.7	Confident	74.9	Confident	15 Å²	15	69.9 Å²	69.9	7%	0.07	39%	0.386	C	S	.	.	H	α-helix	trans	-61.5	-44.9	-179.8	-68.2	-69.3	-12	0	0	112.1	H416 C419 Y520 F714 H715 K720 N721 F722	H416-Q718 PolarHBondContact ND1-NE2 2.83Å; C419-Q718 PolarHBondContact SG-NE2 3.4Å; Y520-Q718 HydrophobicContact CD2-CB 4.46Å; Y520-Q718 HydrophobicContact CD2-CG 4.21Å; Y520-Q718 HydrophobicContact CE2-CB 3.92Å; Y520-Q718 HydrophobicContact CE2-CG 3.75Å; F714-Q718 HydrophobicContact CD2-CG 4.19Å; F714-Q718 HydrophobicContact CE1-CG 4.23Å; F714-Q718 HydrophobicContact CE2-CG 3.86Å; F714-Q718 VanDerWaalsContact CE2-NE2 3.28Å; F714-Q718 HydrophobicContact CZ-CG 3.87Å; F714-Q718 WeakPolarHBondContact O-CG 3.46Å; F714-Q718 PolarHBondContact O-N 3.03Å; H715-Q718 PolarHBondContact O-N 2.95Å; Q718-K720 VanDerWaalsContact C-N 3.34Å; Q718-K720 PolarHBondContact O-N 3.07Å; Q718-N721 WeakPolarHBondContact O-CB 3.45Å; Q718-N721 PolarHBondContact O-N 2.88Å; Q718-N721 VanDerWaalsContact O-N 3.08Å; Q718-F722 VanDerWaalsContact O-CD2 3.22Å; Q718-F722 WeakPolarHBondContact O-CD2 3.29Å; Q718-F722 PolarHBondContact O-N 2.87Å
719	S	82.6	Confident	72.1	Confident	54 Å²	54	78.7 Å²	78.7	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-59.5	-39.7	176.5	50.4	0	0	0	0	113.2	H715 A717 N721 G723	H715-S719 WeakPolarHBondContact O-CB 3.48Å; H715-S719 PolarHBondContact O-N 2.97Å; H715-S719 PolarHBondContact O-OG 3.16Å; A717-S719 PolarHBondContact O-N 2.81Å; S719-N721 VanDerWaalsContact C-N 3.32Å; S719-N721 PolarHBondContact O-N 3.15Å; S719-G723 PolarHBondContact O-N 3.43Å
720	K	80	Confident	70.8	Confident	149 Å²	149	81.5 Å²	81.5	65%	0.648	46%	0.459	S	S	*	.	H	α-helix	trans	-65.7	-32.8	173.8	-70.4	174.6	-170.4	176	0	112.9	S716 A717 Q718	S716-K720 WeakPolarHBondContact O-CD 3.45Å; S716-K720 WeakPolarHBondContact O-CE 3.45Å; S716-K720 VanDerWaalsContact O-CG 3.24Å; S716-K720 WeakPolarHBondContact O-CG 3.25Å; A717-K720 PolarHBondContact O-N 3.5Å; Q718-K720 VanDerWaalsContact C-N 3.34Å; Q718-K720 PolarHBondContact O-N 3.07Å
721	N	69.4	Low	69.4	Low	94 Å²	94	85.6 Å²	85.6	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-72.6	-44.4	177.5	-67.7	-18.9	0	0	0	111.8	A717 Q718 S719 G723 R724	A717-N721 PolarHBondContact O-N 2.97Å; A717-N721 VanDerWaalsContact O-N 3.13Å; A717-N721 PolarHBondContact O-ND2 2.94Å; Q718-N721 WeakPolarHBondContact O-CB 3.45Å; Q718-N721 PolarHBondContact O-N 2.88Å; Q718-N721 VanDerWaalsContact O-N 3.08Å; S719-N721 VanDerWaalsContact C-N 3.32Å; S719-N721 PolarHBondContact O-N 3.15Å; N721-G723 VanDerWaalsContact C-N 3.26Å; N721-G723 PolarHBondContact O-N 2.84Å; N721-R724 PolarHBondContact O-N 2.84Å
722	F	57.3	Low	67.9	Low	106 Å²	106	90.3 Å²	90.3	47%	0.465	51%	0.509	S	S	.	.	H	α-helix	trans	-57.2	-40.5	173.7	-78	-69.3	0	0	0	112.1	Q718 R724 S725	Q718-F722 VanDerWaalsContact O-CD2 3.22Å; Q718-F722 WeakPolarHBondContact O-CD2 3.29Å; Q718-F722 PolarHBondContact O-N 2.87Å; F722-R724 PolarHBondContact O-N 3.07Å; F722-R724 VanDerWaalsContact O-N 3.13Å; F722-S725 PolarHBondContact O-N 3Å
723	G	48.3	Very low	66.3	Low	69 Å²	69	91.2 Å²	91.2	71%	0.711	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14	176.3	0	0	0	0	0	115.8	S719 N721	S719-G723 PolarHBondContact O-N 3.43Å; N721-G723 VanDerWaalsContact C-N 3.26Å; N721-G723 PolarHBondContact O-N 2.84Å
724	R	48.8	Very low	64.5	Low	212 Å²	212	89.4 Å²	89.4	80%	0.8	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-9.8	177.9	-70.9	-173.1	175.2	-139.8	-1.5	114.3	N721 F722 C726	N721-R724 PolarHBondContact O-N 2.84Å; F722-R724 PolarHBondContact O-N 3.07Å; F722-R724 VanDerWaalsContact O-N 3.13Å; R724-C726 VanDerWaalsContact C-N 3.33Å; R724-C726 PolarHBondContact O-N 3.39Å
725	S	42.9	Very low	62.4	Low	99 Å²	99	95.3 Å²	95.3	69%	0.692	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	1.4	-171.7	-163.4	0	0	0	0	115.6	F722	F722-S725 PolarHBondContact O-N 3Å
726	C	37.4	Very low	60.2	Low	135 Å²	135	101.6 Å²	101.6	91%	0.912	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	17.6	175	-72.1	0	0	0	0	113.4	R724	R724-C726 VanDerWaalsContact C-N 3.33Å; R724-C726 PolarHBondContact O-N 3.39Å
727	G	30.4	Very low	57.7	Low	62 Å²	62	105.8 Å²	105.8	64%	0.639	62%	0.62	S	S	*	*			trans	-122	62.6	179	0	0	0	0	0	112.6
728	M	35.2	Very low	54.8	Low	170 Å²	170	112.9 Å²	112.9	84%	0.837	66%	0.657	S	S	*	*			trans	-73	142.3	154.3	-72.2	-68.7	-68.9	0	0	108.2
729	P	37.8	Very low	51.8	Low	190 Å²	190	121.8 Å²	121.8	100%	1.234	71%	0.711	S	S	*	*			trans	-70	0	169.8	32.7	-35.5	0	0	0	112.1

Retrieved 729 of 729 residues in 621 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).