A0A096NBU3_PAPAN Loading...

Hormonally up-regulated neu tumor-associated kinase

AlphaFold DB , UniProt , Accession A0A096NBU3, Species PAPAN (Papio anubis, Olive baboon), Gene HUNK, Length 714 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.6	Very low	33.4	Very low	233 Å²	233	124.8 Å²	124.8	100%	1.148	85%	0.852	S	S	*	*				0	119.4	0	-88.2	-64.2	-162.7	0	0	107.8
2	P	50.5	Low	33.1	Very low	117 Å²	117	129.8 Å²	129.8	76%	0.76	85%	0.853	S	S	*	*			cis	-88.2	-172.6	-27.9	12.6	10.7	0	0	0	109
3	A	31.9	Very low	34	Very low	95 Å²	95	128.1 Å²	128.1	79%	0.785	84%	0.841	S	S	*	*			cis	70.8	156.3	27.8	0	0	0	0	0	113.4
4	A	36.2	Very low	33.5	Very low	97 Å²	97	125.9 Å²	125.9	80%	0.802	84%	0.839	S	S	*	*			cis	-159.8	168.7	-6.2	0	0	0	0	0	106.7
5	A	36.2	Very low	33.6	Very low	104 Å²	104	123.9 Å²	123.9	86%	0.86	84%	0.835	S	S	*	*			cis	-167.4	175.4	-19.4	0	0	0	0	0	106.8
6	G	30.5	Very low	34	Very low	78 Å²	78	124.5 Å²	124.5	80%	0.804	84%	0.837	S	S	*	*			trans	175.6	81.9	175.8	0	0	0	0	0	116.7
7	D	33.8	Very low	33.6	Very low	170 Å²	170	121.7 Å²	121.7	91%	0.909	84%	0.835	S	S	*	*			trans	-80.4	155.9	171.2	-80.5	-63.2	0	0	0	113.3
8	G	30	Very low	33.3	Very low	75 Å²	75	119.9 Å²	119.9	77%	0.773	84%	0.839	S	S	*	*			trans	-165.2	123.9	170.8	0	0	0	0	0	111.6
9	L	32.5	Very low	33.1	Very low	152 Å²	152	118.1 Å²	118.1	80%	0.796	84%	0.842	S	S	*	*			trans	-100.9	147	-165.2	-75.4	106.9	0	0	0	115.6
10	L	31.2	Very low	32.8	Very low	170 Å²	170	116 Å²	116	89%	0.89	84%	0.839	S	S	*	*			trans	59	132.6	143.3	-66.7	166.6	0	0	0	120.7
11	G	28.6	Very low	32.7	Very low	82 Å²	82	114.6 Å²	114.6	85%	0.845	84%	0.842	S	S	*	*			trans	174.4	82.4	169.1	0	0	0	0	0	114.3
12	E	29.6	Very low	32.9	Very low	185 Å²	185	108.4 Å²	108.4	86%	0.864	83%	0.828	S	S	*	*			trans	-91.7	171.7	165.6	-111.1	-146	130.5	0	0	110.6
13	P	44.1	Very low	32.2	Very low	107 Å²	107	112.2 Å²	112.2	70%	0.695	84%	0.835	S	S	*	*			cis	-134.4	-161.7	-0.9	36.6	-15.8	0	0	0	113.9
14	A	28	Very low	32.1	Very low	98 Å²	98	115.4 Å²	115.4	81%	0.81	84%	0.839	S	S	*	*			trans	107.3	125.4	150.8	0	0	0	0	0	119.1
15	A	34.6	Very low	32	Very low	95 Å²	95	115.2 Å²	115.2	79%	0.785	84%	0.837	S	S	*	*			trans	-105.8	158.9	162.7	0	0	0	0	0	108.8
16	P	40.4	Very low	31.9	Very low	134 Å²	134	114.7 Å²	114.7	87%	0.87	83%	0.833	S	S	*	*				-151.6	179.8	77.5	41.6	-23.8	0	0	0	115.5
17	G	27.1	Very low	32	Very low	77 Å²	77	122.1 Å²	122.1	79%	0.794	84%	0.837	S	S	*	*			trans	121.5	98.3	149.8	0	0	0	0	0	116.6
18	G	28.6	Very low	32.3	Very low	89 Å²	89	119.2 Å²	119.2	92%	0.918	83%	0.827	S	S	*	*			trans	-74.5	173.4	-178.7	0	0	0	0	0	117.4
19	G	27.9	Very low	32.5	Very low	86 Å²	86	120 Å²	120	89%	0.887	83%	0.827	S	S	*	*			trans	125.2	139.1	-180	0	0	0	0	0	110.7
20	G	28.7	Very low	32.8	Very low	76 Å²	76	117.3 Å²	117.3	78%	0.784	83%	0.826	S	S	*	*			cis	-169.6	144.1	-7	0	0	0	0	0	108.2
21	G	30.3	Very low	33.1	Very low	87 Å²	87	113 Å²	113	90%	0.897	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-66.6	137.2	-168	0	0	0	0	0	114.2
22	A	31.3	Very low	33.3	Very low	103 Å²	103	113.9 Å²	113.9	85%	0.851	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-99.3	118.2	162	0	0	0	0	0	108.6
23	E	34.2	Very low	33.7	Very low	196 Å²	196	114.8 Å²	114.8	92%	0.916	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.5	128.2	171.8	-68.3	-175.9	118	0	0	109.7	A25	E23-A25 PolarHBondContact O-N 3.36Å
24	D	31.2	Very low	33.7	Very low	163 Å²	163	113 Å²	113	87%	0.872	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.7	117.1	-174.6	-157.3	-7.1	0	0	0	110.9	A26	D24-A26 VanDerWaalsContact C-N 3.31Å; D24-A26 PolarHBondContact O-N 2.68Å
25	A	33.4	Very low	35.2	Very low	93 Å²	93	111 Å²	111	77%	0.769	79%	0.793	S	S	*	*			trans	-80.6	73.4	-168.6	0	0	0	0	0	112	E23 R27	E23-A25 PolarHBondContact O-N 3.36Å; A25-R27 PolarHBondContact O-N 3.33Å
26	A	33.3	Very low	36.9	Very low	93 Å²	93	110.9 Å²	110.9	77%	0.769	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-53.8	120.1	-179.5	0	0	0	0	0	112.5	D24	D24-A26 VanDerWaalsContact C-N 3.31Å; D24-A26 PolarHBondContact O-N 2.68Å
27	R	33.7	Very low	38.9	Very low	233 Å²	233	104.9 Å²	104.9	88%	0.879	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-62.1	139.2	171.5	-69.7	178.1	173.5	176.3	-2.1	109.9	A25 A29	A25-R27 PolarHBondContact O-N 3.33Å; R27-A29 PolarHBondContact O-N 3.17Å
28	P	39.5	Very low	41.6	Very low	110 Å²	110	103.1 Å²	103.1	71%	0.714	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-64.4	120	174	26.8	-33.1	0	0	0	110
29	A	34.3	Very low	44	Very low	92 Å²	92	103 Å²	103	76%	0.76	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-65.4	159.8	170.4	0	0	0	0	0	110.9	R27 A31	R27-A29 PolarHBondContact O-N 3.17Å; A29-A31 PolarHBondContact O-N 3.31Å
30	A	37.7	Very low	46.3	Very low	95 Å²	95	105 Å²	105	79%	0.785	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-56.2	135.3	179.1	0	0	0	0	0	111.2	C32	A30-C32 PolarHBondContact O-N 2.74Å; A30-C32 VanDerWaalsContact O-N 3.13Å
31	A	37.6	Very low	48.8	Very low	78 Å²	78	101.3 Å²	101.3	65%	0.645	64%	0.643	S	S	*	*			trans	-70.5	109.1	-175.1	0	0	0	0	0	111	A29	A29-A31 PolarHBondContact O-N 3.31Å
32	C	33	Very low	51.2	Low	102 Å²	102	98.9 Å²	98.9	69%	0.689	61%	0.612	S	S	*	*			trans	-63.1	139.2	168.9	-61.6	0	0	0	0	110.5	A30 S35	A30-C32 PolarHBondContact O-N 2.74Å; A30-C32 VanDerWaalsContact O-N 3.13Å; C32-S35 WeakPolarHBondContact O-CB 3.46Å; C32-S35 PolarHBondContact O-N 2.76Å; C32-S35 PolarHBondContact O-OG 3.14Å
33	E	38.5	Very low	53.6	Low	203 Å²	203	95.4 Å²	95.4	95%	0.949	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	137.3	172.3	-60.1	-175.6	135	0	0	110.2
34	G	43.5	Very low	56	Low	70 Å²	70	87.8 Å²	87.8	72%	0.722	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.9	-1.1	-174.1	0	0	0	0	0	115.7
35	S	59.5	Low	58.4	Low	56 Å²	56	82.6 Å²	82.6	39%	0.392	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-74.8	136.3	173.6	51.3	0	0	0	0	113.3	C32 S346	C32-S35 WeakPolarHBondContact O-CB 3.46Å; C32-S35 PolarHBondContact O-N 2.76Å; C32-S35 PolarHBondContact O-OG 3.14Å; S35-S346 WeakPolarHBondContact O-CB 3.47Å
36	F	70.9	Confident	60.7	Low	93 Å²	93	87.4 Å²	87.4	41%	0.408	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-64.5	155	171.5	-75.2	-76.4	0	0	0	111.7	L349 E353 K354	F36-L349 HydrophobicContact CD1-CD2 4.39Å; F36-L349 HydrophobicContact CE1-CD2 4.37Å; F36-L349 HydrophobicContact CE1-CG 4.38Å; F36-E353 HydrophobicContact CE1-CB 4.31Å; F36-E353 WeakPolarHBondContact CE1-OE2 3.11Å; F36-E353 WeakPolarHBondContact CZ-OE2 3.47Å; F36-K354 HydrophobicContact CE1-CD 4.46Å; F36-K354 VanDerWaalsContact CE1-CE 3.43Å
37	L	82.9	Confident	63.2	Low	7 Å²	7	87.2 Å²	87.2	4%	0.037	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-52.3	129.8	169.5	-70.8	-174.3	0	0	0	111.3	V41 S42 V347 H350 L381 L385	L37-V41 HydrophobicContact CB-CB 4.44Å; L37-V41 HydrophobicContact CB-CG1 4.46Å; L37-V41 HydrophobicContact CD1-CG1 4.1Å; L37-V41 HydrophobicContact CD2-CG1 4.27Å; L37-S42 PolarHBondContact O-OG 2.75Å; L37-V347 HydrophobicContact CD1-CG2 4.31Å; L37-V347 HydrophobicContact CD2-CG2 3.84Å; L37-H350 HydrophobicContact CB-CB 4.26Å; L37-H350 HydrophobicContact CD1-CB 3.65Å; L37-H350 HydrophobicContact CG-CB 3.73Å; L37-L381 HydrophobicContact CD1-CB 4.29Å; L37-L381 HydrophobicContact CD1-CD1 4.11Å; L37-L381 HydrophobicContact CD1-CD2 4.22Å; L37-L381 HydrophobicContact CD1-CG 4.44Å; L37-L385 HydrophobicContact CD2-CD1 4.16Å; L37-L385 HydrophobicContact CD2-CD2 3.92Å; L37-L385 HydrophobicContact CD2-CG 4.43Å
38	P	82.6	Confident	65.6	Low	40 Å²	40	79.2 Å²	79.2	26%	0.26	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-50.6	148.6	177.8	-28.2	34.1	0	0	0	112.5	W40 V41 S42 Y388	P38-W40 PolarHBondContact O-N 2.9Å; P38-W40 VanDerWaalsContact O-N 3.07Å; P38-V41 HydrophobicContact CB-CG2 4.2Å; P38-V41 HydrophobicContact CG-CG2 4.3Å; P38-V41 WeakPolarHBondContact O-CA 3.36Å; P38-V41 PolarHBondContact O-N 2.68Å; P38-S42 PolarHBondContact O-N 2.75Å; P38-S42 PolarHBondContact O-OG 3.49Å; P38-Y388 HydrophobicContact CB-CE1 4.07Å; P38-Y388 HydrophobicContact CG-CD1 4.02Å; P38-Y388 HydrophobicContact CG-CE1 3.61Å
39	A	80	Confident	67.9	Low	86 Å²	86	76 Å²	76	71%	0.711	46%	0.456	S	S	*	.	H	α-helix	trans	-55.2	-31.9	-175.5	0	0	0	0	0	113.4	S42 G43	A39-S42 WeakPolarHBondContact CA-OG 3.33Å; A39-G43 VanDerWaalsContact O-CA 3.3Å; A39-G43 WeakPolarHBondContact O-CA 3.31Å; A39-G43 PolarHBondContact O-N 3.17Å
40	W	76.9	Confident	70.4	Confident	128 Å²	128	79.9 Å²	79.9	49%	0.485	45%	0.451	S	S	.	.	H	α-helix	trans	-67.2	-39.3	173.1	-176.1	-110.3	0	0	0	113.6	P38 K384	P38-W40 PolarHBondContact O-N 2.9Å; P38-W40 VanDerWaalsContact O-N 3.07Å; W40-K384 WeakPolarHBondContact O-CE 3.24Å; W40-K384 PolarHBondContact O-NZ 2.94Å; W40-K384 VanDerWaalsContact O-NZ 3.08Å
41	V	80.2	Confident	73	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-75	-44.7	-179.3	-176.4	0	0	0	0	110.4	L37 P38 K384 L385 Y388	L37-V41 HydrophobicContact CB-CB 4.44Å; L37-V41 HydrophobicContact CB-CG1 4.46Å; L37-V41 HydrophobicContact CD1-CG1 4.1Å; L37-V41 HydrophobicContact CD2-CG1 4.27Å; P38-V41 HydrophobicContact CB-CG2 4.2Å; P38-V41 HydrophobicContact CG-CG2 4.3Å; P38-V41 WeakPolarHBondContact O-CA 3.36Å; P38-V41 PolarHBondContact O-N 2.68Å; V41-K384 HydrophobicContact CG1-CB 4.19Å; V41-K384 HydrophobicContact CG1-CD 4.4Å; V41-K384 HydrophobicContact CG1-CG 4.17Å; V41-K384 WeakPolarHBondContact O-CD 3.46Å; V41-K384 WeakPolarHBondContact O-CE 3.46Å; V41-K384 PolarHBondContact O-NZ 2.86Å; V41-L385 HydrophobicContact CG1-CB 4.11Å; V41-L385 HydrophobicContact CG2-CD1 4.32Å; V41-Y388 HydrophobicContact CG2-CD1 4.36Å; V41-Y388 HydrophobicContact CG2-CG 4.04Å
42	S	81.5	Confident	75.6	Confident	36 Å²	36	78.8 Å²	78.8	25%	0.252	42%	0.42	S	S	.	.	H	α-helix	trans	-75.7	-31.3	178	49.1	0	0	0	0	113.9	L37 P38 A39 H350	L37-S42 PolarHBondContact O-OG 2.75Å; P38-S42 PolarHBondContact O-N 2.75Å; P38-S42 PolarHBondContact O-OG 3.49Å; A39-S42 WeakPolarHBondContact CA-OG 3.33Å; S42-H350 WeakPolarHBondContact CB-CE1 3.32Å
43	G	81.3	Confident	78.5	Confident	29 Å²	29	81.4 Å²	81.4	30%	0.299	42%	0.422	S	S	.	.			trans	-76	146.9	-177.2	0	0	0	0	0	114.5	A39 K384	A39-G43 VanDerWaalsContact O-CA 3.3Å; A39-G43 WeakPolarHBondContact O-CA 3.31Å; A39-G43 PolarHBondContact O-N 3.17Å; G43-K384 PolarHBondContact O-NZ 3.39Å
44	V	84.3	Confident	81.1	Confident	37 Å²	37	75.5 Å²	75.5	22%	0.224	39%	0.394	C	S	.	.			trans	-123	110.3	170.1	-175	0	0	0	0	108.8	R46 L49 T84	V44-R46 PolarHBondContact O-N 2.88Å; V44-L49 HydrophobicContact CG1-CD1 3.79Å; V44-L49 HydrophobicContact CG1-CD2 4.04Å; V44-L49 HydrophobicContact CG1-CG 3.77Å; V44-T84 VanDerWaalsContact CG2-C 3.4Å
45	P	82.4	Confident	83.4	Confident	53 Å²	53	76.9 Å²	76.9	34%	0.344	38%	0.382	S	S	.	.			trans	-56.6	133.7	175.2	-26.1	35.2	0	0	0	111.3	E47 R48 L49	P45-E47 PolarHBondContact O-N 2.99Å; P45-R48 HydrophobicContact CB-CB 4.11Å; P45-R48 PolarHBondContact O-N 3.12Å; P45-L49 PolarHBondContact O-N 3.39Å
46	R	82	Confident	85	Confident	194 Å²	194	78.5 Å²	78.5	73%	0.732	38%	0.382	S	S	*	.	H	α-helix	trans	-69	-23.5	-177.6	-69.3	-179	175	-179.7	-0.9	111.5	V44 R50	V44-R46 PolarHBondContact O-N 2.88Å; R46-R50 WeakPolarHBondContact O-CB 3.15Å; R46-R50 VanDerWaalsContact O-CG 3.24Å; R46-R50 WeakPolarHBondContact O-CG 3.25Å; R46-R50 PolarHBondContact O-N 2.79Å; R46-R50 VanDerWaalsContact O-N 3.09Å; R46-R50 PolarHBondContact O-NE 3.49Å
47	E	84.1	Confident	86.2	Confident	89 Å²	89	80.9 Å²	80.9	42%	0.416	39%	0.388	S	S	.	.	H	α-helix	trans	-66.9	-54.5	177.9	-58.9	57.3	-114.4	0	0	107.9	P45 L49 R50 D51	P45-E47 PolarHBondContact O-N 2.99Å; E47-L49 PolarHBondContact O-N 3.44Å; E47-R50 PolarHBondContact O-N 3Å; E47-R50 IonicContact OE1-CZ 2.75Å; E47-R50 IonicContact OE1-NH2 2.63Å; E47-R50 PolarHBondContact OE1-NH2 3.08Å; E47-D51 WeakPolarHBondContact O-CB 3.39Å; E47-D51 PolarHBondContact O-N 2.72Å; E47-D51 VanDerWaalsContact O-OD2 3.13Å
48	R	85.9	Confident	86.8	Confident	65 Å²	65	81.2 Å²	81.2	25%	0.245	39%	0.39	C	S	.	.	H	α-helix	trans	-54.8	-28.1	176.5	-170.4	176.6	178.7	114.8	-11.7	113.9	P45 F52 L80 G85 D397	P45-R48 HydrophobicContact CB-CB 4.11Å; P45-R48 PolarHBondContact O-N 3.12Å; R48-F52 WeakPolarHBondContact O-CB 3.37Å; R48-L80 VanDerWaalsContact O-CD2 3.27Å; R48-L80 WeakPolarHBondContact O-CD2 3.19Å; R48-G85 PolarHBondContact NE-O 2.9Å; R48-G85 PolarHBondContact NH2-O 2.92Å; R48-D397 IonicContact CZ-OD2 2.62Å; R48-D397 IonicContact NH1-OD1 3.79Å; R48-D397 IonicContact NH1-OD2 2.75Å; R48-D397 PolarHBondContact NH1-OD2 2.96Å
49	L	87.8	Confident	87.4	Confident	43 Å²	43	81.6 Å²	81.6	23%	0.225	40%	0.401	C	S	.	.	H	α-helix	trans	-83.7	-36	172.9	-67.3	174.8	0	0	0	113.6	V44 P45 E47 L80 V82	V44-L49 HydrophobicContact CG1-CD1 3.79Å; V44-L49 HydrophobicContact CG1-CD2 4.04Å; V44-L49 HydrophobicContact CG1-CG 3.77Å; P45-L49 PolarHBondContact O-N 3.39Å; E47-L49 PolarHBondContact O-N 3.44Å; L49-L80 HydrophobicContact CD2-CD2 3.9Å; L49-V82 HydrophobicContact CD2-CB 4.48Å; L49-V82 HydrophobicContact CD2-CG1 4.31Å
50	R	86.9	Confident	88.2	Confident	174 Å²	174	79.2 Å²	79.2	66%	0.657	38%	0.377	S	S	*	.	H	α-helix	trans	-74.1	-42.8	179.7	-76.5	-178.1	-74.6	176.7	-1.5	112.3	R46 E47 F52	R46-R50 WeakPolarHBondContact O-CB 3.15Å; R46-R50 VanDerWaalsContact O-CG 3.24Å; R46-R50 WeakPolarHBondContact O-CG 3.25Å; R46-R50 PolarHBondContact O-N 2.79Å; R46-R50 VanDerWaalsContact O-N 3.09Å; R46-R50 PolarHBondContact O-NE 3.49Å; E47-R50 PolarHBondContact O-N 3Å; E47-R50 IonicContact OE1-CZ 2.75Å; E47-R50 IonicContact OE1-NH2 2.63Å; E47-R50 PolarHBondContact OE1-NH2 3.08Å; R50-F52 VanDerWaalsContact C-N 3.34Å; R50-F52 PolarHBondContact O-N 3.4Å
51	D	90.3	Very high	89.2	Confident	122 Å²	122	73.2 Å²	73.2	65%	0.652	35%	0.354	S	S	*	.	S	Bend	trans	-84.8	-11	-170.6	-53	-30.2	0	0	0	112.7	E47 Q53	E47-D51 WeakPolarHBondContact O-CB 3.39Å; E47-D51 PolarHBondContact O-N 2.72Å; E47-D51 VanDerWaalsContact O-OD2 3.13Å; D51-Q53 PolarHBondContact O-N 3.4Å
52	F	93.1	Very high	90	Very high	28 Å²	28	73.8 Å²	73.8	12%	0.123	36%	0.357	C	S	.	.	S	Bend	trans	-72.7	100.9	178.9	-175.5	-98.2	0	0	0	111.5	R48 R50 H54 L62 E78 L80	R48-F52 WeakPolarHBondContact O-CB 3.37Å; R50-F52 VanDerWaalsContact C-N 3.34Å; R50-F52 PolarHBondContact O-N 3.4Å; F52-H54 HydrophobicContact CD1-CB 4.05Å; F52-H54 HydrophobicContact CE1-CB 4.15Å; F52-H54 PolarHBondContact O-N 3.02Å; F52-H54 PolarHBondContact O-ND1 3.1Å; F52-L62 HydrophobicContact CD1-CB 3.9Å; F52-L62 HydrophobicContact CD1-CD1 4.24Å; F52-L62 HydrophobicContact CE1-CB 4.04Å; F52-E78 HydrophobicContact CE2-CG 4.3Å; F52-E78 HydrophobicContact CZ-CG 4.39Å; F52-L80 HydrophobicContact CB-CD2 3.74Å; F52-L80 HydrophobicContact CD1-CB 3.65Å; F52-L80 HydrophobicContact CD1-CD2 4.23Å; F52-L80 HydrophobicContact CD2-CB 4.04Å; F52-L80 HydrophobicContact CD2-CD2 4.22Å; F52-L80 HydrophobicContact CE1-CB 3.66Å; F52-L80 HydrophobicContact CE2-CB 4.05Å; F52-L80 HydrophobicContact CG-CB 3.86Å; F52-L80 HydrophobicContact CG-CD2 3.8Å; F52-L80 HydrophobicContact CG-CG 4.38Å; F52-L80 HydrophobicContact CZ-CB 3.86Å
53	Q	94.4	Very high	90.7	Very high	156 Å²	156	72.3 Å²	72.3	73%	0.729	35%	0.346	S	S	*	.			trans	-58.3	107.8	178.7	-63.6	-177.4	3.4	0	0	112.2	D51 G64 S65	D51-Q53 PolarHBondContact O-N 3.4Å; Q53-G64 CarbonylContact O-C 3.6Å; Q53-G64 WeakPolarHBondContact O-CA 3.17Å; Q53-S65 PolarHBondContact O-N 2.66Å; Q53-S65 PolarHBondContact O-OG 2.93Å
54	H	93.4	Very high	91.3	Very high	80 Å²	80	71 Å²	71	37%	0.37	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	158.4	-179.3	66.8	-82	0	0	0	111.6	F52 L62 I63	F52-H54 HydrophobicContact CD1-CB 4.05Å; F52-H54 HydrophobicContact CE1-CB 4.15Å; F52-H54 PolarHBondContact O-N 3.02Å; F52-H54 PolarHBondContact O-ND1 3.1Å; H54-L62 HydrophobicContact CB-CB 3.97Å; H54-I63 WeakPolarHBondContact CA-O 3.15Å; H54-I63 VanDerWaalsContact CB-O 3.3Å; H54-I63 WeakPolarHBondContact CB-O 3.47Å
55	H	90.7	Very high	91.7	Very high	99 Å²	99	72 Å²	72	46%	0.458	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-9.7	-179.7	58.5	77.2	0	0	0	113.8	I63 G64 R77	H55-I63 PolarHBondContact CD2-O 3.27Å; H55-I63 VanDerWaalsContact CD2-O 3.22Å; H55-I63 PolarHBondContact N-O 3.36Å; H55-I63 VanDerWaalsContact N-O 3.09Å; H55-I63 PolarHBondContact NE2-O 3.49Å; H55-I63 VanDerWaalsContact NE2-O 3.16Å; H55-G64 PolarHBondContact CD2-O 2.65Å; H55-G64 PolarHBondContact NE2-O 3.28Å; H55-R77 WeakPolarHBondContact NE2-CD 3.35Å; H55-R77 PolarHBondContact NE2-NE 3.27Å
56	K	93.2	Very high	92.2	Very high	89 Å²	89	75.2 Å²	75.2	39%	0.387	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	149.6	179.1	-170.2	179	-177.7	-171.2	0	110	V58 I63 Y137	K56-V58 HydrophobicContact CD-CG2 3.82Å; K56-V58 HydrophobicContact CG-CG2 4.05Å; K56-I63 HydrophobicContact CB-CB 4.36Å; K56-I63 HydrophobicContact CB-CG1 4.28Å; K56-I63 PolarHBondContact O-N 3Å; K56-Y137 PolarHBondContact NZ-OH 2.91Å
57	R	95.4	Very high	92.8	Very high	143 Å²	143	71.3 Å²	71.3	54%	0.54	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.2	160.6	-178.8	173.3	174.7	173.8	-1.3	110	G59 Y61 L62	R57-G59 PolarHBondContact NE-O 3.18Å; R57-Y61 CarbonylContact C-O 3.45Å; R57-Y61 WeakPolarHBondContact CA-O 3.44Å; R57-L62 HydrophobicContact CB-CD2 4.09Å; R57-L62 HydrophobicContact CG-CD2 4.04Å
58	V	96.2	Very high	93.2	Very high	14 Å²	14	70.2 Å²	70.2	9%	0.085	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	114.8	173.1	-171	0	0	0	0	107.7	K56 N60 Y61 I63 L130 T132 Y137	K56-V58 HydrophobicContact CD-CG2 3.82Å; K56-V58 HydrophobicContact CG-CG2 4.05Å; V58-N60 PolarHBondContact O-N 2.92Å; V58-Y61 PolarHBondContact N-O 3.19Å; V58-Y61 PolarHBondContact O-N 2.96Å; V58-I63 HydrophobicContact CB-CD1 4.3Å; V58-I63 HydrophobicContact CG2-CD1 4.12Å; V58-I63 HydrophobicContact CG2-CG1 3.88Å; V58-L130 HydrophobicContact CG1-CB 4.39Å; V58-L130 HydrophobicContact CG1-CD1 3.97Å; V58-T132 HydrophobicContact CG1-CG2 4.33Å; V58-Y137 HydrophobicContact CG1-CD2 4.2Å; V58-Y137 HydrophobicContact CG1-CE2 3.99Å; V58-Y137 HydrophobicContact CG2-CE1 4.05Å; V58-Y137 HydrophobicContact CG2-CE2 4.32Å
59	G	95.4	Very high	93.2	Very high	48 Å²	48	68.3 Å²	68.3	50%	0.495	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	-124.9	-171.4	0	0	0	0	0	112	R57 Y61	R57-G59 PolarHBondContact NE-O 3.18Å; G59-Y61 VanDerWaalsContact C-N 3.31Å; G59-Y61 PolarHBondContact O-N 3.48Å
60	N	96.1	Very high	93.2	Very high	37 Å²	37	70.3 Å²	70.3	20%	0.198	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	12.1	179	-65.6	-18.7	0	0	0	114.1	V58 H81 V82 L83	V58-N60 PolarHBondContact O-N 2.92Å; N60-H81 WeakPolarHBondContact CB-NE2 3.49Å; N60-H81 WeakPolarHBondContact O-CA 3.41Å; N60-H81 PolarHBondContact O-CD2 3.36Å; N60-V82 WeakPolarHBondContact O-CB 3.46Å; N60-V82 WeakPolarHBondContact O-CG2 3.36Å; N60-V82 PolarHBondContact O-N 2.91Å; N60-L83 WeakPolarHBondContact ND2-CD1 3.06Å
61	Y	98	Very high	92.7	Very high	1 Å²	1	63.7 Å²	63.7	0%	0.004	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.9	-175	-51.1	-86.2	0	0	0	113.2	R57 V58 G59 L80 H81 V88 I90 D128 L130 V139 A376	R57-Y61 CarbonylContact C-O 3.45Å; R57-Y61 WeakPolarHBondContact CA-O 3.44Å; V58-Y61 PolarHBondContact N-O 3.19Å; V58-Y61 PolarHBondContact O-N 2.96Å; G59-Y61 VanDerWaalsContact C-N 3.31Å; G59-Y61 PolarHBondContact O-N 3.48Å; Y61-L80 WeakPolarHBondContact CA-O 3.44Å; Y61-H81 HydrophobicContact CD1-CB 3.86Å; Y61-H81 AromaticContact CD1-CD2 3.76Å; Y61-H81 HydrophobicContact CE1-CB 3.78Å; Y61-H81 AromaticContact CE1-CD2 3.29Å; Y61-H81 WeakPolarHBondContact CE1-CD2 3.24Å; Y61-H81 AromaticContact CE1-CG 3.75Å; Y61-H81 AromaticContact CZ-CD2 3.65Å; Y61-V88 HydrophobicContact CD1-CG2 3.9Å; Y61-V88 HydrophobicContact CE1-CG2 4.33Å; Y61-I90 HydrophobicContact CD1-CD1 4.45Å; Y61-I90 HydrophobicContact CG-CD1 4.26Å; Y61-D128 HydrophobicContact CE2-CB 4.26Å; Y61-D128 VanDerWaalsContact CE2-OD2 3.27Å; Y61-D128 WeakPolarHBondContact CE2-OD2 3.48Å; Y61-D128 VanDerWaalsContact OH-CB 3.29Å; Y61-D128 WeakPolarHBondContact OH-CB 3.37Å; Y61-D128 PolarHBondContact OH-OD2 3.07Å; Y61-L130 HydrophobicContact CD2-CD1 3.65Å; Y61-L130 HydrophobicContact CE2-CD1 3.83Å; Y61-V139 HydrophobicContact CD1-CG1 4.13Å; Y61-V139 HydrophobicContact CD2-CG2 4.23Å; Y61-V139 HydrophobicContact CE1-CG1 3.63Å; Y61-V139 HydrophobicContact CE1-CG2 4.43Å; Y61-V139 HydrophobicContact CE2-CG2 4.04Å; Y61-A376 WeakPolarHBondContact OH-CB 3.09Å
62	L	97.5	Very high	92	Very high	13 Å²	13	60.5 Å²	60.5	7%	0.068	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	121	164	-51.8	-177.2	0	0	0	108.1	F52 H54 R57 G64 G79 L80 V82	F52-L62 HydrophobicContact CD1-CB 3.9Å; F52-L62 HydrophobicContact CD1-CD1 4.24Å; F52-L62 HydrophobicContact CE1-CB 4.04Å; H54-L62 HydrophobicContact CB-CB 3.97Å; R57-L62 HydrophobicContact CB-CD2 4.09Å; R57-L62 HydrophobicContact CG-CD2 4.04Å; L62-G64 PolarHBondContact O-N 2.93Å; L62-G79 WeakPolarHBondContact O-CA 3.26Å; L62-L80 HydrophobicContact CB-CB 4.35Å; L62-L80 HydrophobicContact CD1-CD2 4.39Å; L62-L80 PolarHBondContact N-O 3.26Å; L62-L80 PolarHBondContact O-N 3.3Å; L62-V82 HydrophobicContact CD1-CG2 4.44Å; L62-V82 HydrophobicContact CD2-CG2 3.92Å; L62-V82 HydrophobicContact CG-CG2 3.81Å
63	I	96.6	Very high	91.4	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	104.4	-179.1	-44.3	-56.7	0	0	0	108.4	H54 H55 K56 V58 R77 I90	H54-I63 WeakPolarHBondContact CA-O 3.15Å; H54-I63 VanDerWaalsContact CB-O 3.3Å; H54-I63 WeakPolarHBondContact CB-O 3.47Å; H55-I63 PolarHBondContact CD2-O 3.27Å; H55-I63 VanDerWaalsContact CD2-O 3.22Å; H55-I63 PolarHBondContact N-O 3.36Å; H55-I63 VanDerWaalsContact N-O 3.09Å; H55-I63 PolarHBondContact NE2-O 3.49Å; H55-I63 VanDerWaalsContact NE2-O 3.16Å; K56-I63 HydrophobicContact CB-CB 4.36Å; K56-I63 HydrophobicContact CB-CG1 4.28Å; K56-I63 PolarHBondContact O-N 3Å; V58-I63 HydrophobicContact CB-CD1 4.3Å; V58-I63 HydrophobicContact CG2-CD1 4.12Å; V58-I63 HydrophobicContact CG2-CG1 3.88Å; I63-R77 HydrophobicContact CG2-CB 4.39Å; I63-I90 HydrophobicContact CD1-CD1 3.51Å; I63-I90 HydrophobicContact CD1-CG2 4.36Å
64	G	93.9	Very high	91.1	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	155.5	-170.8	0	0	0	0	0	114.6	Q53 H55 L62 R66 R77 E78	Q53-G64 CarbonylContact O-C 3.6Å; Q53-G64 WeakPolarHBondContact O-CA 3.17Å; H55-G64 PolarHBondContact CD2-O 2.65Å; H55-G64 PolarHBondContact NE2-O 3.28Å; L62-G64 PolarHBondContact O-N 2.93Å; G64-R66 VanDerWaalsContact C-N 3.32Å; G64-R77 WeakPolarHBondContact O-CD 3.31Å; G64-R77 PolarHBondContact O-NH1 3.1Å; G64-E78 WeakPolarHBondContact CA-O 3.45Å; G64-E78 PolarHBondContact N-O 3.44Å
65	S	92	Very high	91.1	Very high	58 Å²	58	54.1 Å²	54.1	41%	0.406	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	-28.4	177.6	-65.3	0	0	0	0	112.8	Q53 K67 R77	Q53-S65 PolarHBondContact O-N 2.66Å; Q53-S65 PolarHBondContact O-OG 2.93Å; S65-K67 PolarHBondContact O-N 3.14Å; S65-R77 PolarHBondContact O-NH1 3.28Å
66	R	93.4	Very high	91.3	Very high	122 Å²	122	51.1 Å²	51.1	46%	0.46	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	122.3	175.7	-166.9	-167	-174.9	-166.1	-1.3	111.6	G64 R77 E78	G64-R66 VanDerWaalsContact C-N 3.32Å; R66-R77 WeakPolarHBondContact O-CA 3.45Å; R66-E78 HydrophobicContact CB-CB 4.22Å; R66-E78 WeakPolarHBondContact CD-OE2 3.34Å; R66-E78 IonicContact CZ-OE2 3.57Å; R66-E78 IonicContact NE-OE2 3.55Å; R66-E78 IonicContact NH1-OE2 2.7Å; R66-E78 PolarHBondContact NH1-OE2 3.25Å; R66-E78 PolarHBondContact O-N 3.27Å
67	K	94	Very high	91.5	Very high	112 Å²	112	49.4 Å²	49.4	49%	0.487	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	136	167.3	-162.3	179.2	90.5	175.8	0	109	S65 E70	S65-K67 PolarHBondContact O-N 3.14Å; K67-E70 HydrophobicContact CD-CB 3.99Å; K67-E70 WeakPolarHBondContact CD-OE2 3.33Å; K67-E70 IonicContact NZ-OE2 2.73Å; K67-E70 PolarHBondContact NZ-OE2 3.31Å
68	L	92.1	Very high	91.5	Very high	65 Å²	65	43 Å²	43	34%	0.34	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-29.7	172.5	-61.5	177.8	0	0	0	111.7	V76 E78 A89 L142	L68-V76 HydrophobicContact CB-CB 4.31Å; L68-V76 HydrophobicContact CB-CG1 4.08Å; L68-V76 HydrophobicContact CD1-CG1 4.4Å; L68-V76 PolarHBondContact N-O 3.11Å; L68-E78 HydrophobicContact CD1-CB 4.24Å; L68-E78 HydrophobicContact CD2-CB 4.34Å; L68-E78 HydrophobicContact CG-CB 4.33Å; L68-A89 HydrophobicContact CD1-CB 4.26Å; L68-L142 HydrophobicContact CD1-CD1 3.63Å
69	G	87.9	Confident	91.6	Very high	25 Å²	25	42.3 Å²	42.3	26%	0.258	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	164.8	177.9	0	0	0	0	0	111.9	V76	G69-V76 PolarHBondContact N-O 3.44Å; G69-V76 PolarHBondContact O-N 3.33Å
70	E	85.9	Confident	91.7	Very high	85 Å²	85	40 Å²	40	40%	0.397	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	132.9	179.3	177.3	157.1	-155.1	0	0	111.5	K67 K75	K67-E70 HydrophobicContact CD-CB 3.99Å; K67-E70 WeakPolarHBondContact CD-OE2 3.33Å; K67-E70 IonicContact NZ-OE2 2.73Å; K67-E70 PolarHBondContact NZ-OE2 3.31Å; E70-K75 HydrophobicContact CG-CD 4.48Å; E70-K75 HydrophobicContact CG-CG 4.21Å; E70-K75 WeakPolarHBondContact OE1-CD 3.49Å; E70-K75 WeakPolarHBondContact OE1-CE 3.16Å; E70-K75 IonicContact OE1-NZ 2.68Å; E70-K75 PolarHBondContact OE1-NZ 3.34Å; E70-K75 IonicContact OE2-NZ 2.76Å
71	G	77.9	Confident	91.8	Very high	35 Å²	35	38.3 Å²	38.3	36%	0.361	20%	0.204	S	C	.	.			trans	-130.9	-174.4	176.6	0	0	0	0	0	112.4	F73 A74 R97	G71-F73 PolarHBondContact O-N 2.97Å; G71-F73 VanDerWaalsContact O-N 3.07Å; G71-A74 PolarHBondContact N-O 2.8Å; G71-R97 PolarHBondContact O-NH2 2.9Å
72	S	74.9	Confident	91.6	Very high	56 Å²	56	39.4 Å²	39.4	39%	0.392	21%	0.211	S	C	.	.	S	Bend	trans	-59.5	-26	-171.1	-46.5	0	0	0	0	114.8	R97	S72-R97 VanDerWaalsContact C-NH2 3.32Å; S72-R97 PolarHBondContact O-NH2 3.35Å
73	F	80	Confident	91.4	Very high	43 Å²	43	41.9 Å²	41.9	19%	0.189	22%	0.224	C	C	.	.	S	Bend	trans	-132.9	-10.5	-177.6	-52	-80.2	0	0	0	114.5	G71 D94 R97 D101 V104	G71-F73 PolarHBondContact O-N 2.97Å; G71-F73 VanDerWaalsContact O-N 3.07Å; F73-D94 PolarHBondContact O-N 2.91Å; F73-R97 HydrophobicContact CD1-CB 4.49Å; F73-D101 HydrophobicContact CE1-CB 3.82Å; F73-D101 HydrophobicContact CZ-CB 3.81Å; F73-D101 WeakPolarHBondContact CZ-OD2 3.34Å; F73-V104 HydrophobicContact CB-CG1 4.38Å; F73-V104 HydrophobicContact CD1-CG1 4.49Å; F73-V104 HydrophobicContact CD2-CG1 4.27Å; F73-V104 HydrophobicContact CD2-CG2 3.78Å; F73-V104 HydrophobicContact CE1-CG2 4.44Å; F73-V104 HydrophobicContact CE2-CG2 3.58Å; F73-V104 HydrophobicContact CG-CG1 4.12Å; F73-V104 HydrophobicContact CG-CG2 4.32Å; F73-V104 HydrophobicContact CZ-CG2 3.93Å
74	A	89.1	Confident	91.3	Very high	14 Å²	14	41.7 Å²	41.7	12%	0.116	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	153.1	-171.7	0	0	0	0	0	112.3	G71 K91 V92 I93	G71-A74 PolarHBondContact N-O 2.8Å; A74-K91 HydrophobicContact CB-CG 4.07Å; A74-V92 CarbonylContact C-O 3.5Å; A74-V92 VanDerWaalsContact CA-O 3.23Å; A74-V92 WeakPolarHBondContact CA-O 3.43Å; A74-I93 HydrophobicContact CB-CG1 4.03Å
75	K	93.2	Very high	91.3	Very high	73 Å²	73	41.7 Å²	41.7	32%	0.317	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.1	169.2	-51.5	-161.8	-170.3	-143	0	109.9	E70 V92	E70-K75 HydrophobicContact CG-CD 4.48Å; E70-K75 HydrophobicContact CG-CG 4.21Å; E70-K75 WeakPolarHBondContact OE1-CD 3.49Å; E70-K75 WeakPolarHBondContact OE1-CE 3.16Å; E70-K75 IonicContact OE1-NZ 2.68Å; E70-K75 PolarHBondContact OE1-NZ 3.34Å; E70-K75 IonicContact OE2-NZ 2.76Å; K75-V92 PolarHBondContact N-O 2.84Å; K75-V92 PolarHBondContact O-N 2.97Å
76	V	94.9	Very high	91.5	Very high	35 Å²	35	39.8 Å²	39.8	21%	0.212	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	133.8	174.4	-168	0	0	0	0	109.2	L68 G69 A89 I90 K91	L68-V76 HydrophobicContact CB-CB 4.31Å; L68-V76 HydrophobicContact CB-CG1 4.08Å; L68-V76 HydrophobicContact CD1-CG1 4.4Å; L68-V76 PolarHBondContact N-O 3.11Å; G69-V76 PolarHBondContact N-O 3.44Å; G69-V76 PolarHBondContact O-N 3.33Å; V76-A89 HydrophobicContact CG1-CB 4.32Å; V76-I90 WeakPolarHBondContact CA-O 3.36Å; V76-K91 HydrophobicContact CG2-CB 4.29Å; V76-K91 HydrophobicContact CG2-CG 4.12Å
77	R	96.1	Very high	91.6	Very high	54 Å²	54	36.1 Å²	36.1	20%	0.204	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.1	-178.9	-70.2	179.8	162.9	-76.6	0.6	111.7	H55 I63 G64 S65 R66 I90	H55-R77 WeakPolarHBondContact NE2-CD 3.35Å; H55-R77 PolarHBondContact NE2-NE 3.27Å; I63-R77 HydrophobicContact CG2-CB 4.39Å; G64-R77 WeakPolarHBondContact O-CD 3.31Å; G64-R77 PolarHBondContact O-NH1 3.1Å; S65-R77 PolarHBondContact O-NH1 3.28Å; R66-R77 WeakPolarHBondContact O-CA 3.45Å; R77-I90 PolarHBondContact N-O 3.46Å; R77-I90 PolarHBondContact O-N 3.26Å
78	E	96.9	Very high	91.8	Very high	7 Å²	7	30.8 Å²	30.8	3%	0.033	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.8	164.6	-172.5	172.4	154.3	0	0	107.1	F52 G64 R66 L68 K87 L142 R404	F52-E78 HydrophobicContact CE2-CG 4.3Å; F52-E78 HydrophobicContact CZ-CG 4.39Å; G64-E78 WeakPolarHBondContact CA-O 3.45Å; G64-E78 PolarHBondContact N-O 3.44Å; R66-E78 HydrophobicContact CB-CB 4.22Å; R66-E78 WeakPolarHBondContact CD-OE2 3.34Å; R66-E78 IonicContact CZ-OE2 3.57Å; R66-E78 IonicContact NE-OE2 3.55Å; R66-E78 IonicContact NH1-OE2 2.7Å; R66-E78 PolarHBondContact NH1-OE2 3.25Å; R66-E78 PolarHBondContact O-N 3.27Å; L68-E78 HydrophobicContact CD1-CB 4.24Å; L68-E78 HydrophobicContact CD2-CB 4.34Å; L68-E78 HydrophobicContact CG-CB 4.33Å; E78-K87 WeakPolarHBondContact OE1-CD 3.25Å; E78-K87 WeakPolarHBondContact OE1-CE 3.21Å; E78-K87 IonicContact OE1-NZ 2.7Å; E78-K87 PolarHBondContact OE1-NZ 3.07Å; E78-L142 HydrophobicContact CG-CD2 4.4Å; E78-R404 IonicContact OE1-NH2 3.91Å; E78-R404 PolarHBondContact OE1-NH2 3.25Å; E78-R404 IonicContact OE2-NH2 2.67Å; E78-R404 PolarHBondContact OE2-NH2 3.04Å
79	G	97.5	Very high	92	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	161.2	175.3	0	0	0	0	0	111.4	L62 K87 V88	L62-G79 WeakPolarHBondContact O-CA 3.26Å; G79-K87 WeakPolarHBondContact O-CA 3.45Å; G79-V88 PolarHBondContact N-O 2.85Å; G79-V88 PolarHBondContact O-N 3.02Å
80	L	97.6	Very high	92.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.8	176.5	-168.1	73.7	0	0	0	109.7	R48 L49 F52 Y61 L62 G85 K87	R48-L80 VanDerWaalsContact O-CD2 3.27Å; R48-L80 WeakPolarHBondContact O-CD2 3.19Å; L49-L80 HydrophobicContact CD2-CD2 3.9Å; F52-L80 HydrophobicContact CB-CD2 3.74Å; F52-L80 HydrophobicContact CD1-CB 3.65Å; F52-L80 HydrophobicContact CD1-CD2 4.23Å; F52-L80 HydrophobicContact CD2-CB 4.04Å; F52-L80 HydrophobicContact CD2-CD2 4.22Å; F52-L80 HydrophobicContact CE1-CB 3.66Å; F52-L80 HydrophobicContact CE2-CB 4.05Å; F52-L80 HydrophobicContact CG-CB 3.86Å; F52-L80 HydrophobicContact CG-CD2 3.8Å; F52-L80 HydrophobicContact CG-CG 4.38Å; F52-L80 HydrophobicContact CZ-CB 3.86Å; Y61-L80 WeakPolarHBondContact CA-O 3.44Å; L62-L80 HydrophobicContact CB-CB 4.35Å; L62-L80 HydrophobicContact CD1-CD2 4.39Å; L62-L80 PolarHBondContact N-O 3.26Å; L62-L80 PolarHBondContact O-N 3.3Å; L80-G85 WeakPolarHBondContact CD1-O 3.38Å; L80-K87 HydrophobicContact CD1-CG 4.02Å
81	H	97.6	Very high	93	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	117	175.1	-178.7	-119	0	0	0	110.4	N60 Y61 L83 T84 G85 E86 L380	N60-H81 WeakPolarHBondContact CB-NE2 3.49Å; N60-H81 WeakPolarHBondContact O-CA 3.41Å; N60-H81 PolarHBondContact O-CD2 3.36Å; Y61-H81 HydrophobicContact CD1-CB 3.86Å; Y61-H81 AromaticContact CD1-CD2 3.76Å; Y61-H81 HydrophobicContact CE1-CB 3.78Å; Y61-H81 AromaticContact CE1-CD2 3.29Å; Y61-H81 WeakPolarHBondContact CE1-CD2 3.24Å; Y61-H81 AromaticContact CE1-CG 3.75Å; Y61-H81 AromaticContact CZ-CD2 3.65Å; H81-L83 VanDerWaalsContact C-N 3.35Å; H81-L83 PolarHBondContact O-N 3.02Å; H81-T84 PolarHBondContact ND1-OG1 3Å; H81-T84 PolarHBondContact O-N 2.98Å; H81-G85 WeakPolarHBondContact O-CA 3.22Å; H81-G85 PolarHBondContact O-N 3.45Å; H81-E86 PolarHBondContact N-O 2.84Å; H81-L380 HydrophobicContact CB-CD1 3.77Å
82	V	95.6	Very high	93.8	Very high	25 Å²	25	23.2 Å²	23.2	15%	0.152	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-35.9	-167.2	175.4	0	0	0	0	112.7	L49 N60 L62	L49-V82 HydrophobicContact CD2-CB 4.48Å; L49-V82 HydrophobicContact CD2-CG1 4.31Å; N60-V82 WeakPolarHBondContact O-CB 3.46Å; N60-V82 WeakPolarHBondContact O-CG2 3.36Å; N60-V82 PolarHBondContact O-N 2.91Å; L62-V82 HydrophobicContact CD1-CG2 4.44Å; L62-V82 HydrophobicContact CD2-CG2 3.92Å; L62-V82 HydrophobicContact CG-CG2 3.81Å
83	L	93.3	Very high	94.6	Very high	64 Å²	64	21.1 Å²	21.1	34%	0.335	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-18.7	-174.4	-58.9	178.6	0	0	0	114.3	N60 H81 I377	N60-L83 WeakPolarHBondContact ND2-CD1 3.06Å; H81-L83 VanDerWaalsContact C-N 3.35Å; H81-L83 PolarHBondContact O-N 3.02Å; L83-I377 HydrophobicContact CD1-CD1 3.92Å; L83-I377 HydrophobicContact CD1-CG1 4.31Å
84	T	94.4	Very high	95.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-14.1	-178.3	60.5	0	0	0	0	113.6	V44 H81 E86 I377 L380 L381 K384	V44-T84 VanDerWaalsContact CG2-C 3.4Å; H81-T84 PolarHBondContact ND1-OG1 3Å; H81-T84 PolarHBondContact O-N 2.98Å; T84-E86 PolarHBondContact O-N 3.47Å; T84-E86 PolarHBondContact OG1-N 2.93Å; T84-I377 HydrophobicContact CG2-CG2 4.47Å; T84-L380 HydrophobicContact CG2-CB 4.2Å; T84-L381 HydrophobicContact CG2-CD2 3.77Å; T84-L381 HydrophobicContact CG2-CG 3.74Å; T84-K384 PolarHBondContact O-NZ 3Å; T84-K384 VanDerWaalsContact O-NZ 3.17Å
85	G	93.6	Very high	95.3	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.01	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	11.5	-173.2	0	0	0	0	0	113.4	R48 L80 H81	R48-G85 PolarHBondContact NE-O 2.9Å; R48-G85 PolarHBondContact NH2-O 2.92Å; L80-G85 WeakPolarHBondContact CD1-O 3.38Å; H81-G85 WeakPolarHBondContact O-CA 3.22Å; H81-G85 PolarHBondContact O-N 3.45Å
86	E	95	Very high	95.1	Very high	19 Å²	19	25 Å²	25	9%	0.089	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	151.1	-172.5	-75.6	-56	148.2	0	0	114.3	H81 T84 L380 K384 R387	H81-E86 PolarHBondContact N-O 2.84Å; T84-E86 PolarHBondContact O-N 3.47Å; T84-E86 PolarHBondContact OG1-N 2.93Å; E86-L380 HydrophobicContact CB-CB 4.04Å; E86-L380 HydrophobicContact CB-CD1 4.42Å; E86-L380 HydrophobicContact CB-CD2 3.8Å; E86-L380 HydrophobicContact CB-CG 4.3Å; E86-L380 HydrophobicContact CG-CB 4.29Å; E86-K384 HydrophobicContact CG-CB 4.49Å; E86-K384 HydrophobicContact CG-CD 4.26Å; E86-K384 WeakPolarHBondContact OE1-CD 3.09Å; E86-R387 IonicContact OE1-CZ 3.47Å; E86-R387 IonicContact OE1-NH1 3.37Å; E86-R387 IonicContact OE1-NH2 2.85Å; E86-R387 PolarHBondContact OE1-NH2 2.83Å; E86-R387 IonicContact OE2-CZ 2.69Å; E86-R387 IonicContact OE2-NH2 3.67Å; E86-R387 PolarHBondContact OE2-NH2 2.93Å
87	K	96.2	Very high	94.6	Very high	45 Å²	45	27 Å²	27	20%	0.196	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	139.5	-176.2	-64	-175.4	174.8	-161.9	0	111.6	E78 G79 L80 L142	E78-K87 WeakPolarHBondContact OE1-CD 3.25Å; E78-K87 WeakPolarHBondContact OE1-CE 3.21Å; E78-K87 IonicContact OE1-NZ 2.7Å; E78-K87 PolarHBondContact OE1-NZ 3.07Å; G79-K87 WeakPolarHBondContact O-CA 3.45Å; L80-K87 HydrophobicContact CD1-CG 4.02Å; K87-L142 HydrophobicContact CB-CD2 3.68Å; K87-L142 HydrophobicContact CD-CD2 4.26Å
88	V	97.7	Very high	94	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.2	-177.3	-70.2	0	0	0	0	111	Y61 G79 I90 L127 V139 M140 L380	Y61-V88 HydrophobicContact CD1-CG2 3.9Å; Y61-V88 HydrophobicContact CE1-CG2 4.33Å; G79-V88 PolarHBondContact N-O 2.85Å; G79-V88 PolarHBondContact O-N 3.02Å; V88-I90 HydrophobicContact CG2-CD1 3.88Å; V88-I90 HydrophobicContact CG2-CG1 3.81Å; V88-L127 HydrophobicContact CG1-CD1 3.88Å; V88-V139 HydrophobicContact CB-CG1 3.85Å; V88-V139 HydrophobicContact CG1-CG1 3.96Å; V88-V139 HydrophobicContact CG2-CG1 3.97Å; V88-M140 WeakPolarHBondContact CA-O 3.43Å; V88-M140 WeakPolarHBondContact CB-O 3.43Å; V88-L380 HydrophobicContact CG1-CD1 4Å; V88-L380 HydrophobicContact CG1-CD2 3.97Å
89	A	97.8	Very high	93.4	Very high	12 Å²	12	31.9 Å²	31.9	10%	0.099	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.3	165.4	0	0	0	0	0	108.9	L68 V76 M140 L142	L68-A89 HydrophobicContact CD1-CB 4.26Å; V76-A89 HydrophobicContact CG1-CB 4.32Å; A89-M140 HydrophobicContact CB-CB 4.44Å; A89-M140 PolarHBondContact N-O 3.16Å; A89-M140 PolarHBondContact O-N 2.87Å; A89-L142 HydrophobicContact CB-CD1 4.2Å
90	I	97.5	Very high	92.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.3	-178.1	-52.8	179.9	0	0	0	109.9	Y61 I63 V76 R77 V88 V92 Y137 L138 V139	Y61-I90 HydrophobicContact CD1-CD1 4.45Å; Y61-I90 HydrophobicContact CG-CD1 4.26Å; I63-I90 HydrophobicContact CD1-CD1 3.51Å; I63-I90 HydrophobicContact CD1-CG2 4.36Å; V76-I90 WeakPolarHBondContact CA-O 3.36Å; R77-I90 PolarHBondContact N-O 3.46Å; R77-I90 PolarHBondContact O-N 3.26Å; V88-I90 HydrophobicContact CG2-CD1 3.88Å; V88-I90 HydrophobicContact CG2-CG1 3.81Å; I90-V92 HydrophobicContact CG2-CG2 4.12Å; I90-V92 PolarHBondContact O-N 3Å; I90-Y137 HydrophobicContact CG2-CD1 3.99Å; I90-L138 WeakPolarHBondContact CA-O 3.14Å; I90-V139 HydrophobicContact CG1-CG1 4.37Å; I90-V139 HydrophobicContact CG1-CG2 4.32Å; I90-V139 HydrophobicContact CG2-CG2 4.41Å
91	K	95.8	Very high	91.9	Very high	13 Å²	13	40.3 Å²	40.3	6%	0.057	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	107.9	172.5	-167.7	-179.1	-156.3	-174.1	0	108.6	A74 V76 E111 Y137 L138 M140 D204	A74-K91 HydrophobicContact CB-CG 4.07Å; V76-K91 HydrophobicContact CG2-CB 4.29Å; V76-K91 HydrophobicContact CG2-CG 4.12Å; K91-E111 VanDerWaalsContact CD-OE1 3.23Å; K91-E111 WeakPolarHBondContact CD-OE1 3.39Å; K91-E111 WeakPolarHBondContact CE-OE1 3.4Å; K91-E111 IonicContact NZ-OE1 3.9Å; K91-E111 PolarHBondContact NZ-OE1 3.02Å; K91-E111 IonicContact NZ-OE2 3.77Å; K91-E111 PolarHBondContact NZ-OE2 3.39Å; K91-Y137 WeakPolarHBondContact O-CA 3.48Å; K91-L138 HydrophobicContact CB-CB 4.3Å; K91-L138 PolarHBondContact N-O 2.83Å; K91-L138 PolarHBondContact O-N 3.49Å; K91-M140 HydrophobicContact CB-CE 3.85Å; K91-D204 WeakPolarHBondContact CE-OD2 3.35Å; K91-D204 IonicContact NZ-OD1 2.69Å; K91-D204 PolarHBondContact NZ-OD1 3.04Å; K91-D204 IonicContact NZ-OD2 3.62Å; K91-D204 PolarHBondContact NZ-OD2 3Å
92	V	95.1	Very high	90.9	Very high	26 Å²	26	46 Å²	46	16%	0.158	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	110.1	179.3	-172.2	0	0	0	0	109	A74 K75 I90 Y137	A74-V92 CarbonylContact C-O 3.5Å; A74-V92 VanDerWaalsContact CA-O 3.23Å; A74-V92 WeakPolarHBondContact CA-O 3.43Å; K75-V92 PolarHBondContact N-O 2.84Å; K75-V92 PolarHBondContact O-N 2.97Å; I90-V92 HydrophobicContact CG2-CG2 4.12Å; I90-V92 PolarHBondContact O-N 3Å; V92-Y137 HydrophobicContact CB-CD1 4.27Å; V92-Y137 HydrophobicContact CB-CE1 4.19Å; V92-Y137 HydrophobicContact CG1-CD1 4.01Å; V92-Y137 HydrophobicContact CG1-CE1 3.55Å; V92-Y137 HydrophobicContact CG2-CD1 3.78Å; V92-Y137 HydrophobicContact CG2-CE1 3.74Å
93	I	92.9	Very high	90	Very high	12 Å²	12	47.4 Å²	47.4	6%	0.062	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.6	174.8	-42.3	-173.1	0	0	0	109.2	A74 L108 S135 Y136	A74-I93 HydrophobicContact CB-CG1 4.03Å; I93-L108 HydrophobicContact CB-CD1 4.14Å; I93-L108 HydrophobicContact CD1-CD1 4.29Å; I93-L108 HydrophobicContact CG2-CD1 3.63Å; I93-S135 VanDerWaalsContact O-CA 3.3Å; I93-S135 WeakPolarHBondContact O-CA 3.42Å; I93-Y136 HydrophobicContact CD1-CD1 4.25Å; I93-Y136 PolarHBondContact N-O 3.07Å; I93-Y136 PolarHBondContact O-N 2.82Å
94	D	91.6	Very high	89.1	Confident	52 Å²	52	45.7 Å²	45.7	28%	0.278	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	116.8	179.3	174	-22.1	0	0	0	109.7	F73 K96 R97 A98	F73-D94 PolarHBondContact O-N 2.91Å; D94-K96 VanDerWaalsContact C-N 3.33Å; D94-K96 PolarHBondContact O-N 3.34Å; D94-K96 WeakPolarHBondContact OD1-CA 3.21Å; D94-K96 WeakPolarHBondContact OD1-CB 3.44Å; D94-K96 PolarHBondContact OD1-N 3.26Å; D94-R97 HydrophobicContact CB-CB 3.97Å; D94-R97 HydrophobicContact CB-CG 4.12Å; D94-R97 PolarHBondContact O-N 2.88Å; D94-R97 PolarHBondContact OD1-N 2.96Å; D94-R97 WeakPolarHBondContact OD2-CD 3.45Å; D94-R97 VanDerWaalsContact OD2-CG 3.31Å; D94-R97 WeakPolarHBondContact OD2-CG 3.46Å; D94-A98 WeakPolarHBondContact O-CB 3.46Å; D94-A98 PolarHBondContact O-N 2.9Å
95	K	91.6	Very high	88.4	Confident	29 Å²	29	48.6 Å²	48.6	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-29.7	-178.2	-73.5	175.7	163.2	-175.3	0	113	K99 L108 E131 T132 E133 N134	K95-K99 WeakPolarHBondContact O-CB 3.43Å; K95-K99 VanDerWaalsContact O-CG 3.25Å; K95-K99 WeakPolarHBondContact O-CG 3.44Å; K95-K99 PolarHBondContact O-N 2.89Å; K95-L108 HydrophobicContact CG-CD2 4.04Å; K95-E131 WeakPolarHBondContact CE-OE1 3.49Å; K95-E131 VanDerWaalsContact NZ-CG 3.31Å; K95-E131 IonicContact NZ-OE1 3.98Å; K95-E131 PolarHBondContact NZ-OE1 3.01Å; K95-T132 WeakPolarHBondContact CE-O 3.27Å; K95-T132 PolarHBondContact NZ-O 2.84Å; K95-E133 WeakPolarHBondContact CD-O 3.4Å; K95-N134 WeakPolarHBondContact CB-O 3.43Å; K95-N134 PolarHBondContact N-O 3.02Å
96	K	88.8	Confident	87.7	Confident	129 Å²	129	57.3 Å²	57.3	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-75.6	-31.4	177.4	-73.5	173.5	168.6	161.7	0	111.2	D94 N134	D94-K96 VanDerWaalsContact C-N 3.33Å; D94-K96 PolarHBondContact O-N 3.34Å; D94-K96 WeakPolarHBondContact OD1-CA 3.21Å; D94-K96 WeakPolarHBondContact OD1-CB 3.44Å; D94-K96 PolarHBondContact OD1-N 3.26Å; K96-N134 WeakPolarHBondContact CE-OD1 3.3Å; K96-N134 PolarHBondContact NZ-OD1 3.33Å
97	R	85.3	Confident	86.9	Confident	79 Å²	79	57.7 Å²	57.7	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-72.2	-46.1	167.5	-72.9	173.1	65.6	179	0.7	111.8	G71 S72 F73 D94 K99 K100	G71-R97 PolarHBondContact O-NH2 2.9Å; S72-R97 VanDerWaalsContact C-NH2 3.32Å; S72-R97 PolarHBondContact O-NH2 3.35Å; F73-R97 HydrophobicContact CD1-CB 4.49Å; D94-R97 HydrophobicContact CB-CB 3.97Å; D94-R97 HydrophobicContact CB-CG 4.12Å; D94-R97 PolarHBondContact O-N 2.88Å; D94-R97 PolarHBondContact OD1-N 2.96Å; D94-R97 WeakPolarHBondContact OD2-CD 3.45Å; D94-R97 VanDerWaalsContact OD2-CG 3.31Å; D94-R97 WeakPolarHBondContact OD2-CG 3.46Å; R97-K99 VanDerWaalsContact C-N 3.33Å; R97-K99 PolarHBondContact O-N 3.05Å; R97-K100 WeakPolarHBondContact O-CB 3.39Å; R97-K100 PolarHBondContact O-N 2.63Å; R97-K100 VanDerWaalsContact O-N 3.12Å
98	A	83.3	Confident	86.3	Confident	2 Å²	2	56.7 Å²	56.7	2%	0.017	27%	0.271	C	S	.	.	H	α-helix	trans	-57.7	-42.6	177.8	0	0	0	0	0	112.2	D94 K100 D101 V104 T105 L108	D94-A98 WeakPolarHBondContact O-CB 3.46Å; D94-A98 PolarHBondContact O-N 2.9Å; A98-K100 PolarHBondContact O-N 2.88Å; A98-D101 CarbonylContact O-C 3.54Å; A98-D101 PolarHBondContact O-N 2.79Å; A98-V104 HydrophobicContact CB-CG1 3.88Å; A98-T105 PolarHBondContact O-OG1 3.23Å; A98-L108 HydrophobicContact CB-CD1 4.37Å
99	K	84.6	Confident	85.9	Confident	160 Å²	160	62.4 Å²	62.4	70%	0.696	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.3	176	-83.2	177	176.8	-173.3	0	115.2	K95 R97 D101 T105	K95-K99 WeakPolarHBondContact O-CB 3.43Å; K95-K99 VanDerWaalsContact O-CG 3.25Å; K95-K99 WeakPolarHBondContact O-CG 3.44Å; K95-K99 PolarHBondContact O-N 2.89Å; R97-K99 VanDerWaalsContact C-N 3.33Å; R97-K99 PolarHBondContact O-N 3.05Å; K99-D101 PolarHBondContact O-N 2.75Å; K99-T105 WeakPolarHBondContact CA-OG1 3.21Å
100	K	83.5	Confident	85.4	Confident	171 Å²	171	64.2 Å²	64.2	74%	0.743	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-1.2	173.5	-55.6	-170	-178.7	-169.6	0	113.5	R97 A98	R97-K100 WeakPolarHBondContact O-CB 3.39Å; R97-K100 PolarHBondContact O-N 2.63Å; R97-K100 VanDerWaalsContact O-N 3.12Å; A98-K100 PolarHBondContact O-N 2.88Å
101	D	78.4	Confident	85.1	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.043	30%	0.3	C	S	.	.			trans	-136	115.2	-179.5	-173.9	-49.3	0	0	0	109.5	F73 A98 K99 Y103 V104 T105 G669	F73-D101 HydrophobicContact CE1-CB 3.82Å; F73-D101 HydrophobicContact CZ-CB 3.81Å; F73-D101 WeakPolarHBondContact CZ-OD2 3.34Å; A98-D101 CarbonylContact O-C 3.54Å; A98-D101 PolarHBondContact O-N 2.79Å; K99-D101 PolarHBondContact O-N 2.75Å; D101-Y103 VanDerWaalsContact C-N 3.32Å; D101-Y103 PolarHBondContact O-N 2.83Å; D101-Y103 WeakPolarHBondContact OD1-CA 3.3Å; D101-Y103 WeakPolarHBondContact OD1-CB 3.34Å; D101-Y103 PolarHBondContact OD1-N 3.23Å; D101-V104 HydrophobicContact CB-CB 3.97Å; D101-V104 HydrophobicContact CB-CG2 3.93Å; D101-V104 VanDerWaalsContact CG-CG2 3.47Å; D101-V104 PolarHBondContact O-N 3.25Å; D101-V104 PolarHBondContact OD1-N 3.37Å; D101-T105 VanDerWaalsContact O-CB 3.31Å; D101-T105 WeakPolarHBondContact O-CB 3.31Å; D101-T105 PolarHBondContact O-N 3.31Å; D101-T105 PolarHBondContact O-OG1 3.31Å; D101-G669 WeakPolarHBondContact OD2-CA 3.36Å
102	T	78	Confident	84.9	Confident	118 Å²	118	64.2 Å²	64.2	72%	0.724	30%	0.297	S	S	*	.	H	α-helix	trans	-70.9	-27.2	-175.3	50.8	0	0	0	0	112.9	K106	T102-K106 WeakPolarHBondContact O-CG 3.2Å; T102-K106 PolarHBondContact O-N 3.01Å; T102-K106 VanDerWaalsContact O-N 3.17Å
103	Y	75.2	Confident	84.7	Confident	56 Å²	56	68.6 Å²	68.6	22%	0.22	32%	0.316	C	S	.	.	H	α-helix	trans	-72	-50.9	174.1	176.5	-90	0	0	0	109.8	D101 T105 K106 N107 L672	D101-Y103 VanDerWaalsContact C-N 3.32Å; D101-Y103 PolarHBondContact O-N 2.83Å; D101-Y103 WeakPolarHBondContact OD1-CA 3.3Å; D101-Y103 WeakPolarHBondContact OD1-CB 3.34Å; D101-Y103 PolarHBondContact OD1-N 3.23Å; Y103-T105 VanDerWaalsContact C-N 3.28Å; Y103-T105 PolarHBondContact O-N 3.15Å; Y103-K106 PolarHBondContact O-N 3.4Å; Y103-N107 WeakPolarHBondContact CD1-ND2 3.1Å; Y103-N107 VanDerWaalsContact CD2-ND2 3.25Å; Y103-N107 WeakPolarHBondContact CD2-ND2 3.46Å; Y103-N107 WeakPolarHBondContact CE1-ND2 3.35Å; Y103-N107 WeakPolarHBondContact CE2-ND2 3.33Å; Y103-N107 WeakPolarHBondContact O-CB 3.13Å; Y103-N107 PolarHBondContact O-N 2.84Å; Y103-N107 PolarHBondContact O-ND2 3.01Å; Y103-L672 HydrophobicContact CD2-CD1 4.32Å; Y103-L672 HydrophobicContact CG-CD1 4.43Å
104	V	75.5	Confident	84.6	Confident	27 Å²	27	68.2 Å²	68.2	16%	0.164	31%	0.314	C	S	.	.	H	α-helix	trans	-62.3	-37.7	178.4	-179.3	0	0	0	0	111	F73 A98 D101 N107 L108	F73-V104 HydrophobicContact CB-CG1 4.38Å; F73-V104 HydrophobicContact CD1-CG1 4.49Å; F73-V104 HydrophobicContact CD2-CG1 4.27Å; F73-V104 HydrophobicContact CD2-CG2 3.78Å; F73-V104 HydrophobicContact CE1-CG2 4.44Å; F73-V104 HydrophobicContact CE2-CG2 3.58Å; F73-V104 HydrophobicContact CG-CG1 4.12Å; F73-V104 HydrophobicContact CG-CG2 4.32Å; F73-V104 HydrophobicContact CZ-CG2 3.93Å; A98-V104 HydrophobicContact CB-CG1 3.88Å; D101-V104 HydrophobicContact CB-CB 3.97Å; D101-V104 HydrophobicContact CB-CG2 3.93Å; D101-V104 VanDerWaalsContact CG-CG2 3.47Å; D101-V104 PolarHBondContact O-N 3.25Å; D101-V104 PolarHBondContact OD1-N 3.37Å; V104-N107 CarbonylContact O-C 3.57Å; V104-N107 PolarHBondContact O-N 3.37Å; V104-L108 WeakPolarHBondContact O-CA 3.18Å; V104-L108 PolarHBondContact O-N 3.19Å
105	T	78.8	Confident	84.7	Confident	61 Å²	61	65.8 Å²	65.8	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-48.6	176.8	-59.7	0	0	0	0	112.3	A98 K99 D101 Y103 N107	A98-T105 PolarHBondContact O-OG1 3.23Å; K99-T105 WeakPolarHBondContact CA-OG1 3.21Å; D101-T105 VanDerWaalsContact O-CB 3.31Å; D101-T105 WeakPolarHBondContact O-CB 3.31Å; D101-T105 PolarHBondContact O-N 3.31Å; D101-T105 PolarHBondContact O-OG1 3.31Å; Y103-T105 VanDerWaalsContact C-N 3.28Å; Y103-T105 PolarHBondContact O-N 3.15Å; T105-N107 PolarHBondContact O-N 2.9Å
106	K	78.4	Confident	84.7	Confident	185 Å²	185	67.3 Å²	67.3	80%	0.804	31%	0.308	S	S	*	.	H	α-helix	trans	-62.4	-29.7	176.1	-75.6	-176.5	177.8	-171.1	0	112.5	T102 Y103	T102-K106 WeakPolarHBondContact O-CG 3.2Å; T102-K106 PolarHBondContact O-N 3.01Å; T102-K106 VanDerWaalsContact O-N 3.17Å; Y103-K106 PolarHBondContact O-N 3.4Å
107	N	79.8	Confident	84.8	Confident	27 Å²	27	65.6 Å²	65.6	14%	0.144	30%	0.303	C	S	.	.	H	α-helix	trans	-104.3	2.7	-170.5	-59.2	-24.8	0	0	0	114.1	Y103 V104 T105 R109 R110	Y103-N107 WeakPolarHBondContact CD1-ND2 3.1Å; Y103-N107 VanDerWaalsContact CD2-ND2 3.25Å; Y103-N107 WeakPolarHBondContact CD2-ND2 3.46Å; Y103-N107 WeakPolarHBondContact CE1-ND2 3.35Å; Y103-N107 WeakPolarHBondContact CE2-ND2 3.33Å; Y103-N107 WeakPolarHBondContact O-CB 3.13Å; Y103-N107 PolarHBondContact O-N 2.84Å; Y103-N107 PolarHBondContact O-ND2 3.01Å; V104-N107 CarbonylContact O-C 3.57Å; V104-N107 PolarHBondContact O-N 3.37Å; T105-N107 PolarHBondContact O-N 2.9Å; N107-R109 PolarHBondContact O-N 3.16Å; N107-R110 PolarHBondContact ND2-NH1 3.38Å; N107-R110 VanDerWaalsContact ND2-NH1 3.13Å; N107-R110 WeakPolarHBondContact O-CB 3.29Å; N107-R110 PolarHBondContact O-N 3.23Å; N107-R110 PolarHBondContact OD1-NH1 2.88Å; N107-R110 PolarHBondContact OD1-NH2 3.03Å
108	L	83.1	Confident	85.2	Confident	24 Å²	24	62 Å²	62	13%	0.126	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-34.1	-168.4	179.1	64.4	0	0	0	114.5	I93 K95 A98 V104 Y136	I93-L108 HydrophobicContact CB-CD1 4.14Å; I93-L108 HydrophobicContact CD1-CD1 4.29Å; I93-L108 HydrophobicContact CG2-CD1 3.63Å; K95-L108 HydrophobicContact CG-CD2 4.04Å; A98-L108 HydrophobicContact CB-CD1 4.37Å; V104-L108 WeakPolarHBondContact O-CA 3.18Å; V104-L108 PolarHBondContact O-N 3.19Å; L108-Y136 HydrophobicContact CD1-CD1 4.44Å; L108-Y136 HydrophobicContact CG-CD1 4.4Å; L108-Y136 WeakPolarHBondContact O-CE1 3.2Å
109	R	89.3	Confident	85.6	Confident	120 Å²	120	64.9 Å²	64.9	45%	0.453	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-7.4	-179.2	-55.8	-168	-173.2	96.3	-3.8	114.2	N107 E111 G112 Q113 E131 Y136	N107-R109 PolarHBondContact O-N 3.16Å; R109-E111 VanDerWaalsContact C-N 3.3Å; R109-E111 PolarHBondContact O-N 3.02Å; R109-G112 PolarHBondContact O-N 2.92Å; R109-Q113 WeakPolarHBondContact O-CB 3.2Å; R109-Q113 VanDerWaalsContact O-CG 3.26Å; R109-Q113 WeakPolarHBondContact O-CG 3.43Å; R109-Q113 PolarHBondContact O-N 3.4Å; R109-Q113 PolarHBondContact O-OE1 2.84Å; R109-E131 IonicContact CZ-OE1 2.68Å; R109-E131 IonicContact CZ-OE2 3.55Å; R109-E131 IonicContact NE-OE1 3.37Å; R109-E131 IonicContact NE-OE2 2.74Å; R109-E131 PolarHBondContact NE-OE2 3.34Å; R109-E131 VanDerWaalsContact NH2-CD 3.34Å; R109-E131 IonicContact NH2-OE1 3.61Å; R109-E131 PolarHBondContact NH2-OE1 3.12Å; R109-E131 IonicContact NH2-OE2 3.7Å; R109-E131 PolarHBondContact NH2-OE2 2.97Å; R109-E131 VanDerWaalsContact NH2-OE2 3.14Å; R109-Y136 HydrophobicContact CG-CE1 4.37Å; R109-Y136 HydrophobicContact CG-CE2 4.05Å
110	R	87.6	Confident	86.1	Confident	49 Å²	49	57.8 Å²	57.8	19%	0.185	27%	0.27	C	S	.	.	H	α-helix	trans	-57.3	-44.6	-177.7	-178.7	-172.8	-68	118.3	10.2	111.2	N107 G112 Q113 I114 S208	N107-R110 PolarHBondContact ND2-NH1 3.38Å; N107-R110 VanDerWaalsContact ND2-NH1 3.13Å; N107-R110 WeakPolarHBondContact O-CB 3.29Å; N107-R110 PolarHBondContact O-N 3.23Å; N107-R110 PolarHBondContact OD1-NH1 2.88Å; N107-R110 PolarHBondContact OD1-NH2 3.03Å; R110-G112 PolarHBondContact O-N 3.32Å; R110-Q113 PolarHBondContact O-N 2.91Å; R110-I114 HydrophobicContact CG-CD1 3.57Å; R110-I114 HydrophobicContact CG-CG1 3.98Å; R110-I114 WeakPolarHBondContact O-CB 3.46Å; R110-I114 WeakPolarHBondContact O-CG1 3.42Å; R110-I114 PolarHBondContact O-N 3.48Å; R110-S208 VanDerWaalsContact CD-O 3.26Å; R110-S208 WeakPolarHBondContact CD-O 3.24Å
111	E	89.8	Confident	86.6	Confident	13 Å²	13	52.4 Å²	52.4	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-55.6	-53.4	-178.5	-174.3	-179.3	167.9	0	0	111.4	K91 R109 Q113 I114 Q115 L138 F205	K91-E111 VanDerWaalsContact CD-OE1 3.23Å; K91-E111 WeakPolarHBondContact CD-OE1 3.39Å; K91-E111 WeakPolarHBondContact CE-OE1 3.4Å; K91-E111 IonicContact NZ-OE1 3.9Å; K91-E111 PolarHBondContact NZ-OE1 3.02Å; K91-E111 IonicContact NZ-OE2 3.77Å; K91-E111 PolarHBondContact NZ-OE2 3.39Å; R109-E111 VanDerWaalsContact C-N 3.3Å; R109-E111 PolarHBondContact O-N 3.02Å; E111-Q113 PolarHBondContact O-N 3.45Å; E111-I114 PolarHBondContact O-N 3.23Å; E111-Q115 VanDerWaalsContact O-CB 3.29Å; E111-Q115 WeakPolarHBondContact O-CB 3.29Å; E111-Q115 PolarHBondContact O-N 3.46Å; E111-L138 HydrophobicContact CB-CD1 4.1Å; E111-L138 HydrophobicContact CG-CD1 3.71Å; E111-F205 HydrophobicContact CG-CB 3.95Å
112	G	91.7	Very high	87.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-39	177	0	0	0	0	0	113.1	R109 R110 Q116	R109-G112 PolarHBondContact O-N 2.92Å; R110-G112 PolarHBondContact O-N 3.32Å; G112-Q116 WeakPolarHBondContact O-CB 3.3Å; G112-Q116 PolarHBondContact O-N 3.13Å
113	Q	91.1	Very high	88.3	Confident	119 Å²	119	47.1 Å²	47.1	56%	0.556	22%	0.22	S	C	*	.	H	α-helix	trans	-63.6	-44.9	177.4	-73.2	170	-43.9	0	0	112.4	R109 R110 E111 M117	R109-Q113 WeakPolarHBondContact O-CB 3.2Å; R109-Q113 VanDerWaalsContact O-CG 3.26Å; R109-Q113 WeakPolarHBondContact O-CG 3.43Å; R109-Q113 PolarHBondContact O-N 3.4Å; R109-Q113 PolarHBondContact O-OE1 2.84Å; R110-Q113 PolarHBondContact O-N 2.91Å; E111-Q113 PolarHBondContact O-N 3.45Å; Q113-M117 WeakPolarHBondContact O-CG 3.31Å
114	I	90.8	Very high	89.3	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-51.4	176.2	-70.4	-178	0	0	0	110	R110 E111 Q116 M117 V182 F205	R110-I114 HydrophobicContact CG-CD1 3.57Å; R110-I114 HydrophobicContact CG-CG1 3.98Å; R110-I114 WeakPolarHBondContact O-CB 3.46Å; R110-I114 WeakPolarHBondContact O-CG1 3.42Å; R110-I114 PolarHBondContact O-N 3.48Å; E111-I114 PolarHBondContact O-N 3.23Å; I114-Q116 VanDerWaalsContact C-N 3.29Å; I114-Q116 PolarHBondContact O-N 2.94Å; I114-M117 WeakPolarHBondContact O-CB 3.43Å; I114-M117 PolarHBondContact O-N 3.47Å; I114-V182 HydrophobicContact CG2-CG1 3.74Å; I114-V182 HydrophobicContact CG2-CG2 4.07Å; I114-F205 HydrophobicContact CG2-CB 4.49Å; I114-F205 HydrophobicContact CG2-CD1 4.03Å; I114-F205 HydrophobicContact CG2-CG 4.46Å
115	Q	93.3	Very high	90.3	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-65.9	-30.7	-174.7	-165.5	-177.6	1.1	0	0	112.5	E111 M117 I118 T124 L126 F205	E111-Q115 VanDerWaalsContact O-CB 3.29Å; E111-Q115 WeakPolarHBondContact O-CB 3.29Å; E111-Q115 PolarHBondContact O-N 3.46Å; Q115-M117 VanDerWaalsContact C-N 3.28Å; Q115-M117 PolarHBondContact O-N 3.41Å; Q115-I118 PolarHBondContact O-N 3Å; Q115-T124 PolarHBondContact NE2-O 3.01Å; Q115-L126 HydrophobicContact CB-CB 4.43Å; Q115-L126 HydrophobicContact CB-CD2 4.3Å; Q115-L126 HydrophobicContact CG-CB 3.9Å; Q115-F205 HydrophobicContact CB-CD2 3.92Å; Q115-F205 HydrophobicContact CB-CE2 4.46Å; Q115-F205 HydrophobicContact CB-CG 4.38Å; Q115-F205 HydrophobicContact CG-CD2 3.71Å; Q115-F205 HydrophobicContact CG-CE2 3.87Å
116	Q	93.1	Very high	91.2	Very high	61 Å²	61	41.5 Å²	41.5	29%	0.285	19%	0.19	S	C	.	.	H	α-helix	trans	-64.4	-29	172.2	-171.5	-171	-41.3	0	0	113	G112 I114 I118 L126 N369 A371	G112-Q116 WeakPolarHBondContact O-CB 3.3Å; G112-Q116 PolarHBondContact O-N 3.13Å; I114-Q116 VanDerWaalsContact C-N 3.29Å; I114-Q116 PolarHBondContact O-N 2.94Å; Q116-I118 PolarHBondContact O-N 3.41Å; Q116-L126 HydrophobicContact CB-CD2 4.17Å; Q116-N369 VanDerWaalsContact CG-O 3.3Å; Q116-N369 WeakPolarHBondContact CG-O 3.18Å; Q116-N369 PolarHBondContact O-ND2 3.05Å; Q116-A371 HydrophobicContact CG-CB 4.03Å
117	M	90.6	Very high	92.1	Very high	92 Å²	92	32.9 Å²	32.9	45%	0.453	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.6	177	-67.8	172.9	57.3	0	0	113.3	Q113 I114 Q115 N336	Q113-M117 WeakPolarHBondContact O-CG 3.31Å; I114-M117 WeakPolarHBondContact O-CB 3.43Å; I114-M117 PolarHBondContact O-N 3.47Å; Q115-M117 VanDerWaalsContact C-N 3.28Å; Q115-M117 PolarHBondContact O-N 3.41Å; M117-N336 WeakPolarHBondContact O-CB 3.42Å; M117-N336 PolarHBondContact O-OD1 3.1Å
118	I	92.4	Very high	93	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.015	15%	0.147	C	C	.	.			trans	-114.9	131.3	-168.7	-59	-60.2	0	0	0	111.7	Q115 Q116 I123 L177 A180 V182 N336 N369	Q115-I118 PolarHBondContact O-N 3Å; Q116-I118 PolarHBondContact O-N 3.41Å; I118-I123 HydrophobicContact CG2-CD1 3.6Å; I118-I123 HydrophobicContact CG2-CG2 4.17Å; I118-L177 HydrophobicContact CD1-CD2 3.88Å; I118-L177 HydrophobicContact CG1-CD2 3.8Å; I118-L177 HydrophobicContact CG2-CD2 4.01Å; I118-A180 HydrophobicContact CD1-CB 3.57Å; I118-V182 HydrophobicContact CD1-CG2 4.43Å; I118-N336 WeakPolarHBondContact CA-OD1 3.45Å; I118-N369 PolarHBondContact O-ND2 3.35Å
119	R	93.1	Very high	93.7	Very high	64 Å²	64	32.7 Å²	32.7	24%	0.242	15%	0.151	C	C	.	.			trans	-137	118.7	166.2	179.9	179.7	173.6	-110.1	1.7	109.8	H176 N336 R337	R119-H176 PolarHBondContact O-CE1 2.92Å; R119-H176 VanDerWaalsContact O-CE1 3.29Å; R119-H176 PolarHBondContact O-NE2 2.83Å; R119-N336 PolarHBondContact N-OD1 2.89Å; R119-R337 PolarHBondContact NH1-O 3.01Å
120	H	94.9	Very high	94	Very high	10 Å²	10	28.7 Å²	28.7	5%	0.046	14%	0.138	C	C	.	.			trans	-155.4	140.8	-179.9	179.4	-84.9	0	0	0	108.7	N122 I123 S172 A173 H176 Y334	H120-N122 VanDerWaalsContact C-N 3.28Å; H120-N122 PolarHBondContact ND1-N 3.33Å; H120-N122 PolarHBondContact O-N 2.96Å; H120-I123 HydrophobicContact CB-CB 4.17Å; H120-I123 HydrophobicContact CB-CD1 3.89Å; H120-I123 HydrophobicContact CB-CG1 3.98Å; H120-I123 PolarHBondContact O-N 3.06Å; H120-I123 VanDerWaalsContact O-O 3.13Å; H120-S172 PolarHBondContact CE1-OG 3.27Å; H120-S172 PolarHBondContact NE2-O 2.88Å; H120-S172 PolarHBondContact NE2-OG 2.79Å; H120-A173 VanDerWaalsContact CE1-CA 3.48Å; H120-A173 WeakPolarHBondContact CE1-CA 3.32Å; H120-A173 PolarHBondContact CE1-N 2.63Å; H120-H176 AromaticContact CD2-CG 3.66Å; H120-H176 AromaticContact CD2-ND1 3.86Å; H120-Y334 AromaticContact CD2-CD2 3.28Å; H120-Y334 WeakPolarHBondContact CD2-CD2 3.38Å; H120-Y334 AromaticContact CD2-CE2 3.88Å; H120-Y334 AromaticContact CD2-CG 3.72Å; H120-Y334 AromaticContact NE2-CD2 3.35Å; H120-Y334 VanDerWaalsContact NE2-CD2 3.35Å; H120-Y334 WeakPolarHBondContact NE2-CD2 3.41Å; H120-Y334 AromaticContact NE2-CE2 3.45Å; H120-Y334 WeakPolarHBondContact NE2-CE2 3.26Å
121	P	94.3	Very high	94.4	Very high	58 Å²	58	30.4 Å²	30.4	38%	0.377	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-36	-174	22.4	-34.9	0	0	0	113.7	I123 K201 Y334	P121-I123 VanDerWaalsContact C-N 3.35Å; P121-K201 WeakPolarHBondContact O-CD 3.2Å; P121-K201 VanDerWaalsContact O-CE 3.25Å; P121-K201 WeakPolarHBondContact O-CE 3.43Å; P121-K201 PolarHBondContact O-NZ 3.5Å; P121-Y334 VanDerWaalsContact CD-CD1 3.46Å; P121-Y334 HydrophobicContact CG-CD1 3.98Å; P121-Y334 HydrophobicContact CG-CE1 3.49Å; P121-Y334 VanDerWaalsContact CG-CE1 3.49Å; P121-Y334 HydrophobicContact CG-CE2 4.33Å
122	N	96.3	Very high	94.6	Very high	11 Å²	11	31.9 Å²	31.9	6%	0.059	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	15.4	178.4	-56.4	110.1	0	0	0	114.9	H120 Q169 A173 I200 L202	H120-N122 VanDerWaalsContact C-N 3.28Å; H120-N122 PolarHBondContact ND1-N 3.33Å; H120-N122 PolarHBondContact O-N 2.96Å; N122-Q169 HydrophobicContact CB-CB 4.32Å; N122-A173 HydrophobicContact CB-CB 4.26Å; N122-I200 WeakPolarHBondContact CA-O 3.48Å; N122-I200 HydrophobicContact CB-CG2 4.48Å; N122-I200 VanDerWaalsContact CB-O 3.3Å; N122-I200 WeakPolarHBondContact CB-O 3.11Å; N122-I200 PolarHBondContact ND2-O 2.95Å; N122-L202 PolarHBondContact O-N 2.75Å
123	I	96.2	Very high	94.7	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.026	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-116.1	141.7	169.8	-62	180	0	0	0	107.8	I118 H120 P121 Q125 A173 L177 L202 F205	I118-I123 HydrophobicContact CG2-CD1 3.6Å; I118-I123 HydrophobicContact CG2-CG2 4.17Å; H120-I123 HydrophobicContact CB-CB 4.17Å; H120-I123 HydrophobicContact CB-CD1 3.89Å; H120-I123 HydrophobicContact CB-CG1 3.98Å; H120-I123 PolarHBondContact O-N 3.06Å; H120-I123 VanDerWaalsContact O-O 3.13Å; P121-I123 VanDerWaalsContact C-N 3.35Å; I123-Q125 PolarHBondContact O-N 2.73Å; I123-A173 HydrophobicContact CD1-CB 4.12Å; I123-A173 HydrophobicContact CG1-CB 3.76Å; I123-L177 HydrophobicContact CD1-CD1 4.13Å; I123-L177 HydrophobicContact CD1-CD2 3.94Å; I123-L177 HydrophobicContact CD1-CG 3.81Å; I123-L202 HydrophobicContact CG1-CB 4.38Å; I123-L202 HydrophobicContact CG1-CD2 4.5Å; I123-F205 HydrophobicContact CG2-CE2 3.79Å; I123-F205 HydrophobicContact CG2-CZ 3.62Å
124	T	95.7	Very high	94.7	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.025	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-68.4	117.6	178.7	-58.3	0	0	0	0	110.7	Q115 L126 M140 E141 L202 I203	Q115-T124 PolarHBondContact NE2-O 3.01Å; T124-L126 PolarHBondContact O-N 2.89Å; T124-M140 HydrophobicContact CG2-CB 3.8Å; T124-M140 HydrophobicContact CG2-CG 4.28Å; T124-M140 HydrophobicContact CG2-SD 4.24Å; T124-E141 HydrophobicContact CG2-CG 3.84Å; T124-L202 WeakPolarHBondContact CB-O 3.27Å; T124-L202 PolarHBondContact N-O 3.28Å; T124-L202 PolarHBondContact OG1-O 2.85Å; T124-I203 HydrophobicContact CG2-CG2 4.31Å; T124-I203 WeakPolarHBondContact OG1-CG2 3.45Å
125	Q	95.8	Very high	94.9	Very high	19 Å²	19	36.9 Å²	36.9	9%	0.089	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-63.4	128.8	178.3	179	70.2	49.6	0	0	111.2	I123 L127 M140 E141 N369 F379	I123-Q125 PolarHBondContact O-N 2.73Å; Q125-L127 HydrophobicContact CG-CD2 3.83Å; Q125-M140 WeakPolarHBondContact O-CA 3.12Å; Q125-E141 PolarHBondContact N-OE1 2.9Å; Q125-E141 PolarHBondContact O-N 3.31Å; Q125-E141 VanDerWaalsContact O-N 3.13Å; Q125-N369 PolarHBondContact NE2-OD1 2.96Å; Q125-F379 HydrophobicContact CG-CD2 4.29Å; Q125-F379 HydrophobicContact CG-CE2 4.15Å; Q125-F379 HydrophobicContact CG-CZ 4.31Å
126	L	97.5	Very high	95	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	127.8	165.1	-173.6	70.4	0	0	0	109.1	Q115 Q116 T124 I129 L138 V139 M140 A371	Q115-L126 HydrophobicContact CB-CB 4.43Å; Q115-L126 HydrophobicContact CB-CD2 4.3Å; Q115-L126 HydrophobicContact CG-CB 3.9Å; Q116-L126 HydrophobicContact CB-CD2 4.17Å; T124-L126 PolarHBondContact O-N 2.89Å; L126-I129 HydrophobicContact CD2-CD1 3.87Å; L126-I129 HydrophobicContact CD2-CG1 3.91Å; L126-I129 HydrophobicContact CG-CG1 4.47Å; L126-L138 HydrophobicContact CD1-CB 3.85Å; L126-L138 HydrophobicContact CD1-CD2 4.18Å; L126-L138 HydrophobicContact CD1-CG 4.5Å; L126-V139 WeakPolarHBondContact CD1-O 3.26Å; L126-M140 HydrophobicContact CD1-CG 3.97Å; L126-A371 HydrophobicContact CD2-CB 3.82Å; L126-A371 HydrophobicContact CG-CB 3.94Å
127	L	97.8	Very high	95.2	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	-47.7	-173.3	-61.4	173.9	0	0	0	111.5	V88 Q125 V139 C372 A376 F379 L380	V88-L127 HydrophobicContact CG1-CD1 3.88Å; Q125-L127 HydrophobicContact CG-CD2 3.83Å; L127-V139 HydrophobicContact CB-CG1 4.4Å; L127-V139 PolarHBondContact N-O 2.97Å; L127-C372 PolarHBondContact O-N 2.89Å; L127-C372 VanDerWaalsContact O-N 3.11Å; L127-C372 VanDerWaalsContact O-O 3.07Å; L127-A376 HydrophobicContact CB-CB 3.86Å; L127-F379 HydrophobicContact CD2-CB 3.67Å; L127-F379 HydrophobicContact CD2-CD2 4.1Å; L127-F379 HydrophobicContact CD2-CG 4.13Å; L127-L380 HydrophobicContact CD1-CD1 4.43Å; L127-L380 HydrophobicContact CD1-CD2 3.99Å; L127-L380 HydrophobicContact CD1-CG 4.22Å
128	D	98.1	Very high	95.5	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.027	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	152	-174.8	-158.8	-7.7	0	0	0	111.1	Y61 V139 C372 H373 A376	Y61-D128 HydrophobicContact CE2-CB 4.26Å; Y61-D128 VanDerWaalsContact CE2-OD2 3.27Å; Y61-D128 WeakPolarHBondContact CE2-OD2 3.48Å; Y61-D128 VanDerWaalsContact OH-CB 3.29Å; Y61-D128 WeakPolarHBondContact OH-CB 3.37Å; Y61-D128 PolarHBondContact OH-OD2 3.07Å; D128-V139 HydrophobicContact CB-CB 3.91Å; D128-V139 HydrophobicContact CB-CG2 4.08Å; D128-V139 PolarHBondContact N-O 3.3Å; D128-V139 PolarHBondContact O-N 2.8Å; D128-C372 VanDerWaalsContact CG-C 3.45Å; D128-C372 VanDerWaalsContact OD1-C 3.32Å; D128-C372 WeakPolarHBondContact OD1-CA 3.12Å; D128-H373 VanDerWaalsContact CG-N 3.32Å; D128-H373 PolarHBondContact OD1-N 2.93Å; D128-H373 WeakPolarHBondContact OD2-CA 3.23Å; D128-H373 PolarHBondContact OD2-N 3.38Å; D128-A376 HydrophobicContact CB-CB 4.22Å
129	I	97.6	Very high	95.8	Very high	42 Å²	42	30.2 Å²	30.2	22%	0.215	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	113	175.4	-58.8	177.5	0	0	0	107.5	L126 Y136 Y137 L138 A371	L126-I129 HydrophobicContact CD2-CD1 3.87Å; L126-I129 HydrophobicContact CD2-CG1 3.91Å; L126-I129 HydrophobicContact CG-CG1 4.47Å; I129-Y136 HydrophobicContact CG2-CD2 4.44Å; I129-Y136 HydrophobicContact CG2-CE2 3.49Å; I129-Y136 VanDerWaalsContact CG2-CE2 3.49Å; I129-Y136 WeakPolarHBondContact CG2-OH 3.41Å; I129-Y137 WeakPolarHBondContact CA-O 3.29Å; I129-L138 HydrophobicContact CD1-CD2 4.43Å; I129-L138 HydrophobicContact CG1-CD2 3.98Å; I129-L138 HydrophobicContact CG2-CD2 4.29Å; I129-A371 HydrophobicContact CD1-CB 4.09Å; I129-A371 HydrophobicContact CG1-CB 3.92Å
130	L	97.1	Very high	96	Very high	36 Å²	36	27.8 Å²	27.8	19%	0.188	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.8	177.3	-54.5	175.4	0	0	0	110	V58 Y61 Y137	V58-L130 HydrophobicContact CG1-CB 4.39Å; V58-L130 HydrophobicContact CG1-CD1 3.97Å; Y61-L130 HydrophobicContact CD2-CD1 3.65Å; Y61-L130 HydrophobicContact CE2-CD1 3.83Å; L130-Y137 HydrophobicContact CB-CD2 4.36Å; L130-Y137 PolarHBondContact N-O 3.41Å; L130-Y137 WeakPolarHBondContact O-CB 3.46Å; L130-Y137 WeakPolarHBondContact O-CD2 3.29Å; L130-Y137 PolarHBondContact O-N 2.73Å
131	E	95.5	Very high	96.1	Very high	85 Å²	85	28.2 Å²	28.2	40%	0.397	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.4	176.6	-168.1	168.1	152.5	0	0	110.9	K95 R109 Y136	K95-E131 WeakPolarHBondContact CE-OE1 3.49Å; K95-E131 VanDerWaalsContact NZ-CG 3.31Å; K95-E131 IonicContact NZ-OE1 3.98Å; K95-E131 PolarHBondContact NZ-OE1 3.01Å; R109-E131 IonicContact CZ-OE1 2.68Å; R109-E131 IonicContact CZ-OE2 3.55Å; R109-E131 IonicContact NE-OE1 3.37Å; R109-E131 IonicContact NE-OE2 2.74Å; R109-E131 PolarHBondContact NE-OE2 3.34Å; R109-E131 VanDerWaalsContact NH2-CD 3.34Å; R109-E131 IonicContact NH2-OE1 3.61Å; R109-E131 PolarHBondContact NH2-OE1 3.12Å; R109-E131 IonicContact NH2-OE2 3.7Å; R109-E131 PolarHBondContact NH2-OE2 2.97Å; R109-E131 VanDerWaalsContact NH2-OE2 3.14Å; E131-Y136 HydrophobicContact CB-CD2 4.01Å; E131-Y136 HydrophobicContact CB-CE2 4.48Å; E131-Y136 HydrophobicContact CG-CD2 3.95Å
132	T	94.6	Very high	96.1	Very high	44 Å²	44	27 Å²	27	27%	0.27	14%	0.136	S	C	.	.			trans	-122.9	166.3	172.4	63.2	0	0	0	0	109	V58 K95 N134 S135 Y137	V58-T132 HydrophobicContact CG1-CG2 4.33Å; K95-T132 WeakPolarHBondContact CE-O 3.27Å; K95-T132 PolarHBondContact NZ-O 2.84Å; T132-N134 PolarHBondContact O-N 3.18Å; T132-N134 VanDerWaalsContact O-N 3.17Å; T132-S135 PolarHBondContact N-O 3.07Å; T132-S135 PolarHBondContact O-N 2.9Å; T132-S135 PolarHBondContact OG1-N 2.8Å; T132-S135 VanDerWaalsContact OG1-N 3.08Å; T132-S135 PolarHBondContact OG1-O 3.33Å; T132-Y137 HydrophobicContact CG2-CE2 3.92Å
133	E	92.9	Very high	96.1	Very high	158 Å²	158	27 Å²	27	74%	0.738	14%	0.137	S	C	*	.	S	Bend	trans	-49.3	-43	176.4	-168.9	-136.1	163.5	0	0	112.6	K95	K95-E133 WeakPolarHBondContact CD-O 3.4Å
134	N	92.4	Very high	95.8	Very high	53 Å²	53	30.6 Å²	30.6	28%	0.283	16%	0.161	S	C	.	.	S	Bend	trans	-101	-16	-171.5	-68.9	-81	0	0	0	115	K95 K96 T132	K95-N134 WeakPolarHBondContact CB-O 3.43Å; K95-N134 PolarHBondContact N-O 3.02Å; K96-N134 WeakPolarHBondContact CE-OD1 3.3Å; K96-N134 PolarHBondContact NZ-OD1 3.33Å; T132-N134 PolarHBondContact O-N 3.18Å; T132-N134 VanDerWaalsContact O-N 3.17Å
135	S	94.7	Very high	95.6	Very high	18 Å²	18	32.5 Å²	32.5	13%	0.126	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	147.9	-174.9	-54.8	0	0	0	0	113	I93 T132	I93-S135 VanDerWaalsContact O-CA 3.3Å; I93-S135 WeakPolarHBondContact O-CA 3.42Å; T132-S135 PolarHBondContact N-O 3.07Å; T132-S135 PolarHBondContact O-N 2.9Å; T132-S135 PolarHBondContact OG1-N 2.8Å; T132-S135 VanDerWaalsContact OG1-N 3.08Å; T132-S135 PolarHBondContact OG1-O 3.33Å
136	Y	95.4	Very high	95.3	Very high	7 Å²	7	33 Å²	33	3%	0.027	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.1	172.1	-174.3	-115.9	0	0	0	108.2	I93 L108 R109 I129 E131 L138	I93-Y136 HydrophobicContact CD1-CD1 4.25Å; I93-Y136 PolarHBondContact N-O 3.07Å; I93-Y136 PolarHBondContact O-N 2.82Å; L108-Y136 HydrophobicContact CD1-CD1 4.44Å; L108-Y136 HydrophobicContact CG-CD1 4.4Å; L108-Y136 WeakPolarHBondContact O-CE1 3.2Å; R109-Y136 HydrophobicContact CG-CE1 4.37Å; R109-Y136 HydrophobicContact CG-CE2 4.05Å; I129-Y136 HydrophobicContact CG2-CD2 4.44Å; I129-Y136 HydrophobicContact CG2-CE2 3.49Å; I129-Y136 VanDerWaalsContact CG2-CE2 3.49Å; I129-Y136 WeakPolarHBondContact CG2-OH 3.41Å; E131-Y136 HydrophobicContact CB-CD2 4.01Å; E131-Y136 HydrophobicContact CB-CE2 4.48Å; E131-Y136 HydrophobicContact CG-CD2 3.95Å; Y136-L138 HydrophobicContact CD1-CD2 4.49Å; Y136-L138 HydrophobicContact CE1-CD2 3.75Å; Y136-L138 HydrophobicContact CE1-CG 4.26Å
137	Y	96.8	Very high	94.9	Very high	8 Å²	8	34.1 Å²	34.1	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.2	-171.1	-62.2	-95.6	0	0	0	109.8	K56 V58 I90 K91 V92 I129 L130 T132	K56-Y137 PolarHBondContact NZ-OH 2.91Å; V58-Y137 HydrophobicContact CG1-CD2 4.2Å; V58-Y137 HydrophobicContact CG1-CE2 3.99Å; V58-Y137 HydrophobicContact CG2-CE1 4.05Å; V58-Y137 HydrophobicContact CG2-CE2 4.32Å; I90-Y137 HydrophobicContact CG2-CD1 3.99Å; K91-Y137 WeakPolarHBondContact O-CA 3.48Å; V92-Y137 HydrophobicContact CB-CD1 4.27Å; V92-Y137 HydrophobicContact CB-CE1 4.19Å; V92-Y137 HydrophobicContact CG1-CD1 4.01Å; V92-Y137 HydrophobicContact CG1-CE1 3.55Å; V92-Y137 HydrophobicContact CG2-CD1 3.78Å; V92-Y137 HydrophobicContact CG2-CE1 3.74Å; I129-Y137 WeakPolarHBondContact CA-O 3.29Å; L130-Y137 HydrophobicContact CB-CD2 4.36Å; L130-Y137 PolarHBondContact N-O 3.41Å; L130-Y137 WeakPolarHBondContact O-CB 3.46Å; L130-Y137 WeakPolarHBondContact O-CD2 3.29Å; L130-Y137 PolarHBondContact O-N 2.73Å; T132-Y137 HydrophobicContact CG2-CE2 3.92Å
138	L	97.5	Very high	94.6	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.1	167	-57.1	178.4	0	0	0	108.3	I90 K91 E111 L126 I129 Y136	I90-L138 WeakPolarHBondContact CA-O 3.14Å; K91-L138 HydrophobicContact CB-CB 4.3Å; K91-L138 PolarHBondContact N-O 2.83Å; K91-L138 PolarHBondContact O-N 3.49Å; E111-L138 HydrophobicContact CB-CD1 4.1Å; E111-L138 HydrophobicContact CG-CD1 3.71Å; L126-L138 HydrophobicContact CD1-CB 3.85Å; L126-L138 HydrophobicContact CD1-CD2 4.18Å; L126-L138 HydrophobicContact CD1-CG 4.5Å; I129-L138 HydrophobicContact CD1-CD2 4.43Å; I129-L138 HydrophobicContact CG1-CD2 3.98Å; I129-L138 HydrophobicContact CG2-CD2 4.29Å; Y136-L138 HydrophobicContact CD1-CD2 4.49Å; Y136-L138 HydrophobicContact CE1-CD2 3.75Å; Y136-L138 HydrophobicContact CE1-CG 4.26Å
139	V	98.2	Very high	94.3	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.7	176.7	-176.4	0	0	0	0	108.5	Y61 V88 I90 L126 L127 D128	Y61-V139 HydrophobicContact CD1-CG1 4.13Å; Y61-V139 HydrophobicContact CD2-CG2 4.23Å; Y61-V139 HydrophobicContact CE1-CG1 3.63Å; Y61-V139 HydrophobicContact CE1-CG2 4.43Å; Y61-V139 HydrophobicContact CE2-CG2 4.04Å; V88-V139 HydrophobicContact CB-CG1 3.85Å; V88-V139 HydrophobicContact CG1-CG1 3.96Å; V88-V139 HydrophobicContact CG2-CG1 3.97Å; I90-V139 HydrophobicContact CG1-CG1 4.37Å; I90-V139 HydrophobicContact CG1-CG2 4.32Å; I90-V139 HydrophobicContact CG2-CG2 4.41Å; L126-V139 WeakPolarHBondContact CD1-O 3.26Å; L127-V139 HydrophobicContact CB-CG1 4.4Å; L127-V139 PolarHBondContact N-O 2.97Å; D128-V139 HydrophobicContact CB-CB 3.91Å; D128-V139 HydrophobicContact CB-CG2 4.08Å; D128-V139 PolarHBondContact N-O 3.3Å; D128-V139 PolarHBondContact O-N 2.8Å
140	M	97.6	Very high	93.9	Very high	13 Å²	13	35.8 Å²	35.8	6%	0.064	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	161.8	-173.2	-68.5	174.4	-69.5	0	0	110.6	V88 A89 K91 T124 Q125 L126	V88-M140 WeakPolarHBondContact CA-O 3.43Å; V88-M140 WeakPolarHBondContact CB-O 3.43Å; A89-M140 HydrophobicContact CB-CB 4.44Å; A89-M140 PolarHBondContact N-O 3.16Å; A89-M140 PolarHBondContact O-N 2.87Å; K91-M140 HydrophobicContact CB-CE 3.85Å; T124-M140 HydrophobicContact CG2-CB 3.8Å; T124-M140 HydrophobicContact CG2-CG 4.28Å; T124-M140 HydrophobicContact CG2-SD 4.24Å; Q125-M140 WeakPolarHBondContact O-CA 3.12Å; L126-M140 HydrophobicContact CD1-CG 3.97Å
141	E	95.4	Very high	93.7	Very high	19 Å²	19	36.2 Å²	36.2	9%	0.089	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	148.6	168.2	71.5	175	132.2	0	0	111.2	T124 Q125 K201 K383	T124-E141 HydrophobicContact CG2-CG 3.84Å; Q125-E141 PolarHBondContact N-OE1 2.9Å; Q125-E141 PolarHBondContact O-N 3.31Å; Q125-E141 VanDerWaalsContact O-N 3.13Å; E141-K201 WeakPolarHBondContact OE1-CE 3.45Å; E141-K201 IonicContact OE1-NZ 3.36Å; E141-K201 PolarHBondContact OE1-NZ 3.22Å; E141-K201 IonicContact OE2-NZ 3.24Å; E141-K201 PolarHBondContact OE2-NZ 3.09Å; E141-K383 IonicContact OE2-NZ 2.81Å; E141-K383 PolarHBondContact OE2-NZ 3.21Å
142	L	95.8	Very high	93.6	Very high	32 Å²	32	32.3 Å²	32.3	17%	0.168	19%	0.186	C	C	.	.			trans	-88.5	131	173.9	-176.1	62.9	0	0	0	110.1	L68 E78 K87 A89 P144	L68-L142 HydrophobicContact CD1-CD1 3.63Å; E78-L142 HydrophobicContact CG-CD2 4.4Å; K87-L142 HydrophobicContact CB-CD2 3.68Å; K87-L142 HydrophobicContact CD-CD2 4.26Å; A89-L142 HydrophobicContact CB-CD1 4.2Å; L142-P144 VanDerWaalsContact O-CD 3.28Å; L142-P144 WeakPolarHBondContact O-CD 3.39Å
143	C	95.3	Very high	93.4	Very high	11 Å²	11	34.5 Å²	34.5	7%	0.074	19%	0.19	C	C	.	.			trans	-97.5	100.5	174.3	-51.1	0	0	0	0	109.3	G145 L193 L194	C143-G145 PolarHBondContact O-N 3.31Å; C143-L193 HydrophobicContact CB-CB 3.74Å; C143-L193 HydrophobicContact CB-CD1 3.88Å; C143-L193 HydrophobicContact CB-CG 4.49Å; C143-L194 CarbonylContact C-O 3.53Å; C143-L194 WeakPolarHBondContact CB-O 3.29Å
144	P	91.3	Very high	93.3	Very high	81 Å²	81	33.9 Å²	33.9	53%	0.526	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.2	-170.1	30.1	-36.2	0	0	0	114.2	L142 G146 E196	L142-P144 VanDerWaalsContact O-CD 3.28Å; L142-P144 WeakPolarHBondContact O-CD 3.39Å; P144-G146 PolarHBondContact O-N 3.44Å; P144-E196 HydrophobicContact CG-CB 3.78Å
145	G	89.9	Confident	93.3	Very high	44 Å²	44	36.2 Å²	36.2	45%	0.454	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-8.2	177.1	0	0	0	0	0	114.3	C143 L194	C143-G145 PolarHBondContact O-N 3.31Å; G145-L194 VanDerWaalsContact CA-O 3.28Å; G145-L194 WeakPolarHBondContact CA-O 3.34Å; G145-L194 PolarHBondContact N-O 3.07Å
146	G	89.9	Confident	93.2	Very high	29 Å²	29	43.6 Å²	43.6	30%	0.299	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.8	-151.3	176.5	0	0	0	0	0	113.2	P144 L193 L194	P144-G146 PolarHBondContact O-N 3.44Å; G146-L193 CarbonylContact O-C 3.48Å; G146-L193 WeakPolarHBondContact O-CA 3.48Å; G146-L193 WeakPolarHBondContact O-CB 3.4Å; G146-L194 PolarHBondContact O-N 3.09Å
147	N	88.6	Confident	93.1	Very high	27 Å²	27	48 Å²	48	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.1	-177.1	179	-5.4	0	0	0	110.2	M149 H150 I189 L193	N147-M149 VanDerWaalsContact CG-CB 3.48Å; N147-M149 WeakPolarHBondContact ND2-CB 3.5Å; N147-M149 PolarHBondContact O-N 3.42Å; N147-M149 WeakPolarHBondContact OD1-CB 3.37Å; N147-M149 PolarHBondContact OD1-N 3.31Å; N147-H150 WeakPolarHBondContact O-CB 3.47Å; N147-H150 PolarHBondContact O-N 2.81Å; N147-I189 PolarHBondContact OD1-O 3.06Å; N147-L193 HydrophobicContact CB-CD2 4.1Å
148	L	92.4	Very high	93	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.3	-30	178	178.7	56.8	0	0	0	112.4	H150 K151 I152 L158 Y166 I189 L192 L194 I200 M256	L148-H150 VanDerWaalsContact C-N 3.28Å; L148-H150 PolarHBondContact O-N 3.34Å; L148-K151 HydrophobicContact CD1-CB 4.34Å; L148-K151 HydrophobicContact CD1-CD 4.41Å; L148-K151 WeakPolarHBondContact O-CB 3.13Å; L148-K151 PolarHBondContact O-N 3.41Å; L148-I152 HydrophobicContact CG-CD1 4.31Å; L148-I152 PolarHBondContact O-N 2.87Å; L148-I152 VanDerWaalsContact O-N 3.08Å; L148-L158 HydrophobicContact CD1-CD1 4.32Å; L148-Y166 HydrophobicContact CD1-CD2 3.95Å; L148-Y166 HydrophobicContact CD1-CE2 3.49Å; L148-Y166 VanDerWaalsContact CD1-CE2 3.49Å; L148-Y166 HydrophobicContact CD2-CD2 4.19Å; L148-Y166 HydrophobicContact CD2-CG 4.27Å; L148-I189 HydrophobicContact CB-CD1 4.23Å; L148-I189 HydrophobicContact CD2-CD1 3.82Å; L148-I189 HydrophobicContact CG-CD1 3.9Å; L148-L192 HydrophobicContact CB-CB 4.34Å; L148-L192 VanDerWaalsContact CB-O 3.3Å; L148-L192 WeakPolarHBondContact CB-O 3.3Å; L148-L192 HydrophobicContact CD2-CB 4.37Å; L148-L192 HydrophobicContact CD2-CD1 4.49Å; L148-L192 PolarHBondContact N-O 2.65Å; L148-L194 HydrophobicContact CB-CD1 4.48Å; L148-L194 HydrophobicContact CB-CG 4.32Å; L148-L194 HydrophobicContact CD1-CD1 4.13Å; L148-L194 HydrophobicContact CD1-CD2 4.34Å; L148-I200 HydrophobicContact CD2-CD1 3.86Å; L148-I200 HydrophobicContact CD2-CG1 4.11Å; L148-M256 HydrophobicContact CD2-CE 3.73Å; L148-M256 HydrophobicContact CD2-SD 4.38Å
149	M	91	Very high	92.9	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-50.7	-43.6	171.4	-173.6	174.7	-169.2	0	0	113	N147 K151 I152 Y153 I189 E190 W425 T426 L429	N147-M149 VanDerWaalsContact CG-CB 3.48Å; N147-M149 WeakPolarHBondContact ND2-CB 3.5Å; N147-M149 PolarHBondContact O-N 3.42Å; N147-M149 WeakPolarHBondContact OD1-CB 3.37Å; N147-M149 PolarHBondContact OD1-N 3.31Å; M149-K151 VanDerWaalsContact C-N 3.29Å; M149-K151 PolarHBondContact O-N 3.49Å; M149-I152 PolarHBondContact O-N 2.98Å; M149-Y153 PolarHBondContact O-N 3.1Å; M149-I189 HydrophobicContact CB-CG1 4.18Å; M149-I189 HydrophobicContact CB-CG2 4.1Å; M149-I189 HydrophobicContact CG-CG2 4.02Å; M149-I189 HydrophobicContact SD-CG2 4.13Å; M149-E190 HydrophobicContact SD-CG 3.74Å; M149-W425 HydrophobicContact CE-CE3 3.76Å; M149-W425 HydrophobicContact CE-CZ3 3.82Å; M149-W425 HydrophobicContact CG-CE3 4.19Å; M149-W425 HydrophobicContact CG-CH2 4.12Å; M149-W425 HydrophobicContact CG-CZ3 3.4Å; M149-W425 VanDerWaalsContact CG-CZ3 3.4Å; M149-W425 WeakPolarHBondContact O-CZ3 3.34Å; M149-T426 HydrophobicContact CE-CG2 4.1Å; M149-T426 VanDerWaalsContact CE-OG1 3.23Å; M149-T426 WeakPolarHBondContact CE-OG1 3.11Å; M149-L429 HydrophobicContact CE-CD1 3.49Å; M149-L429 VanDerWaalsContact CE-CD1 3.49Å
150	H	89.8	Confident	92.8	Very high	81 Å²	81	55.2 Å²	55.2	38%	0.375	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-37.7	179.4	-61.3	-176.3	0	0	0	111.2	N147 L148 Y153 E154	N147-H150 WeakPolarHBondContact O-CB 3.47Å; N147-H150 PolarHBondContact O-N 2.81Å; L148-H150 VanDerWaalsContact C-N 3.28Å; L148-H150 PolarHBondContact O-N 3.34Å; H150-Y153 WeakPolarHBondContact O-CB 3.47Å; H150-Y153 PolarHBondContact O-N 3.3Å; H150-E154 WeakPolarHBondContact O-CG 3.46Å; H150-E154 PolarHBondContact O-N 3.15Å
151	K	92.7	Very high	92.6	Very high	46 Å²	46	57.8 Å²	57.8	20%	0.2	29%	0.294	C	S	.	.	H	α-helix	trans	-69.3	-36.9	-179.6	-163.8	-179.9	-167	-174.8	0	112.1	L148 M149 K155 E162 Y166 L194 N198	L148-K151 HydrophobicContact CD1-CB 4.34Å; L148-K151 HydrophobicContact CD1-CD 4.41Å; L148-K151 WeakPolarHBondContact O-CB 3.13Å; L148-K151 PolarHBondContact O-N 3.41Å; M149-K151 VanDerWaalsContact C-N 3.29Å; M149-K151 PolarHBondContact O-N 3.49Å; K151-K155 WeakPolarHBondContact O-CB 2.98Å; K151-K155 PolarHBondContact O-N 2.72Å; K151-K155 VanDerWaalsContact O-N 3.09Å; K151-E162 WeakPolarHBondContact CE-OE1 3.28Å; K151-E162 IonicContact NZ-OE1 2.71Å; K151-E162 PolarHBondContact NZ-OE1 3.42Å; K151-Y166 PolarHBondContact NZ-OH 2.7Å; K151-L194 HydrophobicContact CD-CD1 4.04Å; K151-N198 PolarHBondContact NZ-ND2 2.83Å; K151-N198 PolarHBondContact NZ-OD1 2.89Å
152	I	93.8	Very high	92.5	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-47.3	171.7	-65	165.5	0	0	0	109.7	L148 M149 E154 K155 K156 L158 I189 M256 W425	L148-I152 HydrophobicContact CG-CD1 4.31Å; L148-I152 PolarHBondContact O-N 2.87Å; L148-I152 VanDerWaalsContact O-N 3.08Å; M149-I152 PolarHBondContact O-N 2.98Å; I152-E154 PolarHBondContact O-N 3.21Å; I152-K155 CarbonylContact O-C 3.19Å; I152-K155 PolarHBondContact O-N 3.47Å; I152-K156 CarbonylContact O-C 3.58Å; I152-K156 WeakPolarHBondContact O-CA 3.3Å; I152-K156 PolarHBondContact O-N 3.04Å; I152-L158 HydrophobicContact CG1-CD1 4.08Å; I152-L158 HydrophobicContact CG1-CD2 4.06Å; I152-L158 HydrophobicContact CG1-CG 3.94Å; I152-I189 HydrophobicContact CD1-CD1 3.66Å; I152-I189 HydrophobicContact CD1-CG1 3.72Å; I152-M256 HydrophobicContact CD1-CG 3.95Å; I152-W425 HydrophobicContact CB-CH2 4.22Å; I152-W425 HydrophobicContact CG2-CH2 3.91Å; I152-W425 HydrophobicContact CG2-CZ2 4.29Å
153	Y	90.4	Very high	92.6	Very high	91 Å²	91	56.7 Å²	56.7	36%	0.357	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-49.5	177.2	-177.4	-96.4	0	0	0	112.5	M149 H150 K155 K156 S421 L422 W425	M149-Y153 PolarHBondContact O-N 3.1Å; H150-Y153 WeakPolarHBondContact O-CB 3.47Å; H150-Y153 PolarHBondContact O-N 3.3Å; Y153-K155 PolarHBondContact O-N 3.33Å; Y153-K156 PolarHBondContact O-N 3.02Å; Y153-S421 WeakPolarHBondContact OH-CB 3.23Å; Y153-S421 PolarHBondContact OH-OG 2.81Å; Y153-L422 HydrophobicContact CD1-CD1 4.35Å; Y153-L422 HydrophobicContact CD2-CD1 4.29Å; Y153-L422 HydrophobicContact CG-CD1 4.07Å; Y153-W425 HydrophobicContact CD2-CB 4.21Å; Y153-W425 AromaticContact CD2-CD2 3.75Å; Y153-W425 HydrophobicContact CD2-CD2 3.75Å; Y153-W425 AromaticContact CD2-CE3 3.61Å; Y153-W425 HydrophobicContact CD2-CE3 3.61Å; Y153-W425 HydrophobicContact CD2-CG 4.02Å; Y153-W425 HydrophobicContact CD2-CZ3 4.2Å; Y153-W425 HydrophobicContact CE2-CB 4.07Å; Y153-W425 HydrophobicContact CE2-CD2 4.47Å; Y153-W425 HydrophobicContact CE2-CG 4.28Å; Y153-W425 HydrophobicContact CG-CE3 4.18Å; Y153-W425 HydrophobicContact CG-CZ3 4.4Å
154	E	90.9	Very high	92.6	Very high	145 Å²	145	57.3 Å²	57.3	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-64	-38	179.7	-73.5	-170.2	137.8	0	0	113.1	H150 I152	H150-E154 WeakPolarHBondContact O-CG 3.46Å; H150-E154 PolarHBondContact O-N 3.15Å; I152-E154 PolarHBondContact O-N 3.21Å
155	K	92.3	Very high	92.8	Very high	102 Å²	102	57.6 Å²	57.6	44%	0.443	28%	0.28	S	S	.	.	H	α-helix	trans	-84.5	-7.4	175.7	-69.1	-168.7	168	-166.4	0	114.1	K151 I152 Y153 R157 L158 E162	K151-K155 WeakPolarHBondContact O-CB 2.98Å; K151-K155 PolarHBondContact O-N 2.72Å; K151-K155 VanDerWaalsContact O-N 3.09Å; I152-K155 CarbonylContact O-C 3.19Å; I152-K155 PolarHBondContact O-N 3.47Å; Y153-K155 PolarHBondContact O-N 3.33Å; K155-R157 VanDerWaalsContact CB-O 3.26Å; K155-R157 WeakPolarHBondContact CB-O 3.35Å; K155-R157 PolarHBondContact O-N 3.22Å; K155-L158 HydrophobicContact CD-CD2 3.93Å; K155-E162 IonicContact NZ-OE1 2.69Å; K155-E162 IonicContact NZ-OE2 3.96Å; K155-E162 PolarHBondContact NZ-OE2 3.36Å
156	K	92.1	Very high	93.1	Very high	172 Å²	172	55.5 Å²	55.5	75%	0.748	26%	0.258	S	S	*	.	S	Bend	trans	61.4	-41.5	-161.2	-52.8	178.2	-178.6	179.2	0	114.6	I152 Y153 G259	I152-K156 CarbonylContact O-C 3.58Å; I152-K156 WeakPolarHBondContact O-CA 3.3Å; I152-K156 PolarHBondContact O-N 3.04Å; Y153-K156 PolarHBondContact O-N 3.02Å; K156-G259 WeakPolarHBondContact O-CA 3.01Å
157	R	93	Very high	93.4	Very high	99 Å²	99	54.1 Å²	54.1	37%	0.374	24%	0.244	S	C	.	.	S	Bend	trans	-151.6	160.2	171.8	65.2	-175.9	-177.8	88.3	-2.4	110.2	K155 L257	K155-R157 VanDerWaalsContact CB-O 3.26Å; K155-R157 WeakPolarHBondContact CB-O 3.35Å; K155-R157 PolarHBondContact O-N 3.22Å; R157-L257 WeakPolarHBondContact CD-O 3.39Å
158	L	95.8	Very high	93.7	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	24%	0.243	C	C	.	.			trans	-87.5	158.1	173.2	-51.6	-175.3	0	0	0	111	L148 I152 K155 E162 A163 Y166 M256	L148-L158 HydrophobicContact CD1-CD1 4.32Å; I152-L158 HydrophobicContact CG1-CD1 4.08Å; I152-L158 HydrophobicContact CG1-CD2 4.06Å; I152-L158 HydrophobicContact CG1-CG 3.94Å; K155-L158 HydrophobicContact CD-CD2 3.93Å; L158-E162 HydrophobicContact CD1-CG 4.39Å; L158-A163 HydrophobicContact CB-CB 4.47Å; L158-Y166 HydrophobicContact CD1-CD2 3.66Å; L158-Y166 HydrophobicContact CD1-CE2 3.75Å; L158-M256 WeakPolarHBondContact CB-O 3.26Å; L158-M256 HydrophobicContact CD1-CB 3.95Å; L158-M256 HydrophobicContact CD1-CG 3.88Å; L158-M256 HydrophobicContact CD1-SD 4.39Å; L158-M256 HydrophobicContact CG-CB 4.42Å; L158-M256 PolarHBondContact N-O 3.39Å
159	E	94.9	Very high	93.9	Very high	125 Å²	125	55.9 Å²	55.9	58%	0.584	25%	0.25	S	C	*	.			trans	-72.4	153.9	165.7	-71.6	175.8	-160.4	0	0	110.7	S161 E162 A163	E159-S161 WeakPolarHBondContact CB-OG 3.46Å; E159-S161 PolarHBondContact O-N 2.98Å; E159-S161 PolarHBondContact OE2-OG 2.97Å; E159-E162 PolarHBondContact O-N 3.35Å; E159-E162 VanDerWaalsContact O-N 3.16Å; E159-A163 WeakPolarHBondContact O-CB 3.5Å; E159-A163 PolarHBondContact O-N 2.84Å
160	E	95.2	Very high	94.2	Very high	35 Å²	35	55.7 Å²	55.7	16%	0.164	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-32.5	179.9	-163.2	-175.9	115.4	0	0	112.2	R164 L257 S290 A293 W319	E160-R164 VanDerWaalsContact C-NH1 3.35Å; E160-R164 WeakPolarHBondContact O-CB 3.31Å; E160-R164 PolarHBondContact O-N 3.13Å; E160-R164 PolarHBondContact O-NH1 3.04Å; E160-R164 IonicContact OE1-CZ 3.67Å; E160-R164 IonicContact OE1-NH1 3.78Å; E160-R164 IonicContact OE1-NH2 3.95Å; E160-R164 PolarHBondContact OE1-NH2 3.2Å; E160-L257 HydrophobicContact CB-CD2 4.47Å; E160-L257 HydrophobicContact CG-CD2 4.43Å; E160-S290 VanDerWaalsContact CD-OG 3.22Å; E160-S290 WeakPolarHBondContact OE1-CB 3.32Å; E160-S290 PolarHBondContact OE1-OG 3.37Å; E160-S290 WeakPolarHBondContact OE2-CB 3.39Å; E160-S290 PolarHBondContact OE2-N 2.85Å; E160-S290 PolarHBondContact OE2-OG 2.67Å; E160-S290 VanDerWaalsContact OE2-OG 3.07Å; E160-A293 HydrophobicContact CG-CB 4.14Å; E160-W319 HydrophobicContact CG-CZ2 3.63Å; E160-W319 PolarHBondContact OE1-NE1 3.41Å
161	S	93.7	Very high	94.5	Very high	67 Å²	67	51.8 Å²	51.8	47%	0.469	23%	0.231	S	C	.	.	H	α-helix	trans	-58.3	-51.9	172.2	52.3	0	0	0	0	112.4	E159 R164 R165	E159-S161 WeakPolarHBondContact CB-OG 3.46Å; E159-S161 PolarHBondContact O-N 2.98Å; E159-S161 PolarHBondContact OE2-OG 2.97Å; S161-R164 PolarHBondContact O-N 3.25Å; S161-R165 PolarHBondContact O-N 2.96Å
162	E	94.8	Very high	94.6	Very high	28 Å²	28	50.1 Å²	50.1	13%	0.131	23%	0.225	C	C	.	.	H	α-helix	trans	-71.9	-43.4	-178.8	-179.1	166.2	-137	0	0	111.7	K151 K155 L158 E159 R164 R165 Y166	K151-E162 WeakPolarHBondContact CE-OE1 3.28Å; K151-E162 IonicContact NZ-OE1 2.71Å; K151-E162 PolarHBondContact NZ-OE1 3.42Å; K155-E162 IonicContact NZ-OE1 2.69Å; K155-E162 IonicContact NZ-OE2 3.96Å; K155-E162 PolarHBondContact NZ-OE2 3.36Å; L158-E162 HydrophobicContact CD1-CG 4.39Å; E159-E162 PolarHBondContact O-N 3.35Å; E159-E162 VanDerWaalsContact O-N 3.16Å; E162-R164 VanDerWaalsContact C-N 3.32Å; E162-R164 PolarHBondContact O-N 3.37Å; E162-R165 WeakPolarHBondContact O-CB 3.47Å; E162-R165 PolarHBondContact O-N 3.06Å; E162-Y166 HydrophobicContact CG-CD2 3.9Å; E162-Y166 HydrophobicContact CG-CE2 3.4Å; E162-Y166 WeakPolarHBondContact O-CD2 3.42Å; E162-Y166 PolarHBondContact O-N 3.2Å; E162-Y166 VanDerWaalsContact O-N 3.07Å; E162-Y166 PolarHBondContact OE1-OH 3.05Å
163	A	96.4	Very high	94.7	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-41.4	173.3	0	0	0	0	0	111.8	L158 E159 R165 Y166 I167 M256 L257	L158-A163 HydrophobicContact CB-CB 4.47Å; E159-A163 WeakPolarHBondContact O-CB 3.5Å; E159-A163 PolarHBondContact O-N 2.84Å; A163-R165 PolarHBondContact O-N 3.48Å; A163-Y166 PolarHBondContact O-N 2.97Å; A163-I167 WeakPolarHBondContact O-CB 3.47Å; A163-I167 WeakPolarHBondContact O-CG1 3.47Å; A163-I167 PolarHBondContact O-N 2.77Å; A163-M256 HydrophobicContact CB-CB 4.15Å; A163-L257 HydrophobicContact CB-CD2 3.58Å; A163-L257 HydrophobicContact CB-CG 4.21Å
164	R	95.8	Very high	94.9	Very high	25 Å²	25	45.7 Å²	45.7	9%	0.094	21%	0.208	C	C	.	.	H	α-helix	trans	-61.8	-39.4	175.4	-170.3	-168	-78.7	94.7	-16.5	112.1	E160 S161 E162 R168 W319 E322	E160-R164 VanDerWaalsContact C-NH1 3.35Å; E160-R164 WeakPolarHBondContact O-CB 3.31Å; E160-R164 PolarHBondContact O-N 3.13Å; E160-R164 PolarHBondContact O-NH1 3.04Å; E160-R164 IonicContact OE1-CZ 3.67Å; E160-R164 IonicContact OE1-NH1 3.78Å; E160-R164 IonicContact OE1-NH2 3.95Å; E160-R164 PolarHBondContact OE1-NH2 3.2Å; S161-R164 PolarHBondContact O-N 3.25Å; E162-R164 VanDerWaalsContact C-N 3.32Å; E162-R164 PolarHBondContact O-N 3.37Å; R164-R168 VanDerWaalsContact O-CB 3.24Å; R164-R168 WeakPolarHBondContact O-CB 3.33Å; R164-R168 PolarHBondContact O-N 3.34Å; R164-R168 VanDerWaalsContact O-N 3.13Å; R164-W319 HydrophobicContact CB-CH2 3.61Å; R164-W319 HydrophobicContact CB-CZ2 3.73Å; R164-W319 HydrophobicContact CB-CZ3 4.15Å; R164-W319 VanDerWaalsContact CD-O 3.24Å; R164-W319 WeakPolarHBondContact CD-O 3.31Å; R164-W319 HydrophobicContact CG-CD2 4.45Å; R164-W319 HydrophobicContact CG-CE3 4.28Å; R164-W319 HydrophobicContact CG-CH2 4.01Å; R164-W319 HydrophobicContact CG-CZ2 4.14Å; R164-W319 HydrophobicContact CG-CZ3 4.07Å; R164-W319 PolarHBondContact NE-O 3.22Å; R164-E322 IonicContact CZ-OE2 3.7Å; R164-E322 IonicContact NE-OE2 2.85Å; R164-E322 IonicContact NH2-OE2 3.57Å; R164-E322 PolarHBondContact NH2-OE2 3.5Å
165	R	94.6	Very high	95.1	Very high	87 Å²	87	39.4 Å²	39.4	33%	0.328	18%	0.178	S	C	.	.	H	α-helix	trans	-60.2	-49	172.3	176.1	-179	173.4	-175	-3.6	111.2	S161 E162 A163 Q169 D197 N198 N199	S161-R165 PolarHBondContact O-N 2.96Å; E162-R165 WeakPolarHBondContact O-CB 3.47Å; E162-R165 PolarHBondContact O-N 3.06Å; A163-R165 PolarHBondContact O-N 3.48Å; R165-Q169 WeakPolarHBondContact O-CG 3.47Å; R165-Q169 PolarHBondContact O-N 3.17Å; R165-D197 PolarHBondContact NH2-O 3.12Å; R165-N198 PolarHBondContact NH2-O 3.38Å; R165-N199 PolarHBondContact NH2-OD1 3.29Å
166	Y	96.8	Very high	95.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.1	-46.9	-177	-70.7	-39.9	0	0	0	113.1	L148 K151 L158 E162 A163 R168 Q169 L170 L194 N198 I200 M256	L148-Y166 HydrophobicContact CD1-CD2 3.95Å; L148-Y166 HydrophobicContact CD1-CE2 3.49Å; L148-Y166 VanDerWaalsContact CD1-CE2 3.49Å; L148-Y166 HydrophobicContact CD2-CD2 4.19Å; L148-Y166 HydrophobicContact CD2-CG 4.27Å; K151-Y166 PolarHBondContact NZ-OH 2.7Å; L158-Y166 HydrophobicContact CD1-CD2 3.66Å; L158-Y166 HydrophobicContact CD1-CE2 3.75Å; E162-Y166 HydrophobicContact CG-CD2 3.9Å; E162-Y166 HydrophobicContact CG-CE2 3.4Å; E162-Y166 WeakPolarHBondContact O-CD2 3.42Å; E162-Y166 PolarHBondContact O-N 3.2Å; E162-Y166 VanDerWaalsContact O-N 3.07Å; E162-Y166 PolarHBondContact OE1-OH 3.05Å; A163-Y166 PolarHBondContact O-N 2.97Å; Y166-R168 VanDerWaalsContact C-N 3.27Å; Y166-R168 PolarHBondContact O-N 3.09Å; Y166-Q169 PolarHBondContact O-N 3.41Å; Y166-Q169 VanDerWaalsContact O-N 3.13Å; Y166-L170 PolarHBondContact O-N 2.8Å; Y166-L194 HydrophobicContact CD1-CD2 4.46Å; Y166-L194 HydrophobicContact CE1-CD2 3.58Å; Y166-N198 WeakPolarHBondContact CE1-O 3.46Å; Y166-N198 VanDerWaalsContact OH-CG 3.25Å; Y166-N198 PolarHBondContact OH-ND2 3.18Å; Y166-N198 PolarHBondContact OH-OD1 3.39Å; Y166-I200 HydrophobicContact CD1-CD1 4Å; Y166-I200 HydrophobicContact CD1-CG1 3.82Å; Y166-I200 HydrophobicContact CE1-CG1 4.47Å; Y166-I200 HydrophobicContact CG-CD1 4.09Å; Y166-I200 HydrophobicContact CG-CG1 4.39Å; Y166-M256 HydrophobicContact CD2-SD 4.33Å
167	I	97.4	Very high	95.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.1	-33.3	178.2	-64.6	-59.9	0	0	0	111.4	A163 L170 I171 I249 M253 M256 F296 L320	A163-I167 WeakPolarHBondContact O-CB 3.47Å; A163-I167 WeakPolarHBondContact O-CG1 3.47Å; A163-I167 PolarHBondContact O-N 2.77Å; I167-L170 HydrophobicContact CD1-CD2 4.34Å; I167-L170 PolarHBondContact O-N 2.89Å; I167-I171 HydrophobicContact CG2-CD1 3.61Å; I167-I171 HydrophobicContact CG2-CG1 4.19Å; I167-I171 WeakPolarHBondContact O-CB 3.11Å; I167-I171 VanDerWaalsContact O-CG1 3.26Å; I167-I171 WeakPolarHBondContact O-CG1 3.24Å; I167-I171 PolarHBondContact O-N 3.03Å; I167-I249 HydrophobicContact CD1-CG2 4.35Å; I167-I249 HydrophobicContact CG2-CG2 4.14Å; I167-M253 HydrophobicContact CD1-CB 3.73Å; I167-M253 HydrophobicContact CD1-CG 4.45Å; I167-M253 HydrophobicContact CG1-CB 3.94Å; I167-M253 HydrophobicContact CG1-CG 4.1Å; I167-M256 HydrophobicContact CD1-CE 3.72Å; I167-M256 HydrophobicContact CD1-SD 3.82Å; I167-M256 HydrophobicContact CG1-SD 4Å; I167-F296 HydrophobicContact CG2-CE1 4.1Å; I167-L320 HydrophobicContact CB-CD1 4.38Å; I167-L320 HydrophobicContact CG2-CD1 3.96Å
168	R	94.9	Very high	95.2	Very high	33 Å²	33	23.3 Å²	23.3	13%	0.125	11%	0.111	C	C	.	.	H	α-helix	trans	-63.5	-42.4	172.6	-166.7	-174.1	-60.7	130.5	-8.8	112.3	R164 Y166 S172 L320 Y324 P329	R164-R168 VanDerWaalsContact O-CB 3.24Å; R164-R168 WeakPolarHBondContact O-CB 3.33Å; R164-R168 PolarHBondContact O-N 3.34Å; R164-R168 VanDerWaalsContact O-N 3.13Å; Y166-R168 VanDerWaalsContact C-N 3.27Å; Y166-R168 PolarHBondContact O-N 3.09Å; R168-S172 WeakPolarHBondContact O-CB 3.05Å; R168-S172 PolarHBondContact O-N 3.38Å; R168-L320 HydrophobicContact CB-CD1 3.91Å; R168-L320 HydrophobicContact CB-CG 4.19Å; R168-L320 HydrophobicContact CG-CG 4.24Å; R168-L320 PolarHBondContact NE-O 3.42Å; R168-L320 PolarHBondContact NH2-O 3.4Å; R168-Y324 VanDerWaalsContact CZ-CD2 3.46Å; R168-P329 HydrophobicContact CG-CG 3.82Å
169	Q	95.6	Very high	94.9	Very high	30 Å²	30	28.7 Å²	28.7	14%	0.14	13%	0.131	C	C	.	.	H	α-helix	trans	-67.3	-39.2	175.7	-73.7	-179.2	-18.1	0	0	112.6	N122 R165 Y166 A173 N199 I200	N122-Q169 HydrophobicContact CB-CB 4.32Å; R165-Q169 WeakPolarHBondContact O-CG 3.47Å; R165-Q169 PolarHBondContact O-N 3.17Å; Y166-Q169 PolarHBondContact O-N 3.41Å; Y166-Q169 VanDerWaalsContact O-N 3.13Å; Q169-A173 PolarHBondContact O-N 2.95Å; Q169-N199 PolarHBondContact NE2-OD1 2.85Å; Q169-I200 HydrophobicContact CB-CB 4.28Å
170	L	97.4	Very high	94.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-67.9	-46.3	177.4	-178.9	57.7	0	0	0	112	Y166 I167 S172 A173 V174 L192 I200 I249 N252	Y166-L170 PolarHBondContact O-N 2.8Å; I167-L170 HydrophobicContact CD1-CD2 4.34Å; I167-L170 PolarHBondContact O-N 2.89Å; L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 3.47Å; L170-A173 PolarHBondContact O-N 3.13Å; L170-V174 HydrophobicContact CD1-CG2 4.12Å; L170-V174 VanDerWaalsContact O-CG2 3.31Å; L170-V174 WeakPolarHBondContact O-CG2 3.45Å; L170-V174 PolarHBondContact O-N 2.84Å; L170-L192 HydrophobicContact CD1-CD2 3.71Å; L170-L192 HydrophobicContact CD2-CD1 3.99Å; L170-I200 HydrophobicContact CB-CD1 4.43Å; L170-I249 HydrophobicContact CD2-CB 4.5Å; L170-I249 HydrophobicContact CD2-CG1 3.98Å; L170-I249 HydrophobicContact CD2-CG2 4.31Å; L170-I249 HydrophobicContact CG-CG1 4.05Å; L170-N252 HydrophobicContact CD2-CB 4.31Å
171	I	96.5	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.5	-39.4	176.5	-64.8	167.9	0	0	0	110.4	I167 A173 V174 E175 I249 F296 I311 A314 L315 L320	I167-I171 HydrophobicContact CG2-CD1 3.61Å; I167-I171 HydrophobicContact CG2-CG1 4.19Å; I167-I171 WeakPolarHBondContact O-CB 3.11Å; I167-I171 VanDerWaalsContact O-CG1 3.26Å; I167-I171 WeakPolarHBondContact O-CG1 3.24Å; I167-I171 PolarHBondContact O-N 3.03Å; I171-A173 PolarHBondContact O-N 3.35Å; I171-V174 PolarHBondContact O-N 2.96Å; I171-E175 VanDerWaalsContact O-CB 3.29Å; I171-E175 WeakPolarHBondContact O-CB 3.29Å; I171-E175 PolarHBondContact O-N 2.84Å; I171-I249 HydrophobicContact CD1-CG2 4.23Å; I171-I249 HydrophobicContact CG1-CD1 3.95Å; I171-I249 HydrophobicContact CG1-CG2 3.84Å; I171-F296 HydrophobicContact CD1-CE1 4.23Å; I171-F296 HydrophobicContact CD1-CZ 3.73Å; I171-I311 HydrophobicContact CB-CD1 4.48Å; I171-I311 HydrophobicContact CG2-CD1 3.79Å; I171-I311 HydrophobicContact CG2-CG1 4.14Å; I171-A314 HydrophobicContact CD1-CB 4.44Å; I171-L315 HydrophobicContact CB-CD1 4.3Å; I171-L315 HydrophobicContact CG2-CB 3.8Å; I171-L315 HydrophobicContact CG2-CD1 3.73Å; I171-L315 HydrophobicContact CG2-CG 4.27Å; I171-L320 HydrophobicContact CD1-CD1 4.22Å; I171-L320 HydrophobicContact CD1-CD2 3.72Å
172	S	94.8	Very high	94.1	Very high	11 Å²	11	19.9 Å²	19.9	8%	0.077	9%	0.092	C	C	.	.	H	α-helix	trans	-57.5	-47.1	173.4	-170.7	0	0	0	0	112.1	H120 R168 L170 V174 H176	H120-S172 PolarHBondContact CE1-OG 3.27Å; H120-S172 PolarHBondContact NE2-O 2.88Å; H120-S172 PolarHBondContact NE2-OG 2.79Å; R168-S172 WeakPolarHBondContact O-CB 3.05Å; R168-S172 PolarHBondContact O-N 3.38Å; L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 3.47Å; S172-V174 PolarHBondContact O-N 2.89Å; S172-H176 WeakPolarHBondContact O-CB 3.4Å; S172-H176 PolarHBondContact O-N 2.86Å; S172-H176 VanDerWaalsContact O-N 3.14Å
173	A	95.6	Very high	94	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.2	-41.6	177.2	0	0	0	0	0	112.6	H120 N122 I123 Q169 L170 I171 L177 L202	H120-A173 VanDerWaalsContact CE1-CA 3.48Å; H120-A173 WeakPolarHBondContact CE1-CA 3.32Å; H120-A173 PolarHBondContact CE1-N 2.63Å; N122-A173 HydrophobicContact CB-CB 4.26Å; I123-A173 HydrophobicContact CD1-CB 4.12Å; I123-A173 HydrophobicContact CG1-CB 3.76Å; Q169-A173 PolarHBondContact O-N 2.95Å; L170-A173 PolarHBondContact O-N 3.13Å; I171-A173 PolarHBondContact O-N 3.35Å; A173-L177 WeakPolarHBondContact O-CG 3.33Å; A173-L177 PolarHBondContact O-N 3.43Å; A173-L177 VanDerWaalsContact O-N 3.1Å; A173-L202 HydrophobicContact CB-CD2 4.32Å
174	V	95.6	Very high	93.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-75.8	-35.7	-177.5	176.4	0	0	0	0	112	L170 I171 S172 H176 L177 H178 L187 D245 I249 I311	L170-V174 HydrophobicContact CD1-CG2 4.12Å; L170-V174 VanDerWaalsContact O-CG2 3.31Å; L170-V174 WeakPolarHBondContact O-CG2 3.45Å; L170-V174 PolarHBondContact O-N 2.84Å; I171-V174 PolarHBondContact O-N 2.96Å; S172-V174 PolarHBondContact O-N 2.89Å; V174-H176 VanDerWaalsContact C-N 3.33Å; V174-L177 PolarHBondContact O-N 3.46Å; V174-H178 WeakPolarHBondContact CG1-NE2 3.38Å; V174-H178 WeakPolarHBondContact O-CB 3.34Å; V174-H178 PolarHBondContact O-CD2 3.41Å; V174-H178 VanDerWaalsContact O-CD2 3.28Å; V174-H178 VanDerWaalsContact O-CG 3.29Å; V174-H178 PolarHBondContact O-N 2.93Å; V174-L187 HydrophobicContact CG1-CD1 4.33Å; V174-L187 HydrophobicContact CG2-CD1 3.55Å; V174-L187 HydrophobicContact CG2-CD2 4.22Å; V174-D245 HydrophobicContact CG1-CB 3.89Å; V174-I249 HydrophobicContact CB-CD1 4Å; V174-I249 HydrophobicContact CG1-CD1 4.06Å; V174-I249 HydrophobicContact CG2-CD1 3.99Å; V174-I311 HydrophobicContact CB-CD1 4.06Å; V174-I311 HydrophobicContact CB-CG1 4.49Å; V174-I311 HydrophobicContact CG1-CD1 3.76Å; V174-I311 HydrophobicContact CG1-CG1 4.19Å
175	E	94.4	Very high	93.5	Very high	12 Å²	12	17.8 Å²	17.8	6%	0.056	8%	0.083	C	C	.	.	H	α-helix	trans	-59.9	-47	172.1	-166	-69.4	142.6	0	0	110.1	I171 L177 H178 R179 I311 Q312 L315	I171-E175 VanDerWaalsContact O-CB 3.29Å; I171-E175 WeakPolarHBondContact O-CB 3.29Å; I171-E175 PolarHBondContact O-N 2.84Å; E175-L177 VanDerWaalsContact C-N 3.32Å; E175-L177 PolarHBondContact O-N 2.75Å; E175-H178 PolarHBondContact O-N 3.42Å; E175-R179 VanDerWaalsContact CD-NH2 3.31Å; E175-R179 VanDerWaalsContact O-CB 3.27Å; E175-R179 WeakPolarHBondContact O-CB 3.41Å; E175-R179 PolarHBondContact O-N 3.01Å; E175-R179 IonicContact OE1-CZ 2.79Å; E175-R179 IonicContact OE1-NE 2.75Å; E175-R179 PolarHBondContact OE1-NE 2.84Å; E175-R179 VanDerWaalsContact OE1-NE 3.07Å; E175-R179 IonicContact OE1-NH2 2.8Å; E175-R179 PolarHBondContact OE1-NH2 2.94Å; E175-R179 IonicContact OE2-CZ 2.73Å; E175-R179 VanDerWaalsContact OE2-CZ 3.26Å; E175-R179 IonicContact OE2-NE 2.63Å; E175-R179 PolarHBondContact OE2-NE 2.87Å; E175-R179 VanDerWaalsContact OE2-NE 3.09Å; E175-R179 IonicContact OE2-NH2 2.65Å; E175-R179 PolarHBondContact OE2-NH2 3.39Å; E175-I311 HydrophobicContact CB-CG1 3.83Å; E175-I311 HydrophobicContact CB-CG2 4.27Å; E175-I311 HydrophobicContact CG-CG1 4.39Å; E175-I311 HydrophobicContact CG-CG2 4.04Å; E175-Q312 HydrophobicContact CG-CG 4.29Å; E175-Q312 PolarHBondContact OE1-NE2 2.79Å; E175-Q312 VanDerWaalsContact OE1-NE2 3.09Å; E175-L315 HydrophobicContact CB-CD2 4.43Å; E175-L315 HydrophobicContact CG-CD2 4.22Å
176	H	93.3	Very high	93.2	Very high	8 Å²	8	14.7 Å²	14.7	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-59.4	-40.3	176.8	-177.3	92.8	0	0	0	112.8	R119 H120 S172 V174 A180 Y334 N336	R119-H176 PolarHBondContact O-CE1 2.92Å; R119-H176 VanDerWaalsContact O-CE1 3.29Å; R119-H176 PolarHBondContact O-NE2 2.83Å; H120-H176 AromaticContact CD2-CG 3.66Å; H120-H176 AromaticContact CD2-ND1 3.86Å; S172-H176 WeakPolarHBondContact O-CB 3.4Å; S172-H176 PolarHBondContact O-N 2.86Å; S172-H176 VanDerWaalsContact O-N 3.14Å; V174-H176 VanDerWaalsContact C-N 3.33Å; H176-A180 WeakPolarHBondContact O-CB 3.34Å; H176-A180 PolarHBondContact O-N 3.48Å; H176-A180 VanDerWaalsContact O-N 3.1Å; H176-Y334 PolarHBondContact CE1-O 3.32Å; H176-N336 PolarHBondContact CE1-OD1 3.2Å; H176-N336 PolarHBondContact NE2-OD1 2.95Å
177	L	93.4	Very high	93.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.7	-48.6	172.8	-71.5	172.1	0	0	0	112	I118 I123 A173 V174 E175 R179 A180 G181 V182 L202 F205	I118-L177 HydrophobicContact CD1-CD2 3.88Å; I118-L177 HydrophobicContact CG1-CD2 3.8Å; I118-L177 HydrophobicContact CG2-CD2 4.01Å; I123-L177 HydrophobicContact CD1-CD1 4.13Å; I123-L177 HydrophobicContact CD1-CD2 3.94Å; I123-L177 HydrophobicContact CD1-CG 3.81Å; A173-L177 WeakPolarHBondContact O-CG 3.33Å; A173-L177 PolarHBondContact O-N 3.43Å; A173-L177 VanDerWaalsContact O-N 3.1Å; V174-L177 PolarHBondContact O-N 3.46Å; E175-L177 VanDerWaalsContact C-N 3.32Å; E175-L177 PolarHBondContact O-N 2.75Å; L177-R179 VanDerWaalsContact C-N 3.29Å; L177-R179 PolarHBondContact O-N 3.23Å; L177-A180 CarbonylContact O-C 3.41Å; L177-A180 WeakPolarHBondContact O-CA 3.37Å; L177-A180 WeakPolarHBondContact O-CB 3.38Å; L177-A180 PolarHBondContact O-N 3.03Å; L177-G181 PolarHBondContact O-N 3.3Å; L177-V182 CarbonylContact C-O 3.29Å; L177-V182 HydrophobicContact CB-CB 4.31Å; L177-V182 HydrophobicContact CD2-CB 4.23Å; L177-V182 HydrophobicContact CD2-CG1 4.16Å; L177-V182 PolarHBondContact O-N 3.37Å; L177-V182 VanDerWaalsContact O-O 3.11Å; L177-L202 HydrophobicContact CD1-CD2 3.98Å; L177-F205 HydrophobicContact CD1-CE1 3.8Å; L177-F205 HydrophobicContact CD1-CZ 4.34Å; L177-F205 HydrophobicContact CD2-CE1 3.61Å; L177-F205 HydrophobicContact CD2-CZ 4.19Å; L177-F205 HydrophobicContact CG-CE1 4.38Å
178	H	92.2	Very high	92.8	Very high	28 Å²	28	16 Å²	16	13%	0.13	8%	0.079	C	C	.	.	H	α-helix	trans	-61.9	-39.1	-179.6	-71	-170.5	0	0	0	111.3	V174 E175 A180 G181 V182 P242 D245 I311	V174-H178 WeakPolarHBondContact CG1-NE2 3.38Å; V174-H178 WeakPolarHBondContact O-CB 3.34Å; V174-H178 PolarHBondContact O-CD2 3.41Å; V174-H178 VanDerWaalsContact O-CD2 3.28Å; V174-H178 VanDerWaalsContact O-CG 3.29Å; V174-H178 PolarHBondContact O-N 2.93Å; E175-H178 PolarHBondContact O-N 3.42Å; H178-A180 VanDerWaalsContact C-N 3.31Å; H178-A180 PolarHBondContact O-N 3.35Å; H178-G181 WeakPolarHBondContact O-CA 3.15Å; H178-G181 PolarHBondContact O-N 3.4Å; H178-V182 PolarHBondContact CD2-O 3.47Å; H178-V182 PolarHBondContact N-O 3.33Å; H178-P242 PolarHBondContact CE1-O 2.89Å; H178-P242 WeakPolarHBondContact ND1-CB 3.35Å; H178-D245 IonicContact CD2-OD2 3.31Å; H178-D245 IonicContact CE1-OD2 3.82Å; H178-D245 IonicContact NE2-OD2 3.71Å; H178-D245 PolarHBondContact NE2-OD2 2.99Å; H178-I311 HydrophobicContact CB-CG2 4.11Å; H178-I311 WeakPolarHBondContact ND1-CG2 3.38Å
179	R	89.8	Confident	92.6	Very high	113 Å²	113	14.6 Å²	14.6	43%	0.426	7%	0.073	S	C	.	.	H	α-helix	trans	-64.7	-32.6	174.1	-164.3	-168.1	-62.8	-160	9.9	112.6	E175 L177 G181 T333	E175-R179 VanDerWaalsContact CD-NH2 3.31Å; E175-R179 VanDerWaalsContact O-CB 3.27Å; E175-R179 WeakPolarHBondContact O-CB 3.41Å; E175-R179 PolarHBondContact O-N 3.01Å; E175-R179 IonicContact OE1-CZ 2.79Å; E175-R179 IonicContact OE1-NE 2.75Å; E175-R179 PolarHBondContact OE1-NE 2.84Å; E175-R179 VanDerWaalsContact OE1-NE 3.07Å; E175-R179 IonicContact OE1-NH2 2.8Å; E175-R179 PolarHBondContact OE1-NH2 2.94Å; E175-R179 IonicContact OE2-CZ 2.73Å; E175-R179 VanDerWaalsContact OE2-CZ 3.26Å; E175-R179 IonicContact OE2-NE 2.63Å; E175-R179 PolarHBondContact OE2-NE 2.87Å; E175-R179 VanDerWaalsContact OE2-NE 3.09Å; E175-R179 IonicContact OE2-NH2 2.65Å; E175-R179 PolarHBondContact OE2-NH2 3.39Å; L177-R179 VanDerWaalsContact C-N 3.29Å; L177-R179 PolarHBondContact O-N 3.23Å; R179-G181 PolarHBondContact O-N 2.82Å; R179-T333 VanDerWaalsContact NH1-CG2 3.3Å; R179-T333 PolarHBondContact NH1-OG1 3.02Å
180	A	88.8	Confident	92.2	Very high	20 Å²	20	14.6 Å²	14.6	17%	0.165	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	6.3	170.4	0	0	0	0	0	113.8	I118 H176 L177 H178 V182 I213	I118-A180 HydrophobicContact CD1-CB 3.57Å; H176-A180 WeakPolarHBondContact O-CB 3.34Å; H176-A180 PolarHBondContact O-N 3.48Å; H176-A180 VanDerWaalsContact O-N 3.1Å; L177-A180 CarbonylContact O-C 3.41Å; L177-A180 WeakPolarHBondContact O-CA 3.37Å; L177-A180 WeakPolarHBondContact O-CB 3.38Å; L177-A180 PolarHBondContact O-N 3.03Å; H178-A180 VanDerWaalsContact C-N 3.31Å; H178-A180 PolarHBondContact O-N 3.35Å; A180-V182 VanDerWaalsContact C-N 3.28Å; A180-V182 HydrophobicContact CB-CG2 4.46Å; A180-V182 PolarHBondContact O-N 2.62Å; A180-I213 WeakPolarHBondContact O-CD1 3.27Å
181	G	88.3	Confident	92	Very high	20 Å²	20	15.2 Å²	15.2	21%	0.206	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	10.1	-178.4	0	0	0	0	0	114.7	L177 H178 R179 C210 A211	L177-G181 PolarHBondContact O-N 3.3Å; H178-G181 WeakPolarHBondContact O-CA 3.15Å; H178-G181 PolarHBondContact O-N 3.4Å; R179-G181 PolarHBondContact O-N 2.82Å; G181-C210 CarbonylContact O-C 3.54Å; G181-C210 VanDerWaalsContact O-CA 3.31Å; G181-C210 WeakPolarHBondContact O-CA 3.25Å; G181-A211 PolarHBondContact O-N 3.44Å
182	V	90.3	Very high	91.9	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.012	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.7	-178.3	-177.7	0	0	0	0	110	I114 I118 L177 H178 A180	I114-V182 HydrophobicContact CG2-CG1 3.74Å; I114-V182 HydrophobicContact CG2-CG2 4.07Å; I118-V182 HydrophobicContact CD1-CG2 4.43Å; L177-V182 CarbonylContact C-O 3.29Å; L177-V182 HydrophobicContact CB-CB 4.31Å; L177-V182 HydrophobicContact CD2-CB 4.23Å; L177-V182 HydrophobicContact CD2-CG1 4.16Å; L177-V182 PolarHBondContact O-N 3.37Å; L177-V182 VanDerWaalsContact O-O 3.11Å; H178-V182 PolarHBondContact CD2-O 3.47Å; H178-V182 PolarHBondContact N-O 3.33Å; A180-V182 VanDerWaalsContact C-N 3.28Å; A180-V182 HydrophobicContact CB-CG2 4.46Å; A180-V182 PolarHBondContact O-N 2.62Å
183	V	91.4	Very high	92	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.7	169.3	-172.7	0	0	0	0	108.5	R185 S208 N209 F220 P242 I244 D245	V183-R185 HydrophobicContact CB-CG 4.19Å; V183-R185 HydrophobicContact CG1-CG 3.79Å; V183-S208 VanDerWaalsContact O-CA 3.29Å; V183-S208 WeakPolarHBondContact O-CA 3.36Å; V183-S208 WeakPolarHBondContact O-CB 3.4Å; V183-N209 PolarHBondContact N-O 3.25Å; V183-N209 PolarHBondContact O-N 2.75Å; V183-F220 HydrophobicContact CB-CE2 4.01Å; V183-F220 HydrophobicContact CG2-CE2 3.81Å; V183-F220 HydrophobicContact CG2-CZ 4.49Å; V183-P242 HydrophobicContact CG2-CB 3.92Å; V183-P242 HydrophobicContact CG2-CG 3.78Å; V183-I244 HydrophobicContact CG1-CG1 4.19Å; V183-D245 VanDerWaalsContact CG1-OD2 3.24Å; V183-D245 WeakPolarHBondContact CG1-OD2 3.49Å
184	H	92.1	Very high	92	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.			trans	-79.4	-45.6	-170.3	-163.8	-63	0	0	0	112.6	D186 L187 D204 L207 S208 D245	H184-D186 PolarHBondContact O-N 2.8Å; H184-L187 HydrophobicContact CB-CD2 3.83Å; H184-L187 HydrophobicContact CB-CG 3.94Å; H184-L187 VanDerWaalsContact CG-CD2 3.48Å; H184-D204 PolarHBondContact CE1-O 2.78Å; H184-D204 VanDerWaalsContact CE1-O 3.25Å; H184-L207 CarbonylContact O-C 3.49Å; H184-S208 WeakPolarHBondContact O-CA 3.33Å; H184-S208 PolarHBondContact O-N 3.19Å; H184-S208 PolarHBondContact O-OG 3.3Å; H184-D245 PolarHBondContact N-OD2 2.76Å
185	R	90.3	Very high	91.9	Very high	9 Å²	9	17.9 Å²	17.9	3%	0.034	9%	0.09	C	C	.	.	S	Bend	trans	63.3	13.8	174.6	-38	-170.8	-65.3	167.8	-1.7	116.3	V183 L207 Y240 I244 D245	V183-R185 HydrophobicContact CB-CG 4.19Å; V183-R185 HydrophobicContact CG1-CG 3.79Å; R185-L207 VanDerWaalsContact CZ-O 3.25Å; R185-L207 PolarHBondContact NE-O 3.18Å; R185-L207 PolarHBondContact NH2-O 2.71Å; R185-Y240 PolarHBondContact NH1-OH 3.38Å; R185-I244 HydrophobicContact CB-CD1 4.07Å; R185-I244 HydrophobicContact CG-CD1 4Å; R185-D245 PolarHBondContact N-OD1 2.71Å
186	D	88.5	Confident	91.7	Very high	21 Å²	21	20 Å²	20	11%	0.112	10%	0.1	C	C	.	.			trans	-159.2	51.7	175.7	-164.5	45.4	0	0	0	110.9	H184 K188 N191 L207 G225 S226	H184-D186 PolarHBondContact O-N 2.8Å; D186-K188 PolarHBondContact O-N 3.4Å; D186-N191 PolarHBondContact O-ND2 3.09Å; D186-N191 PolarHBondContact OD2-ND2 2.87Å; D186-L207 HydrophobicContact CB-CB 4.11Å; D186-L207 HydrophobicContact CB-CD1 3.84Å; D186-G225 WeakPolarHBondContact OD1-CA 3.48Å; D186-S226 PolarHBondContact OD1-N 3.37Å
187	L	93.6	Very high	91.6	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.12	C	C	.	.			trans	-82.6	106.6	174.9	-65.8	178	0	0	0	109.7	V174 H184 L202 Y229 D245 S248 I249 N252	V174-L187 HydrophobicContact CG1-CD1 4.33Å; V174-L187 HydrophobicContact CG2-CD1 3.55Å; V174-L187 HydrophobicContact CG2-CD2 4.22Å; H184-L187 HydrophobicContact CB-CD2 3.83Å; H184-L187 HydrophobicContact CB-CG 3.94Å; H184-L187 VanDerWaalsContact CG-CD2 3.48Å; L187-L202 HydrophobicContact CD2-CD1 3.67Å; L187-L202 HydrophobicContact CD2-CD2 4.03Å; L187-Y229 WeakPolarHBondContact O-CD1 3.29Å; L187-D245 HydrophobicContact CD1-CB 3.63Å; L187-S248 WeakPolarHBondContact O-CB 3.49Å; L187-I249 HydrophobicContact CD1-CD1 4.48Å; L187-I249 HydrophobicContact CD1-CG1 4.05Å; L187-N252 PolarHBondContact O-ND2 3.03Å; L187-N252 VanDerWaalsContact O-ND2 3.08Å
188	K	91.2	Very high	91.6	Very high	27 Å²	27	25.8 Å²	25.8	12%	0.117	13%	0.131	C	C	.	.			trans	-142.4	159.5	-177.5	64.9	-177.5	-162.9	139.4	0	110.4	D186 E190 N191 Y229 E430	D186-K188 PolarHBondContact O-N 3.4Å; K188-E190 VanDerWaalsContact CB-OE2 3.28Å; K188-E190 WeakPolarHBondContact CB-OE2 3.39Å; K188-E190 VanDerWaalsContact CD-OE1 3.27Å; K188-E190 WeakPolarHBondContact CD-OE1 3.23Å; K188-E190 VanDerWaalsContact CE-OE1 3.26Å; K188-E190 WeakPolarHBondContact CE-OE1 3.39Å; K188-E190 WeakPolarHBondContact CG-OE2 3.49Å; K188-E190 IonicContact NZ-OE1 2.65Å; K188-E190 PolarHBondContact NZ-OE1 3.5Å; K188-E190 PolarHBondContact O-N 3.45Å; K188-N191 HydrophobicContact CG-CB 4.21Å; K188-N191 WeakPolarHBondContact O-CB 3.48Å; K188-N191 PolarHBondContact O-N 2.82Å; K188-Y229 HydrophobicContact CB-CD1 3.83Å; K188-Y229 HydrophobicContact CB-CD2 3.7Å; K188-Y229 HydrophobicContact CB-CE1 3.9Å; K188-Y229 HydrophobicContact CB-CE2 3.76Å; K188-Y229 HydrophobicContact CB-CG 3.73Å; K188-E430 IonicContact NZ-OE1 2.82Å
189	I	91.3	Very high	91.7	Very high	3 Å²	3	26 Å²	26	2%	0.015	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-64.2	-28.8	-167.7	-163.7	55.5	0	0	0	112.4	N147 L148 M149 I152 N191 L192 Y229 N252 M256	N147-I189 PolarHBondContact OD1-O 3.06Å; L148-I189 HydrophobicContact CB-CD1 4.23Å; L148-I189 HydrophobicContact CD2-CD1 3.82Å; L148-I189 HydrophobicContact CG-CD1 3.9Å; M149-I189 HydrophobicContact CB-CG1 4.18Å; M149-I189 HydrophobicContact CB-CG2 4.1Å; M149-I189 HydrophobicContact CG-CG2 4.02Å; M149-I189 HydrophobicContact SD-CG2 4.13Å; I152-I189 HydrophobicContact CD1-CD1 3.66Å; I152-I189 HydrophobicContact CD1-CG1 3.72Å; I189-N191 PolarHBondContact O-N 2.89Å; I189-L192 HydrophobicContact CD1-CD1 3.97Å; I189-L192 PolarHBondContact O-N 3.22Å; I189-L192 VanDerWaalsContact O-N 3.17Å; I189-Y229 WeakPolarHBondContact CG2-OH 3.47Å; I189-N252 VanDerWaalsContact CA-OD1 3.32Å; I189-N252 WeakPolarHBondContact CA-OD1 3.17Å; I189-N252 PolarHBondContact N-OD1 3.14Å; I189-N252 VanDerWaalsContact N-OD1 3.09Å; I189-M256 HydrophobicContact CD1-CE 4.17Å
190	E	87.9	Confident	92	Very high	30 Å²	30	20.7 Å²	20.7	14%	0.14	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-67.3	-23.2	176	-42.8	94.3	98.7	0	0	113.1	M149 K188 L192	M149-E190 HydrophobicContact SD-CG 3.74Å; K188-E190 VanDerWaalsContact CB-OE2 3.28Å; K188-E190 WeakPolarHBondContact CB-OE2 3.39Å; K188-E190 VanDerWaalsContact CD-OE1 3.27Å; K188-E190 WeakPolarHBondContact CD-OE1 3.23Å; K188-E190 VanDerWaalsContact CE-OE1 3.26Å; K188-E190 WeakPolarHBondContact CE-OE1 3.39Å; K188-E190 WeakPolarHBondContact CG-OE2 3.49Å; K188-E190 IonicContact NZ-OE1 2.65Å; K188-E190 PolarHBondContact NZ-OE1 3.5Å; K188-E190 PolarHBondContact O-N 3.45Å; E190-L192 VanDerWaalsContact C-N 3.31Å
191	N	92.1	Very high	92.4	Very high	14 Å²	14	20.5 Å²	20.5	8%	0.075	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-91.3	9	177.1	-66.1	-8	0	0	0	112.1	D186 K188 I189 I203	D186-N191 PolarHBondContact O-ND2 3.09Å; D186-N191 PolarHBondContact OD2-ND2 2.87Å; K188-N191 HydrophobicContact CG-CB 4.21Å; K188-N191 WeakPolarHBondContact O-CB 3.48Å; K188-N191 PolarHBondContact O-N 2.82Å; I189-N191 PolarHBondContact O-N 2.89Å; N191-I203 HydrophobicContact CB-CG1 4.22Å; N191-I203 WeakPolarHBondContact O-CG1 3.5Å; N191-I203 PolarHBondContact O-N 2.82Å
192	L	95.5	Very high	92.8	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	97.9	178.4	-57.5	-178.7	0	0	0	110.8	L148 L170 I189 E190 I200 L202 M256	L148-L192 HydrophobicContact CB-CB 4.34Å; L148-L192 VanDerWaalsContact CB-O 3.3Å; L148-L192 WeakPolarHBondContact CB-O 3.3Å; L148-L192 HydrophobicContact CD2-CB 4.37Å; L148-L192 HydrophobicContact CD2-CD1 4.49Å; L148-L192 PolarHBondContact N-O 2.65Å; L170-L192 HydrophobicContact CD1-CD2 3.71Å; L170-L192 HydrophobicContact CD2-CD1 3.99Å; I189-L192 HydrophobicContact CD1-CD1 3.97Å; I189-L192 PolarHBondContact O-N 3.22Å; I189-L192 VanDerWaalsContact O-N 3.17Å; E190-L192 VanDerWaalsContact C-N 3.31Å; L192-I200 HydrophobicContact CD1-CD1 4.22Å; L192-I200 HydrophobicContact CD2-CG2 4.18Å; L192-L202 HydrophobicContact CD2-CD1 3.72Å; L192-M256 HydrophobicContact CD1-CE 4.09Å
193	L	96	Very high	92.9	Very high	38 Å²	38	21.2 Å²	21.2	20%	0.199	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	167.8	174.2	-57.4	-169.9	0	0	0	111.9	C143 G146 N147 I200 K201 I203	C143-L193 HydrophobicContact CB-CB 3.74Å; C143-L193 HydrophobicContact CB-CD1 3.88Å; C143-L193 HydrophobicContact CB-CG 4.49Å; G146-L193 CarbonylContact O-C 3.48Å; G146-L193 WeakPolarHBondContact O-CA 3.48Å; G146-L193 WeakPolarHBondContact O-CB 3.4Å; N147-L193 HydrophobicContact CB-CD2 4.1Å; L193-I200 CarbonylContact O-C 3.59Å; L193-I200 WeakPolarHBondContact O-CA 3.09Å; L193-K201 HydrophobicContact CB-CB 4.34Å; L193-K201 PolarHBondContact N-O 2.82Å; L193-K201 PolarHBondContact O-N 3.31Å; L193-I203 HydrophobicContact CD1-CD1 4.07Å; L193-I203 HydrophobicContact CD1-CG2 3.86Å; L193-I203 HydrophobicContact CD2-CD1 4.18Å; L193-I203 HydrophobicContact CG-CD1 3.92Å; L193-I203 HydrophobicContact CG-CG1 4.18Å; L193-I203 HydrophobicContact CG-CG2 4.07Å
194	L	95.9	Very high	92.5	Very high	5 Å²	5	23.6 Å²	23.6	3%	0.026	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.4	175.1	-66.2	173.1	0	0	0	111.3	C143 G145 G146 L148 K151 Y166 N199 I200	C143-L194 CarbonylContact C-O 3.53Å; C143-L194 WeakPolarHBondContact CB-O 3.29Å; G145-L194 VanDerWaalsContact CA-O 3.28Å; G145-L194 WeakPolarHBondContact CA-O 3.34Å; G145-L194 PolarHBondContact N-O 3.07Å; G146-L194 PolarHBondContact O-N 3.09Å; L148-L194 HydrophobicContact CB-CD1 4.48Å; L148-L194 HydrophobicContact CB-CG 4.32Å; L148-L194 HydrophobicContact CD1-CD1 4.13Å; L148-L194 HydrophobicContact CD1-CD2 4.34Å; K151-L194 HydrophobicContact CD-CD1 4.04Å; Y166-L194 HydrophobicContact CD1-CD2 4.46Å; Y166-L194 HydrophobicContact CE1-CD2 3.58Å; L194-N199 WeakPolarHBondContact CA-O 3.44Å; L194-I200 HydrophobicContact CD2-CG1 4.48Å
195	D	93.6	Very high	92	Very high	21 Å²	21	23.6 Å²	23.6	11%	0.112	12%	0.12	C	C	.	.			trans	-78.8	-171.6	171.5	72	12.4	0	0	0	112.8	D197 N198 N199 K201	D195-D197 VanDerWaalsContact C-N 3.32Å; D195-D197 PolarHBondContact O-N 3.05Å; D195-D197 PolarHBondContact OD1-N 2.61Å; D195-N198 PolarHBondContact O-N 3.21Å; D195-N198 PolarHBondContact OD1-N 3.07Å; D195-N199 PolarHBondContact N-O 3.29Å; D195-N199 PolarHBondContact OD1-N 3.38Å; D195-N199 PolarHBondContact OD1-ND2 3.1Å; D195-N199 VanDerWaalsContact OD1-ND2 3.13Å; D195-N199 WeakPolarHBondContact OD2-CB 3.34Å; D195-N199 PolarHBondContact OD2-ND2 3.23Å; D195-K201 HydrophobicContact CB-CG 3.98Å
196	E	90	Very high	91.2	Very high	56 Å²	56	24.7 Å²	24.7	26%	0.262	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.2	-179.6	61.8	-160.5	106.5	0	0	114.6	P144 K383 R387 Q396	P144-E196 HydrophobicContact CG-CB 3.78Å; E196-K383 WeakPolarHBondContact OE1-CE 3.48Å; E196-K383 IonicContact OE1-NZ 3.82Å; E196-R387 VanDerWaalsContact OE2-CD 3.28Å; E196-R387 WeakPolarHBondContact OE2-CD 3.32Å; E196-Q396 PolarHBondContact OE2-NE2 3.39Å
197	D	90.9	Very high	90.4	Very high	86 Å²	86	24.3 Å²	24.3	46%	0.46	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	18.2	178.1	-67.6	-43.5	0	0	0	111.8	R165 D195 N199 K392	R165-D197 PolarHBondContact NH2-O 3.12Å; D195-D197 VanDerWaalsContact C-N 3.32Å; D195-D197 PolarHBondContact O-N 3.05Å; D195-D197 PolarHBondContact OD1-N 2.61Å; D197-N199 PolarHBondContact O-N 3.28Å; D197-K392 IonicContact OD1-NZ 2.9Å; D197-K392 PolarHBondContact OD1-NZ 3.29Å; D197-K392 IonicContact OD2-NZ 3.44Å; D197-K392 PolarHBondContact OD2-NZ 3.09Å
198	N	93.6	Very high	89.5	Confident	44 Å²	44	24.3 Å²	24.3	24%	0.235	13%	0.132	C	C	.	.	S	Bend	trans	59.5	40.8	177.1	-178.1	75.2	0	0	0	113	K151 R165 Y166 D195	K151-N198 PolarHBondContact NZ-ND2 2.83Å; K151-N198 PolarHBondContact NZ-OD1 2.89Å; R165-N198 PolarHBondContact NH2-O 3.38Å; Y166-N198 WeakPolarHBondContact CE1-O 3.46Å; Y166-N198 VanDerWaalsContact OH-CG 3.25Å; Y166-N198 PolarHBondContact OH-ND2 3.18Å; Y166-N198 PolarHBondContact OH-OD1 3.39Å; D195-N198 PolarHBondContact O-N 3.21Å; D195-N198 PolarHBondContact OD1-N 3.07Å
199	N	95.6	Very high	88.8	Confident	34 Å²	34	23.9 Å²	23.9	18%	0.182	13%	0.131	C	C	.	.			trans	-98.8	153.5	168.1	-49.2	-69.5	0	0	0	111.5	R165 Q169 L194 D195 D197	R165-N199 PolarHBondContact NH2-OD1 3.29Å; Q169-N199 PolarHBondContact NE2-OD1 2.85Å; L194-N199 WeakPolarHBondContact CA-O 3.44Å; D195-N199 PolarHBondContact N-O 3.29Å; D195-N199 PolarHBondContact OD1-N 3.38Å; D195-N199 PolarHBondContact OD1-ND2 3.1Å; D195-N199 VanDerWaalsContact OD1-ND2 3.13Å; D195-N199 WeakPolarHBondContact OD2-CB 3.34Å; D195-N199 PolarHBondContact OD2-ND2 3.23Å; D197-N199 PolarHBondContact O-N 3.28Å
200	I	96	Very high	88	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	139	171.2	-85.9	175.4	0	0	0	111.4	N122 L148 Y166 Q169 L170 L192 L193 L194 M256	N122-I200 WeakPolarHBondContact CA-O 3.48Å; N122-I200 HydrophobicContact CB-CG2 4.48Å; N122-I200 VanDerWaalsContact CB-O 3.3Å; N122-I200 WeakPolarHBondContact CB-O 3.11Å; N122-I200 PolarHBondContact ND2-O 2.95Å; L148-I200 HydrophobicContact CD2-CD1 3.86Å; L148-I200 HydrophobicContact CD2-CG1 4.11Å; Y166-I200 HydrophobicContact CD1-CD1 4Å; Y166-I200 HydrophobicContact CD1-CG1 3.82Å; Y166-I200 HydrophobicContact CE1-CG1 4.47Å; Y166-I200 HydrophobicContact CG-CD1 4.09Å; Y166-I200 HydrophobicContact CG-CG1 4.39Å; Q169-I200 HydrophobicContact CB-CB 4.28Å; L170-I200 HydrophobicContact CB-CD1 4.43Å; L192-I200 HydrophobicContact CD1-CD1 4.22Å; L192-I200 HydrophobicContact CD2-CG2 4.18Å; L193-I200 CarbonylContact O-C 3.59Å; L193-I200 WeakPolarHBondContact O-CA 3.09Å; L194-I200 HydrophobicContact CD2-CG1 4.48Å; I200-M256 HydrophobicContact CD1-CE 4.4Å
201	K	96.6	Very high	86.7	Confident	17 Å²	17	24.7 Å²	24.7	7%	0.074	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	106.2	165.6	-71.8	-72.3	-172	171.8	0	108.4	P121 E141 L193 D195	P121-K201 WeakPolarHBondContact O-CD 3.2Å; P121-K201 VanDerWaalsContact O-CE 3.25Å; P121-K201 WeakPolarHBondContact O-CE 3.43Å; P121-K201 PolarHBondContact O-NZ 3.5Å; E141-K201 WeakPolarHBondContact OE1-CE 3.45Å; E141-K201 IonicContact OE1-NZ 3.36Å; E141-K201 PolarHBondContact OE1-NZ 3.22Å; E141-K201 IonicContact OE2-NZ 3.24Å; E141-K201 PolarHBondContact OE2-NZ 3.09Å; L193-K201 HydrophobicContact CB-CB 4.34Å; L193-K201 PolarHBondContact N-O 2.82Å; L193-K201 PolarHBondContact O-N 3.31Å; D195-K201 HydrophobicContact CB-CG 3.98Å
202	L	96.5	Very high	84.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	138.4	174.8	-178.7	58.9	0	0	0	110.5	N122 I123 T124 A173 L177 L187 L192	N122-L202 PolarHBondContact O-N 2.75Å; I123-L202 HydrophobicContact CG1-CB 4.38Å; I123-L202 HydrophobicContact CG1-CD2 4.5Å; T124-L202 WeakPolarHBondContact CB-O 3.27Å; T124-L202 PolarHBondContact N-O 3.28Å; T124-L202 PolarHBondContact OG1-O 2.85Å; A173-L202 HydrophobicContact CB-CD2 4.32Å; L177-L202 HydrophobicContact CD1-CD2 3.98Å; L187-L202 HydrophobicContact CD2-CD1 3.67Å; L187-L202 HydrophobicContact CD2-CD2 4.03Å; L192-L202 HydrophobicContact CD2-CD1 3.72Å
203	I	92.3	Very high	82.5	Confident	36 Å²	36	30.7 Å²	30.7	19%	0.185	18%	0.184	C	C	.	.			trans	-131.7	166.9	179.7	57.4	157.2	0	0	0	112.9	T124 N191 L193	T124-I203 HydrophobicContact CG2-CG2 4.31Å; T124-I203 WeakPolarHBondContact OG1-CG2 3.45Å; N191-I203 HydrophobicContact CB-CG1 4.22Å; N191-I203 WeakPolarHBondContact O-CG1 3.5Å; N191-I203 PolarHBondContact O-N 2.82Å; L193-I203 HydrophobicContact CD1-CD1 4.07Å; L193-I203 HydrophobicContact CD1-CG2 3.86Å; L193-I203 HydrophobicContact CD2-CD1 4.18Å; L193-I203 HydrophobicContact CG-CD1 3.92Å; L193-I203 HydrophobicContact CG-CG1 4.18Å; L193-I203 HydrophobicContact CG-CG2 4.07Å
204	D	82.9	Confident	80.1	Confident	52 Å²	52	33.5 Å²	33.5	28%	0.278	20%	0.199	S	C	.	.			trans	65	83.7	172.9	-149.2	-33.6	0	0	0	116.9	K91 H184 G206	K91-D204 WeakPolarHBondContact CE-OD2 3.35Å; K91-D204 IonicContact NZ-OD1 2.69Å; K91-D204 PolarHBondContact NZ-OD1 3.04Å; K91-D204 IonicContact NZ-OD2 3.62Å; K91-D204 PolarHBondContact NZ-OD2 3Å; H184-D204 PolarHBondContact CE1-O 2.78Å; H184-D204 VanDerWaalsContact CE1-O 3.25Å; D204-G206 PolarHBondContact O-N 3.2Å; D204-G206 WeakPolarHBondContact OD1-CA 3.47Å; D204-G206 PolarHBondContact OD1-N 3.02Å
205	F	81.3	Confident	77.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-80.6	12.2	172.2	-66	-86.4	0	0	0	113.7	E111 I114 Q115 I123 L177 L207 S208	E111-F205 HydrophobicContact CG-CB 3.95Å; I114-F205 HydrophobicContact CG2-CB 4.49Å; I114-F205 HydrophobicContact CG2-CD1 4.03Å; I114-F205 HydrophobicContact CG2-CG 4.46Å; Q115-F205 HydrophobicContact CB-CD2 3.92Å; Q115-F205 HydrophobicContact CB-CE2 4.46Å; Q115-F205 HydrophobicContact CB-CG 4.38Å; Q115-F205 HydrophobicContact CG-CD2 3.71Å; Q115-F205 HydrophobicContact CG-CE2 3.87Å; I123-F205 HydrophobicContact CG2-CE2 3.79Å; I123-F205 HydrophobicContact CG2-CZ 3.62Å; L177-F205 HydrophobicContact CD1-CE1 3.8Å; L177-F205 HydrophobicContact CD1-CZ 4.34Å; L177-F205 HydrophobicContact CD2-CE1 3.61Å; L177-F205 HydrophobicContact CD2-CZ 4.19Å; L177-F205 HydrophobicContact CG-CE1 4.38Å; F205-L207 PolarHBondContact O-N 3.36Å; F205-S208 WeakPolarHBondContact CA-OG 3.46Å; F205-S208 WeakPolarHBondContact CD1-OG 3.46Å; F205-S208 PolarHBondContact O-N 3.07Å; F205-S208 VanDerWaalsContact O-N 3.09Å
206	G	73.3	Confident	74.8	Confident	31 Å²	31	42.9 Å²	42.9	32%	0.32	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-63.7	-21.2	-174.2	0	0	0	0	0	114.9	D204	D204-G206 PolarHBondContact O-N 3.2Å; D204-G206 WeakPolarHBondContact OD1-CA 3.47Å; D204-G206 PolarHBondContact OD1-N 3.02Å
207	L	72.2	Confident	72.6	Confident	14 Å²	14	45.8 Å²	45.8	7%	0.073	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-108.1	-4.9	173.3	-72.4	-179.6	0	0	0	114.3	H184 R185 D186 F205 C224 I668	H184-L207 CarbonylContact O-C 3.49Å; R185-L207 VanDerWaalsContact CZ-O 3.25Å; R185-L207 PolarHBondContact NE-O 3.18Å; R185-L207 PolarHBondContact NH2-O 2.71Å; D186-L207 HydrophobicContact CB-CB 4.11Å; D186-L207 HydrophobicContact CB-CD1 3.84Å; F205-L207 PolarHBondContact O-N 3.36Å; L207-C224 HydrophobicContact CD1-CB 4.24Å; L207-C224 HydrophobicContact CD2-CB 4.03Å; L207-I668 HydrophobicContact CD1-CD1 4.14Å; L207-I668 HydrophobicContact CD2-CD1 4.3Å
208	S	74.1	Confident	70.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	28%	0.282	C	S	.	.			trans	-67.9	158.3	-179.7	-48.9	0	0	0	0	112.6	R110 V183 H184 F205	R110-S208 VanDerWaalsContact CD-O 3.26Å; R110-S208 WeakPolarHBondContact CD-O 3.24Å; V183-S208 VanDerWaalsContact O-CA 3.29Å; V183-S208 WeakPolarHBondContact O-CA 3.36Å; V183-S208 WeakPolarHBondContact O-CB 3.4Å; H184-S208 WeakPolarHBondContact O-CA 3.33Å; H184-S208 PolarHBondContact O-N 3.19Å; H184-S208 PolarHBondContact O-OG 3.3Å; F205-S208 WeakPolarHBondContact CA-OG 3.46Å; F205-S208 WeakPolarHBondContact CD1-OG 3.46Å; F205-S208 PolarHBondContact O-N 3.07Å; F205-S208 VanDerWaalsContact O-N 3.09Å
209	N	78.1	Confident	68.7	Low	19 Å²	19	46.5 Å²	46.5	10%	0.102	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	154.3	176.9	-159.4	30.2	0	0	0	111.7	V183 F220	V183-N209 PolarHBondContact N-O 3.25Å; V183-N209 PolarHBondContact O-N 2.75Å; N209-F220 HydrophobicContact CB-CE1 4.09Å; N209-F220 HydrophobicContact CB-CZ 4.28Å; N209-F220 WeakPolarHBondContact ND2-CE1 3.49Å
210	C	73.9	Confident	67	Low	4 Å²	4	45.9 Å²	45.9	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.9	177.7	-48.8	0	0	0	0	110.8	G181 I213 L214	G181-C210 CarbonylContact O-C 3.54Å; G181-C210 VanDerWaalsContact O-CA 3.31Å; G181-C210 WeakPolarHBondContact O-CA 3.25Å; C210-I213 HydrophobicContact CB-CB 4.09Å; C210-L214 HydrophobicContact CB-CD1 4.39Å; C210-L214 HydrophobicContact CB-CG 4.4Å
211	A	61.1	Low	65.1	Low	45 Å²	45	49.6 Å²	49.6	37%	0.372	31%	0.311	S	S	.	.	S	Bend	trans	-80.9	135.3	166.2	0	0	0	0	0	109.4	G181 I213 F220	G181-A211 PolarHBondContact O-N 3.44Å; A211-I213 PolarHBondContact O-N 3.48Å; A211-F220 HydrophobicContact CB-CZ 4.03Å
212	G	52.8	Low	63.7	Low	45 Å²	45	51.1 Å²	51.1	46%	0.464	32%	0.321	S	S	.	.	S	Bend	trans	71.2	-50.8	177.3	0	0	0	0	0	115.9	L214 G215 Y216	G212-L214 PolarHBondContact O-N 2.87Å; G212-G215 PolarHBondContact O-N 3.24Å; G212-Y216 WeakPolarHBondContact CA-O 3.46Å; G212-Y216 PolarHBondContact N-O 2.85Å
213	I	46.8	Very low	62.1	Low	97 Å²	97	52.8 Å²	52.8	50%	0.497	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.8	-167.1	-62.1	170	0	0	0	113.7	A180 C210 A211	A180-I213 WeakPolarHBondContact O-CD1 3.27Å; C210-I213 HydrophobicContact CB-CB 4.09Å; A211-I213 PolarHBondContact O-N 3.48Å
214	L	44.1	Very low	61	Low	97 Å²	97	51.5 Å²	51.5	51%	0.508	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	25	176.5	-64.7	176.2	0	0	0	113.4	C210 G212 Y216	C210-L214 HydrophobicContact CB-CD1 4.39Å; C210-L214 HydrophobicContact CB-CG 4.4Å; G212-L214 PolarHBondContact O-N 2.87Å; L214-Y216 VanDerWaalsContact C-N 3.28Å; L214-Y216 HydrophobicContact CB-CD2 4.32Å; L214-Y216 WeakPolarHBondContact O-CD2 3.41Å; L214-Y216 PolarHBondContact O-N 3.22Å
215	G	38.7	Very low	60.7	Low	70 Å²	70	49.7 Å²	49.7	72%	0.722	32%	0.317	S	S	*	.	S	Bend	trans	80.2	1.8	179.1	0	0	0	0	0	115.2	G212 S217	G212-G215 PolarHBondContact O-N 3.24Å; G215-S217 PolarHBondContact O-N 2.97Å
216	Y	40.4	Very low	60.8	Low	153 Å²	153	51 Å²	51	60%	0.6	33%	0.326	S	S	*	.			trans	-91.3	92.2	174.4	-68.2	-89.3	0	0	0	110.1	G212 L214 D218	G212-Y216 WeakPolarHBondContact CA-O 3.46Å; G212-Y216 PolarHBondContact N-O 2.85Å; L214-Y216 VanDerWaalsContact C-N 3.28Å; L214-Y216 HydrophobicContact CB-CD2 4.32Å; L214-Y216 WeakPolarHBondContact O-CD2 3.41Å; L214-Y216 PolarHBondContact O-N 3.22Å; Y216-D218 VanDerWaalsContact C-N 3.34Å
217	S	42.7	Very low	61.5	Low	117 Å²	117	50.9 Å²	50.9	82%	0.818	32%	0.32	S	S	*	.			trans	-77	-20	169.4	49.6	0	0	0	0	113.2	G215	G215-S217 PolarHBondContact O-N 2.97Å
218	D	46.7	Very low	62.3	Low	86 Å²	86	50.9 Å²	50.9	46%	0.46	32%	0.322	S	S	.	.	S	Bend	trans	-85	140.1	-176.3	-156.7	37.2	0	0	0	111.9	Y216 K239	Y216-D218 VanDerWaalsContact C-N 3.34Å; D218-K239 WeakPolarHBondContact OD1-CE 3.36Å; D218-K239 IonicContact OD1-NZ 3.84Å; D218-K239 PolarHBondContact OD1-NZ 3.41Å; D218-K239 WeakPolarHBondContact OD2-CE 2.94Å; D218-K239 IonicContact OD2-NZ 3.14Å; D218-K239 PolarHBondContact OD2-NZ 2.93Å
219	P	57.4	Low	63.2	Low	60 Å²	60	51.2 Å²	51.2	39%	0.39	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-59.8	149.7	178.9	-23.6	33.7	0	0	0	112.8	K239	P219-K239 HydrophobicContact CB-CB 3.87Å; P219-K239 HydrophobicContact CB-CD 4.36Å; P219-K239 HydrophobicContact CB-CG 4.12Å; P219-K239 HydrophobicContact CG-CB 4.37Å; P219-K239 HydrophobicContact CG-CD 4.26Å
220	F	59.7	Low	63.9	Low	20 Å²	20	50.6 Å²	50.6	9%	0.088	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-64.5	144.9	-174.6	-51.7	-59.3	0	0	0	111.9	V183 N209 A211 Y240	V183-F220 HydrophobicContact CB-CE2 4.01Å; V183-F220 HydrophobicContact CG2-CE2 3.81Å; V183-F220 HydrophobicContact CG2-CZ 4.49Å; N209-F220 HydrophobicContact CB-CE1 4.09Å; N209-F220 HydrophobicContact CB-CZ 4.28Å; N209-F220 WeakPolarHBondContact ND2-CE1 3.49Å; A211-F220 HydrophobicContact CB-CZ 4.03Å; F220-Y240 HydrophobicContact CB-CD1 4.21Å; F220-Y240 HydrophobicContact CB-CD2 3.94Å; F220-Y240 HydrophobicContact CB-CE1 3.73Å; F220-Y240 HydrophobicContact CB-CE2 3.42Å; F220-Y240 VanDerWaalsContact CB-CE2 3.42Å; F220-Y240 HydrophobicContact CB-CG 4.31Å; F220-Y240 HydrophobicContact CD2-CD2 4.1Å; F220-Y240 AromaticContact CD2-CE2 3.75Å; F220-Y240 HydrophobicContact CD2-CE2 3.75Å; F220-Y240 HydrophobicContact CG-CE2 4Å; F220-Y240 PolarHBondContact N-O 2.87Å; F220-Y240 WeakPolarHBondContact O-CD1 3.43Å; F220-Y240 WeakPolarHBondContact O-CE1 3.46Å; F220-Y240 PolarHBondContact O-N 3.28Å
221	S	56.1	Low	64.9	Low	78 Å²	78	50.4 Å²	50.4	55%	0.545	32%	0.32	S	S	.	.			trans	-130.5	-4.1	-177.8	58.9	0	0	0	0	113.9
222	T	66.1	Low	66.5	Low	49 Å²	49	48.4 Å²	48.4	30%	0.301	30%	0.303	S	S	.	.			trans	-77.7	127.9	177.8	-48.5	0	0	0	0	110.7	Y240 L672	T222-Y240 WeakPolarHBondContact O-CE1 3.41Å; T222-Y240 PolarHBondContact O-OH 3.04Å; T222-L672 HydrophobicContact CG2-CD2 4.24Å
223	Q	63.2	Low	68.4	Low	36 Å²	36	47 Å²	47	17%	0.168	28%	0.284	C	S	.	.			trans	-77	128.1	166.8	-61	-163.2	-68.2	0	0	110.3	L234 L235 R237	Q223-L234 PolarHBondContact NE2-O 3.24Å; Q223-L235 PolarHBondContact NE2-O 2.82Å; Q223-R237 VanDerWaalsContact CD-CG 3.48Å; Q223-R237 HydrophobicContact CG-CG 4Å; Q223-R237 VanDerWaalsContact OE1-CZ 3.23Å
224	C	70.4	Confident	70.4	Confident	8 Å²	8	42.6 Å²	42.6	5%	0.054	26%	0.262	C	S	.	.			trans	-155.8	169.1	178	57	0	0	0	0	110.4	L207	L207-C224 HydrophobicContact CD1-CB 4.24Å; L207-C224 HydrophobicContact CD2-CB 4.03Å
225	G	76	Confident	72.5	Confident	15 Å²	15	39.1 Å²	39.1	16%	0.155	24%	0.243	C	C	.	.	S	Bend	trans	82.3	171.3	-178.9	0	0	0	0	0	114.2	D186	D186-G225 WeakPolarHBondContact OD1-CA 3.48Å
226	S	82.9	Confident	74.7	Confident	27 Å²	27	37.5 Å²	37.5	19%	0.189	22%	0.223	C	C	.	.			trans	-71.7	126.6	178	-73.5	0	0	0	0	112.1	D186 A228 Y229 A230	D186-S226 PolarHBondContact OD1-N 3.37Å; S226-A228 VanDerWaalsContact C-N 3.28Å; S226-A228 PolarHBondContact O-N 2.86Å; S226-A228 VanDerWaalsContact O-N 3.12Å; S226-Y229 PolarHBondContact O-N 2.86Å; S226-A230 PolarHBondContact O-N 3.29Å; S226-A230 VanDerWaalsContact O-N 3.15Å
227	P	87.3	Confident	76.6	Confident	29 Å²	29	37.1 Å²	37.1	19%	0.188	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-32.1	-174.6	-29.5	36.2	0	0	0	116.1	Y229 A230 L270 L273	P227-Y229 VanDerWaalsContact C-N 3.29Å; P227-Y229 PolarHBondContact O-N 3.19Å; P227-A230 PolarHBondContact O-N 3.25Å; P227-L270 HydrophobicContact CB-CD1 4.05Å; P227-L273 HydrophobicContact CB-CD2 4.42Å
228	A	89.6	Confident	78.4	Confident	13 Å²	13	37.5 Å²	37.5	11%	0.107	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.6	177.7	0	0	0	0	0	114.1	S226 L261	S226-A228 VanDerWaalsContact C-N 3.28Å; S226-A228 PolarHBondContact O-N 2.86Å; S226-A228 VanDerWaalsContact O-N 3.12Å; A228-L261 HydrophobicContact CB-CD1 3.7Å; A228-L261 HydrophobicContact CB-CD2 4.1Å
229	Y	93.4	Very high	80	Confident	7 Å²	7	39.3 Å²	39.3	3%	0.027	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-12.1	178	-65.4	-91.5	0	0	0	112.7	L187 K188 I189 S226 P227 S248 V251 L261	L187-Y229 WeakPolarHBondContact O-CD1 3.29Å; K188-Y229 HydrophobicContact CB-CD1 3.83Å; K188-Y229 HydrophobicContact CB-CD2 3.7Å; K188-Y229 HydrophobicContact CB-CE1 3.9Å; K188-Y229 HydrophobicContact CB-CE2 3.76Å; K188-Y229 HydrophobicContact CB-CG 3.73Å; I189-Y229 WeakPolarHBondContact CG2-OH 3.47Å; S226-Y229 PolarHBondContact O-N 2.86Å; P227-Y229 VanDerWaalsContact C-N 3.29Å; P227-Y229 PolarHBondContact O-N 3.19Å; Y229-S248 WeakPolarHBondContact O-CB 3.37Å; Y229-S248 PolarHBondContact O-OG 3.05Å; Y229-V251 HydrophobicContact CD1-CB 3.96Å; Y229-V251 HydrophobicContact CD1-CG1 3.4Å; Y229-V251 VanDerWaalsContact CD1-CG1 3.4Å; Y229-V251 HydrophobicContact CE1-CG1 3.68Å; Y229-V251 HydrophobicContact CG-CG1 4.07Å; Y229-L261 HydrophobicContact CE1-CD2 4.44Å; Y229-L261 HydrophobicContact CE2-CD2 4.33Å
230	A	92.5	Very high	81.1	Confident	7 Å²	7	36.7 Å²	36.7	6%	0.058	19%	0.194	C	C	.	.	S	Bend	trans	-72.1	141.1	-179	0	0	0	0	0	112	S226 P227 L234 L235 W247	S226-A230 PolarHBondContact O-N 3.29Å; S226-A230 VanDerWaalsContact O-N 3.15Å; P227-A230 PolarHBondContact O-N 3.25Å; A230-L234 HydrophobicContact CB-CD2 3.95Å; A230-L234 HydrophobicContact CB-CG 4.47Å; A230-L235 HydrophobicContact CB-CD2 3.61Å; A230-L235 HydrophobicContact CB-CG 4.12Å; A230-W247 PolarHBondContact O-NE1 3.18Å
231	A	94.6	Very high	82.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.			trans	-70.5	148.8	173	0	0	0	0	0	111.5	E233 L234 L235 I244 W247	A231-E233 VanDerWaalsContact C-N 3.25Å; A231-E233 WeakPolarHBondContact CB-OE2 3.41Å; A231-E233 PolarHBondContact O-N 3.44Å; A231-L234 VanDerWaalsContact O-CB 3.31Å; A231-L234 WeakPolarHBondContact O-CB 3.24Å; A231-L234 PolarHBondContact O-N 2.71Å; A231-L235 PolarHBondContact O-N 3.16Å; A231-I244 HydrophobicContact CB-CB 3.98Å; A231-I244 HydrophobicContact CB-CG2 3.89Å; A231-W247 VanDerWaalsContact CA-CD1 3.43Å; A231-W247 HydrophobicContact CB-CB 3.81Å; A231-W247 HydrophobicContact CB-CD2 4.31Å; A231-W247 HydrophobicContact CB-CG 3.74Å
232	P	94.3	Very high	84.2	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.019	20%	0.198	C	C	.	.	H	α-helix	trans	-58.7	-34.3	-175.8	20.7	-31.7	0	0	0	112.9	L234 L235 A236 W247 Y274 M277 V278 P303	P232-L234 VanDerWaalsContact C-N 3.3Å; P232-L234 PolarHBondContact O-N 3.19Å; P232-L235 PolarHBondContact O-N 2.91Å; P232-A236 WeakPolarHBondContact O-CB 3.38Å; P232-A236 PolarHBondContact O-N 3.06Å; P232-W247 HydrophobicContact CG-CE3 4.47Å; P232-W247 HydrophobicContact CG-CH2 4.15Å; P232-W247 HydrophobicContact CG-CZ3 4.12Å; P232-Y274 HydrophobicContact CB-CD2 3.91Å; P232-Y274 HydrophobicContact CB-CE2 3.8Å; P232-Y274 VanDerWaalsContact O-CE2 3.31Å; P232-Y274 WeakPolarHBondContact O-CE2 3.33Å; P232-M277 HydrophobicContact CB-CB 4.26Å; P232-V278 HydrophobicContact CB-CG2 4.43Å; P232-P303 HydrophobicContact CG-CB 3.98Å
233	E	92.7	Very high	85.5	Confident	14 Å²	14	36.5 Å²	36.5	7%	0.065	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-31.6	176	67.1	-88.1	-154.3	0	0	113.7	A231 A236 R237 K238 I244 R308	A231-E233 VanDerWaalsContact C-N 3.25Å; A231-E233 WeakPolarHBondContact CB-OE2 3.41Å; A231-E233 PolarHBondContact O-N 3.44Å; E233-A236 PolarHBondContact O-N 3.43Å; E233-R237 PolarHBondContact O-N 2.87Å; E233-K238 HydrophobicContact CB-CB 4.38Å; E233-K238 PolarHBondContact O-N 3.07Å; E233-K238 VanDerWaalsContact O-N 3.07Å; E233-I244 HydrophobicContact CG-CG2 4.08Å; E233-I244 WeakPolarHBondContact OE1-CG2 3.4Å; E233-R308 IonicContact OE1-CZ 3.61Å; E233-R308 IonicContact OE1-NH1 2.76Å; E233-R308 PolarHBondContact OE1-NH1 2.9Å; E233-R308 IonicContact OE1-NH2 3.07Å; E233-R308 PolarHBondContact OE1-NH2 2.98Å; E233-R308 IonicContact OE2-CZ 3.26Å; E233-R308 IonicContact OE2-NH1 2.69Å; E233-R308 IonicContact OE2-NH2 3.09Å; E233-R308 PolarHBondContact OE2-NH2 3.46Å
234	L	88.9	Confident	87	Confident	6 Å²	6	34.9 Å²	34.9	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-72	-37.8	175.6	179.2	61	0	0	0	110.8	Q223 A230 A231 P232 R237 Y240 I244	Q223-L234 PolarHBondContact NE2-O 3.24Å; A230-L234 HydrophobicContact CB-CD2 3.95Å; A230-L234 HydrophobicContact CB-CG 4.47Å; A231-L234 VanDerWaalsContact O-CB 3.31Å; A231-L234 WeakPolarHBondContact O-CB 3.24Å; A231-L234 PolarHBondContact O-N 2.71Å; P232-L234 VanDerWaalsContact C-N 3.3Å; P232-L234 PolarHBondContact O-N 3.19Å; L234-R237 PolarHBondContact O-N 2.96Å; L234-Y240 HydrophobicContact CD1-CD1 3.72Å; L234-Y240 HydrophobicContact CD1-CE1 3.24Å; L234-Y240 HydrophobicContact CD1-CE2 4.19Å; L234-Y240 HydrophobicContact CD1-CG 4.37Å; L234-I244 HydrophobicContact CD2-CD1 4.04Å
235	L	88.4	Confident	88.3	Confident	23 Å²	23	34.5 Å²	34.5	12%	0.12	18%	0.184	C	C	.	.	H	α-helix	trans	-68.7	-38.5	173.2	-58.6	-170.3	0	0	0	111.8	Q223 A230 A231 P232 R237 L270 Y274 M277	Q223-L235 PolarHBondContact NE2-O 2.82Å; A230-L235 HydrophobicContact CB-CD2 3.61Å; A230-L235 HydrophobicContact CB-CG 4.12Å; A231-L235 PolarHBondContact O-N 3.16Å; P232-L235 PolarHBondContact O-N 2.91Å; L235-R237 PolarHBondContact O-N 2.85Å; L235-L270 HydrophobicContact CD1-CD1 4.05Å; L235-L270 HydrophobicContact CD2-CD1 4.04Å; L235-Y274 HydrophobicContact CB-CD2 4.19Å; L235-M277 HydrophobicContact CD1-CE 4.34Å; L235-M277 HydrophobicContact CD1-SD 3.81Å
236	A	85.8	Confident	89.3	Confident	36 Å²	36	33.9 Å²	33.9	30%	0.298	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	0.7	176.7	0	0	0	0	0	115	P232 E233 K238 Y274	P232-A236 WeakPolarHBondContact O-CB 3.38Å; P232-A236 PolarHBondContact O-N 3.06Å; E233-A236 PolarHBondContact O-N 3.43Å; A236-K238 HydrophobicContact CB-CD 4.3Å; A236-K238 HydrophobicContact CB-CG 4.08Å; A236-K238 PolarHBondContact O-N 3.01Å; A236-Y274 HydrophobicContact CB-CE2 3.74Å
237	R	79.4	Confident	90.1	Very high	145 Å²	145	32.6 Å²	32.6	55%	0.547	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	22.2	-179	-58	178.7	169.7	-161.6	-9.7	114.3	Q223 E233 L234 L235	Q223-R237 VanDerWaalsContact CD-CG 3.48Å; Q223-R237 HydrophobicContact CG-CG 4Å; Q223-R237 VanDerWaalsContact OE1-CZ 3.23Å; E233-R237 PolarHBondContact O-N 2.87Å; L234-R237 PolarHBondContact O-N 2.96Å; L235-R237 PolarHBondContact O-N 2.85Å
238	K	81.4	Confident	90.6	Very high	126 Å²	126	31.5 Å²	31.5	55%	0.548	16%	0.161	S	C	.	.			trans	-74.2	157.7	175.1	-65.1	-178.5	178.4	-179.5	0	109.7	E233 A236 Y240	E233-K238 HydrophobicContact CB-CB 4.38Å; E233-K238 PolarHBondContact O-N 3.07Å; E233-K238 VanDerWaalsContact O-N 3.07Å; A236-K238 HydrophobicContact CB-CD 4.3Å; A236-K238 HydrophobicContact CB-CG 4.08Å; A236-K238 PolarHBondContact O-N 3.01Å; K238-Y240 PolarHBondContact O-N 3.2Å
239	K	79.1	Confident	91	Very high	123 Å²	123	30.9 Å²	30.9	54%	0.535	16%	0.156	S	C	.	.			trans	-59.1	125.9	168.2	-90	-177.1	174.7	-172.1	0	109.2	D218 P219	D218-K239 WeakPolarHBondContact OD1-CE 3.36Å; D218-K239 IonicContact OD1-NZ 3.84Å; D218-K239 PolarHBondContact OD1-NZ 3.41Å; D218-K239 WeakPolarHBondContact OD2-CE 2.94Å; D218-K239 IonicContact OD2-NZ 3.14Å; D218-K239 PolarHBondContact OD2-NZ 2.93Å; P219-K239 HydrophobicContact CB-CB 3.87Å; P219-K239 HydrophobicContact CB-CD 4.36Å; P219-K239 HydrophobicContact CB-CG 4.12Å; P219-K239 HydrophobicContact CG-CB 4.37Å; P219-K239 HydrophobicContact CG-CD 4.26Å
240	Y	82.5	Confident	91.2	Very high	6 Å²	6	30.5 Å²	30.5	2%	0.024	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-128.3	152.1	-173.6	68.1	-95.5	0	0	0	113.7	R185 F220 T222 L234 K238 I244	R185-Y240 PolarHBondContact NH1-OH 3.38Å; F220-Y240 HydrophobicContact CB-CD1 4.21Å; F220-Y240 HydrophobicContact CB-CD2 3.94Å; F220-Y240 HydrophobicContact CB-CE1 3.73Å; F220-Y240 HydrophobicContact CB-CE2 3.42Å; F220-Y240 VanDerWaalsContact CB-CE2 3.42Å; F220-Y240 HydrophobicContact CB-CG 4.31Å; F220-Y240 HydrophobicContact CD2-CD2 4.1Å; F220-Y240 AromaticContact CD2-CE2 3.75Å; F220-Y240 HydrophobicContact CD2-CE2 3.75Å; F220-Y240 HydrophobicContact CG-CE2 4Å; F220-Y240 PolarHBondContact N-O 2.87Å; F220-Y240 WeakPolarHBondContact O-CD1 3.43Å; F220-Y240 WeakPolarHBondContact O-CE1 3.46Å; F220-Y240 PolarHBondContact O-N 3.28Å; T222-Y240 WeakPolarHBondContact O-CE1 3.41Å; T222-Y240 PolarHBondContact O-OH 3.04Å; L234-Y240 HydrophobicContact CD1-CD1 3.72Å; L234-Y240 HydrophobicContact CD1-CE1 3.24Å; L234-Y240 HydrophobicContact CD1-CE2 4.19Å; L234-Y240 HydrophobicContact CD1-CG 4.37Å; K238-Y240 PolarHBondContact O-N 3.2Å; Y240-I244 HydrophobicContact CD2-CD1 3.54Å; Y240-I244 HydrophobicContact CD2-CG1 4.04Å; Y240-I244 HydrophobicContact CD2-CG2 3.89Å; Y240-I244 HydrophobicContact CE2-CD1 3.44Å; Y240-I244 VanDerWaalsContact CE2-CD1 3.44Å; Y240-I244 HydrophobicContact CE2-CG1 4.37Å; Y240-I244 HydrophobicContact CG-CG2 4.14Å
241	G	87.3	Confident	91.5	Very high	32 Å²	32	30.2 Å²	30.2	33%	0.33	15%	0.152	S	C	.	.			trans	-124	-167.3	179.3	0	0	0	0	0	112.9	K243 I244	G241-K243 PolarHBondContact O-N 3.17Å; G241-I244 PolarHBondContact O-N 3.18Å
242	P	91.6	Very high	91.6	Very high	59 Å²	59	30.2 Å²	30.2	38%	0.383	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.4	-171.1	-23.9	32.5	0	0	0	115.6	H178 V183 I244 D245	H178-P242 PolarHBondContact CE1-O 2.89Å; H178-P242 WeakPolarHBondContact ND1-CB 3.35Å; V183-P242 HydrophobicContact CG2-CB 3.92Å; V183-P242 HydrophobicContact CG2-CG 3.78Å; P242-I244 PolarHBondContact O-N 2.76Å; P242-D245 PolarHBondContact O-N 2.81Å
243	K	95	Very high	91.8	Very high	52 Å²	52	30 Å²	30	23%	0.226	15%	0.151	C	C	.	.	H	α-helix	trans	-60.3	-10.7	178.2	-70.9	-172.8	-179.6	-172.2	0	114.9	G241 D245 V246 W247 P305 V306 R308	G241-K243 PolarHBondContact O-N 3.17Å; K243-D245 VanDerWaalsContact C-N 3.31Å; K243-V246 PolarHBondContact O-N 2.76Å; K243-W247 PolarHBondContact O-N 3.08Å; K243-P305 WeakPolarHBondContact CD-O 3.2Å; K243-P305 WeakPolarHBondContact CE-O 3.28Å; K243-P305 PolarHBondContact NZ-O 3.18Å; K243-V306 PolarHBondContact NZ-O 2.8Å; K243-R308 VanDerWaalsContact CE-O 3.23Å; K243-R308 WeakPolarHBondContact CE-O 3.31Å; K243-R308 PolarHBondContact NZ-O 2.69Å; K243-R308 PolarHBondContact O-NH1 3.03Å
244	I	94.8	Very high	92.1	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-35.8	170.3	65.1	158.9	0	0	0	112.1	V183 R185 A231 E233 L234 Y240 G241 P242 V246 W247 S248	V183-I244 HydrophobicContact CG1-CG1 4.19Å; R185-I244 HydrophobicContact CB-CD1 4.07Å; R185-I244 HydrophobicContact CG-CD1 4Å; A231-I244 HydrophobicContact CB-CB 3.98Å; A231-I244 HydrophobicContact CB-CG2 3.89Å; E233-I244 HydrophobicContact CG-CG2 4.08Å; E233-I244 WeakPolarHBondContact OE1-CG2 3.4Å; L234-I244 HydrophobicContact CD2-CD1 4.04Å; Y240-I244 HydrophobicContact CD2-CD1 3.54Å; Y240-I244 HydrophobicContact CD2-CG1 4.04Å; Y240-I244 HydrophobicContact CD2-CG2 3.89Å; Y240-I244 HydrophobicContact CE2-CD1 3.44Å; Y240-I244 VanDerWaalsContact CE2-CD1 3.44Å; Y240-I244 HydrophobicContact CE2-CG1 4.37Å; Y240-I244 HydrophobicContact CG-CG2 4.14Å; G241-I244 PolarHBondContact O-N 3.18Å; P242-I244 PolarHBondContact O-N 2.76Å; I244-V246 VanDerWaalsContact C-N 3.28Å; I244-V246 PolarHBondContact O-N 3.39Å; I244-W247 WeakPolarHBondContact O-CB 3.39Å; I244-W247 PolarHBondContact O-N 2.81Å; I244-S248 PolarHBondContact O-N 2.73Å; I244-S248 PolarHBondContact O-OG 3.31Å
245	D	96.5	Very high	92.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.4	-32.6	178.8	-72.2	-17.6	0	0	0	110.4	V174 H178 V183 H184 R185 L187 P242 K243 W247 S248 I249	V174-D245 HydrophobicContact CG1-CB 3.89Å; H178-D245 IonicContact CD2-OD2 3.31Å; H178-D245 IonicContact CE1-OD2 3.82Å; H178-D245 IonicContact NE2-OD2 3.71Å; H178-D245 PolarHBondContact NE2-OD2 2.99Å; V183-D245 VanDerWaalsContact CG1-OD2 3.24Å; V183-D245 WeakPolarHBondContact CG1-OD2 3.49Å; H184-D245 PolarHBondContact N-OD2 2.76Å; R185-D245 PolarHBondContact N-OD1 2.71Å; L187-D245 HydrophobicContact CD1-CB 3.63Å; P242-D245 PolarHBondContact O-N 2.81Å; K243-D245 VanDerWaalsContact C-N 3.31Å; D245-W247 PolarHBondContact O-N 3.19Å; D245-S248 PolarHBondContact O-N 3.24Å; D245-I249 VanDerWaalsContact O-CG1 3.3Å; D245-I249 WeakPolarHBondContact O-CG1 3.36Å; D245-I249 PolarHBondContact O-N 2.81Å
246	V	98.1	Very high	92.9	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-40.1	176.1	-177.8	0	0	0	0	111.5	K243 I244 I249 G250 L300 R308 P309 I311	K243-V246 PolarHBondContact O-N 2.76Å; I244-V246 VanDerWaalsContact C-N 3.28Å; I244-V246 PolarHBondContact O-N 3.39Å; V246-I249 PolarHBondContact O-N 3.21Å; V246-G250 PolarHBondContact O-N 3.34Å; V246-G250 VanDerWaalsContact O-N 3.14Å; V246-L300 HydrophobicContact CG1-CD2 3.54Å; V246-R308 HydrophobicContact CG1-CG 4.35Å; V246-P309 HydrophobicContact CG1-CG 4.41Å; V246-I311 HydrophobicContact CG2-CB 4.21Å; V246-I311 HydrophobicContact CG2-CD1 4.02Å
247	W	98.1	Very high	93.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-47.2	172.3	171.4	-81.4	0	0	0	111.1	A230 A231 P232 K243 I244 D245 I249 G250 V251 F263 M277 L301 P303	A230-W247 PolarHBondContact O-NE1 3.18Å; A231-W247 VanDerWaalsContact CA-CD1 3.43Å; A231-W247 HydrophobicContact CB-CB 3.81Å; A231-W247 HydrophobicContact CB-CD2 4.31Å; A231-W247 HydrophobicContact CB-CG 3.74Å; P232-W247 HydrophobicContact CG-CE3 4.47Å; P232-W247 HydrophobicContact CG-CH2 4.15Å; P232-W247 HydrophobicContact CG-CZ3 4.12Å; K243-W247 PolarHBondContact O-N 3.08Å; I244-W247 WeakPolarHBondContact O-CB 3.39Å; I244-W247 PolarHBondContact O-N 2.81Å; D245-W247 PolarHBondContact O-N 3.19Å; W247-I249 VanDerWaalsContact C-N 3.27Å; W247-I249 PolarHBondContact O-N 3.48Å; W247-G250 CarbonylContact O-C 3.59Å; W247-G250 VanDerWaalsContact O-CA 3.3Å; W247-G250 WeakPolarHBondContact O-CA 3.43Å; W247-G250 PolarHBondContact O-N 3.09Å; W247-V251 PolarHBondContact O-N 3.36Å; W247-F263 AromaticContact CH2-CE2 3.64Å; W247-F263 HydrophobicContact CH2-CE2 3.64Å; W247-F263 AromaticContact CH2-CZ 3.93Å; W247-F263 HydrophobicContact CH2-CZ 3.93Å; W247-F263 HydrophobicContact CZ2-CD2 4.03Å; W247-F263 AromaticContact CZ2-CE2 3.44Å; W247-F263 HydrophobicContact CZ2-CE2 3.44Å; W247-F263 VanDerWaalsContact CZ2-CE2 3.44Å; W247-F263 HydrophobicContact CZ2-CZ 4.2Å; W247-M277 HydrophobicContact CH2-CB 3.94Å; W247-M277 HydrophobicContact CH2-CG 4.13Å; W247-M277 HydrophobicContact CZ2-CB 4.03Å; W247-M277 HydrophobicContact CZ2-CE 4.18Å; W247-M277 HydrophobicContact CZ2-CG 3.73Å; W247-M277 HydrophobicContact CZ2-SD 3.88Å; W247-L301 HydrophobicContact CD2-CD2 3.88Å; W247-L301 HydrophobicContact CE3-CB 4.46Å; W247-L301 HydrophobicContact CE3-CD2 4.13Å; W247-L301 HydrophobicContact CG-CD2 4.31Å; W247-L301 HydrophobicContact CH2-CD2 4.48Å; W247-L301 HydrophobicContact CZ2-CD2 4.25Å; W247-L301 VanDerWaalsContact CZ3-C 3.45Å; W247-L301 HydrophobicContact CZ3-CB 4.26Å; W247-L301 HydrophobicContact CZ3-CD2 4.42Å; W247-L301 VanDerWaalsContact CZ3-O 3.24Å; W247-L301 WeakPolarHBondContact CZ3-O 3.49Å; W247-P303 HydrophobicContact CZ3-CB 4.39Å; W247-P303 HydrophobicContact CZ3-CG 4.2Å
248	S	97.8	Very high	94.2	Very high	6 Å²	6	20.8 Å²	20.8	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-61.8	-33.1	178	-54.1	0	0	0	0	112.5	L187 Y229 I244 D245 G250 V251 N252	L187-S248 WeakPolarHBondContact O-CB 3.49Å; Y229-S248 WeakPolarHBondContact O-CB 3.37Å; Y229-S248 PolarHBondContact O-OG 3.05Å; I244-S248 PolarHBondContact O-N 2.73Å; I244-S248 PolarHBondContact O-OG 3.31Å; D245-S248 PolarHBondContact O-N 3.24Å; S248-G250 VanDerWaalsContact C-N 3.35Å; S248-V251 PolarHBondContact O-N 2.83Å; S248-N252 PolarHBondContact O-N 2.81Å; S248-N252 PolarHBondContact O-ND2 2.69Å
249	I	98.4	Very high	94.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.5	-41	169.3	-67	167.2	0	0	0	111	I167 L170 I171 V174 L187 D245 V246 W247 N252 M253 L300 I311	I167-I249 HydrophobicContact CD1-CG2 4.35Å; I167-I249 HydrophobicContact CG2-CG2 4.14Å; L170-I249 HydrophobicContact CD2-CB 4.5Å; L170-I249 HydrophobicContact CD2-CG1 3.98Å; L170-I249 HydrophobicContact CD2-CG2 4.31Å; L170-I249 HydrophobicContact CG-CG1 4.05Å; I171-I249 HydrophobicContact CD1-CG2 4.23Å; I171-I249 HydrophobicContact CG1-CD1 3.95Å; I171-I249 HydrophobicContact CG1-CG2 3.84Å; V174-I249 HydrophobicContact CB-CD1 4Å; V174-I249 HydrophobicContact CG1-CD1 4.06Å; V174-I249 HydrophobicContact CG2-CD1 3.99Å; L187-I249 HydrophobicContact CD1-CD1 4.48Å; L187-I249 HydrophobicContact CD1-CG1 4.05Å; D245-I249 VanDerWaalsContact O-CG1 3.3Å; D245-I249 WeakPolarHBondContact O-CG1 3.36Å; D245-I249 PolarHBondContact O-N 2.81Å; V246-I249 PolarHBondContact O-N 3.21Å; W247-I249 VanDerWaalsContact C-N 3.27Å; W247-I249 PolarHBondContact O-N 3.48Å; I249-N252 PolarHBondContact O-N 3.29Å; I249-M253 WeakPolarHBondContact O-CB 3.47Å; I249-M253 PolarHBondContact O-N 3.2Å; I249-L300 HydrophobicContact CG2-CD1 4.28Å; I249-I311 HydrophobicContact CD1-CD1 3.68Å
250	G	98.4	Very high	95.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-58.6	-43.4	171.6	0	0	0	0	0	113	V246 W247 S248 N252 M253 Y254 L297	V246-G250 PolarHBondContact O-N 3.34Å; V246-G250 VanDerWaalsContact O-N 3.14Å; W247-G250 CarbonylContact O-C 3.59Å; W247-G250 VanDerWaalsContact O-CA 3.3Å; W247-G250 WeakPolarHBondContact O-CA 3.43Å; W247-G250 PolarHBondContact O-N 3.09Å; S248-G250 VanDerWaalsContact C-N 3.35Å; G250-N252 PolarHBondContact O-N 3.47Å; G250-M253 PolarHBondContact O-N 3.48Å; G250-Y254 PolarHBondContact O-N 3.42Å; G250-L297 WeakPolarHBondContact O-CD1 3.39Å
251	V	98.3	Very high	96.1	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.5	-43.7	175.4	179.9	0	0	0	0	111.2	Y229 W247 S248 Y254 A255 L261 P262 L301	Y229-V251 HydrophobicContact CD1-CB 3.96Å; Y229-V251 HydrophobicContact CD1-CG1 3.4Å; Y229-V251 VanDerWaalsContact CD1-CG1 3.4Å; Y229-V251 HydrophobicContact CE1-CG1 3.68Å; Y229-V251 HydrophobicContact CG-CG1 4.07Å; W247-V251 PolarHBondContact O-N 3.36Å; S248-V251 PolarHBondContact O-N 2.83Å; V251-Y254 PolarHBondContact O-N 3.13Å; V251-A255 PolarHBondContact O-N 3.22Å; V251-L261 HydrophobicContact CG1-CD2 3.69Å; V251-P262 HydrophobicContact CB-CG 4.27Å; V251-P262 HydrophobicContact CG1-CG 3.96Å; V251-P262 HydrophobicContact CG2-CG 4.03Å; V251-L301 HydrophobicContact CG2-CD2 3.83Å
252	N	97.9	Very high	96.5	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.1	-37.3	175.5	-79.5	-90.4	0	0	0	112.2	L170 L187 I189 S248 I249 G250 A255 M256	L170-N252 HydrophobicContact CD2-CB 4.31Å; L187-N252 PolarHBondContact O-ND2 3.03Å; L187-N252 VanDerWaalsContact O-ND2 3.08Å; I189-N252 VanDerWaalsContact CA-OD1 3.32Å; I189-N252 WeakPolarHBondContact CA-OD1 3.17Å; I189-N252 PolarHBondContact N-OD1 3.14Å; I189-N252 VanDerWaalsContact N-OD1 3.09Å; S248-N252 PolarHBondContact O-N 2.81Å; S248-N252 PolarHBondContact O-ND2 2.69Å; I249-N252 PolarHBondContact O-N 3.29Å; G250-N252 PolarHBondContact O-N 3.47Å; N252-A255 PolarHBondContact O-N 3.07Å; N252-M256 HydrophobicContact CB-CE 4.32Å; N252-M256 VanDerWaalsContact O-CG 3.3Å; N252-M256 WeakPolarHBondContact O-CG 3.27Å; N252-M256 PolarHBondContact O-N 2.88Å
253	M	98.1	Very high	96.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-64.7	-43.9	174.8	-179.9	176.5	171.8	0	0	111.7	I167 I249 G250 A255 M256 L257 A293 F296 L297 L300 W319	I167-M253 HydrophobicContact CD1-CB 3.73Å; I167-M253 HydrophobicContact CD1-CG 4.45Å; I167-M253 HydrophobicContact CG1-CB 3.94Å; I167-M253 HydrophobicContact CG1-CG 4.1Å; I249-M253 WeakPolarHBondContact O-CB 3.47Å; I249-M253 PolarHBondContact O-N 3.2Å; G250-M253 PolarHBondContact O-N 3.48Å; M253-A255 PolarHBondContact O-N 2.93Å; M253-M256 PolarHBondContact O-N 3.5Å; M253-L257 HydrophobicContact CE-CD1 3.76Å; M253-L257 HydrophobicContact CG-CD1 3.92Å; M253-L257 WeakPolarHBondContact O-CB 3.21Å; M253-L257 VanDerWaalsContact O-CG 3.32Å; M253-L257 WeakPolarHBondContact O-CG 3.13Å; M253-L257 PolarHBondContact O-N 3.32Å; M253-A293 HydrophobicContact CE-CB 4.3Å; M253-A293 WeakPolarHBondContact CE-O 3.47Å; M253-F296 HydrophobicContact CE-CD1 3.93Å; M253-F296 HydrophobicContact SD-CD1 3.71Å; M253-F296 HydrophobicContact SD-CE1 4.11Å; M253-L297 HydrophobicContact CB-CD1 4.06Å; M253-L297 HydrophobicContact CE-CB 4Å; M253-L297 HydrophobicContact CG-CD1 4.08Å; M253-L297 HydrophobicContact SD-CB 4.14Å; M253-L297 HydrophobicContact SD-CD1 4.23Å; M253-L300 HydrophobicContact SD-CD1 3.98Å; M253-W319 HydrophobicContact CE-CD2 4.42Å; M253-W319 HydrophobicContact CE-CE3 4.09Å; M253-W319 HydrophobicContact CE-CH2 3.61Å; M253-W319 HydrophobicContact CE-CZ2 3.99Å; M253-W319 HydrophobicContact CE-CZ3 3.67Å; M253-W319 HydrophobicContact SD-CH2 4.42Å; M253-W319 HydrophobicContact SD-CZ3 4.19Å
254	Y	98.1	Very high	96.5	Very high	2 Å²	2	8 Å²	8	1%	0.008	5%	0.051	C	C	.	.	H	α-helix	trans	-59.6	-46.2	173.3	-175.8	-78.1	0	0	0	111	G250 V251 M256 L257 T258 T260 L261 P262 M282 N283 P284 L285 L297	G250-Y254 PolarHBondContact O-N 3.42Å; V251-Y254 PolarHBondContact O-N 3.13Å; Y254-M256 PolarHBondContact O-N 3.4Å; Y254-L257 PolarHBondContact O-N 2.85Å; Y254-T258 HydrophobicContact CD1-CG2 4.15Å; Y254-T258 VanDerWaalsContact CD1-OG1 3.29Å; Y254-T258 WeakPolarHBondContact CD1-OG1 3.34Å; Y254-T258 HydrophobicContact CD2-CG2 4.33Å; Y254-T258 HydrophobicContact CE1-CG2 3.81Å; Y254-T258 WeakPolarHBondContact CE1-OG1 3.33Å; Y254-T258 HydrophobicContact CE2-CG2 4.02Å; Y254-T258 HydrophobicContact CG-CG2 4.36Å; Y254-T258 WeakPolarHBondContact O-CB 3.48Å; Y254-T258 WeakPolarHBondContact O-CG2 3.42Å; Y254-T258 PolarHBondContact O-N 3.42Å; Y254-T258 PolarHBondContact O-OG1 2.89Å; Y254-T260 WeakPolarHBondContact CD1-O 3.47Å; Y254-T260 WeakPolarHBondContact CE1-O 3.11Å; Y254-T260 WeakPolarHBondContact CE1-OG1 3.36Å; Y254-L261 VanDerWaalsContact CD1-C 3.45Å; Y254-L261 VanDerWaalsContact CE1-O 3.25Å; Y254-L261 WeakPolarHBondContact CE1-O 3.35Å; Y254-P262 HydrophobicContact CD1-CB 3.92Å; Y254-P262 HydrophobicContact CD1-CG 4.31Å; Y254-P262 HydrophobicContact CD2-CB 3.72Å; Y254-P262 HydrophobicContact CE1-CB 4.37Å; Y254-P262 HydrophobicContact CE2-CB 4.19Å; Y254-P262 HydrophobicContact CG-CB 3.61Å; Y254-P262 HydrophobicContact CG-CG 4.17Å; Y254-M282 HydrophobicContact CD2-CE 4.21Å; Y254-M282 HydrophobicContact CD2-CG 4.02Å; Y254-M282 HydrophobicContact CD2-SD 3.52Å; Y254-M282 VanDerWaalsContact CD2-SD 3.52Å; Y254-M282 HydrophobicContact CE2-CE 4.24Å; Y254-M282 HydrophobicContact CE2-CG 3.76Å; Y254-M282 HydrophobicContact CE2-SD 3.83Å; Y254-N283 VanDerWaalsContact OH-CB 3.24Å; Y254-N283 WeakPolarHBondContact OH-CB 2.97Å; Y254-N283 PolarHBondContact OH-O 3.17Å; Y254-P284 PolarHBondContact OH-O 3.37Å; Y254-L285 HydrophobicContact CD2-CD2 3.74Å; Y254-L285 HydrophobicContact CE2-CD2 3.5Å; Y254-L285 HydrophobicContact CE2-CG 4.36Å; Y254-L297 HydrophobicContact CD2-CD2 4.07Å
255	A	96.7	Very high	96.2	Very high	7 Å²	7	9 Å²	9	6%	0.058	6%	0.057	C	C	.	.	H	α-helix	trans	-62.3	-41	179.2	0	0	0	0	0	112.8	V251 N252 M253 G259 T260	V251-A255 PolarHBondContact O-N 3.22Å; N252-A255 PolarHBondContact O-N 3.07Å; M253-A255 PolarHBondContact O-N 2.93Å; A255-G259 WeakPolarHBondContact O-CA 3.46Å; A255-G259 PolarHBondContact O-N 2.7Å; A255-T260 VanDerWaalsContact CA-O 3.29Å; A255-T260 WeakPolarHBondContact CA-O 3.41Å
256	M	97.4	Very high	95.8	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.4	-43.6	173.1	-74.1	179.7	-149.7	0	0	112.5	L148 I152 L158 A163 Y166 I167 I189 L192 I200 N252 M253 Y254	L148-M256 HydrophobicContact CD2-CE 3.73Å; L148-M256 HydrophobicContact CD2-SD 4.38Å; I152-M256 HydrophobicContact CD1-CG 3.95Å; L158-M256 WeakPolarHBondContact CB-O 3.26Å; L158-M256 HydrophobicContact CD1-CB 3.95Å; L158-M256 HydrophobicContact CD1-CG 3.88Å; L158-M256 HydrophobicContact CD1-SD 4.39Å; L158-M256 HydrophobicContact CG-CB 4.42Å; L158-M256 PolarHBondContact N-O 3.39Å; A163-M256 HydrophobicContact CB-CB 4.15Å; Y166-M256 HydrophobicContact CD2-SD 4.33Å; I167-M256 HydrophobicContact CD1-CE 3.72Å; I167-M256 HydrophobicContact CD1-SD 3.82Å; I167-M256 HydrophobicContact CG1-SD 4Å; I189-M256 HydrophobicContact CD1-CE 4.17Å; L192-M256 HydrophobicContact CD1-CE 4.09Å; I200-M256 HydrophobicContact CD1-CE 4.4Å; N252-M256 HydrophobicContact CB-CE 4.32Å; N252-M256 VanDerWaalsContact O-CG 3.3Å; N252-M256 WeakPolarHBondContact O-CG 3.27Å; N252-M256 PolarHBondContact O-N 2.88Å; M253-M256 PolarHBondContact O-N 3.5Å; Y254-M256 PolarHBondContact O-N 3.4Å
257	L	97.1	Very high	95.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-80.4	-18.8	-174.8	-67.5	173.6	0	0	0	114.3	R157 E160 A163 M253 Y254 L289	R157-L257 WeakPolarHBondContact CD-O 3.39Å; E160-L257 HydrophobicContact CB-CD2 4.47Å; E160-L257 HydrophobicContact CG-CD2 4.43Å; A163-L257 HydrophobicContact CB-CD2 3.58Å; A163-L257 HydrophobicContact CB-CG 4.21Å; M253-L257 HydrophobicContact CE-CD1 3.76Å; M253-L257 HydrophobicContact CG-CD1 3.92Å; M253-L257 WeakPolarHBondContact O-CB 3.21Å; M253-L257 VanDerWaalsContact O-CG 3.32Å; M253-L257 WeakPolarHBondContact O-CG 3.13Å; M253-L257 PolarHBondContact O-N 3.32Å; Y254-L257 PolarHBondContact O-N 2.85Å; L257-L289 HydrophobicContact CB-CD1 4.22Å; L257-L289 HydrophobicContact CB-CD2 4.25Å; L257-L289 HydrophobicContact CD1-CD1 4.28Å; L257-L289 HydrophobicContact CD1-CD2 4.41Å; L257-L289 HydrophobicContact CD2-CD2 3.95Å; L257-L289 HydrophobicContact CG-CD2 4.43Å
258	T	95.8	Very high	94.7	Very high	21 Å²	21	24.6 Å²	24.6	13%	0.129	14%	0.139	C	C	.	.	H	α-helix	trans	-126.9	-23.1	-171.5	69.9	0	0	0	0	115.9	Y254 T260 L285 P286	Y254-T258 HydrophobicContact CD1-CG2 4.15Å; Y254-T258 VanDerWaalsContact CD1-OG1 3.29Å; Y254-T258 WeakPolarHBondContact CD1-OG1 3.34Å; Y254-T258 HydrophobicContact CD2-CG2 4.33Å; Y254-T258 HydrophobicContact CE1-CG2 3.81Å; Y254-T258 WeakPolarHBondContact CE1-OG1 3.33Å; Y254-T258 HydrophobicContact CE2-CG2 4.02Å; Y254-T258 HydrophobicContact CG-CG2 4.36Å; Y254-T258 WeakPolarHBondContact O-CB 3.48Å; Y254-T258 WeakPolarHBondContact O-CG2 3.42Å; Y254-T258 PolarHBondContact O-N 3.42Å; Y254-T258 PolarHBondContact O-OG1 2.89Å; T258-T260 VanDerWaalsContact C-N 3.29Å; T258-T260 PolarHBondContact OG1-N 3.23Å; T258-T260 VanDerWaalsContact OG1-N 3.11Å; T258-T260 PolarHBondContact OG1-O 3.49Å; T258-T260 PolarHBondContact OG1-OG1 2.95Å; T258-T260 VanDerWaalsContact OG1-OG1 3.09Å; T258-L285 HydrophobicContact CG2-CD2 4.26Å; T258-P286 HydrophobicContact CG2-CG 4.31Å
259	G	94.2	Very high	94.4	Very high	9 Å²	9	26.7 Å²	26.7	9%	0.093	15%	0.154	C	C	.	.	S	Bend	trans	76.8	8.8	-169.6	0	0	0	0	0	115.4	K156 A255 W425	K156-G259 WeakPolarHBondContact O-CA 3.01Å; A255-G259 WeakPolarHBondContact O-CA 3.46Å; A255-G259 PolarHBondContact O-N 2.7Å; G259-W425 WeakPolarHBondContact O-CZ2 3.23Å; G259-W425 PolarHBondContact O-NE1 3.24Å
260	T	93.9	Very high	93.9	Very high	66 Å²	66	30.1 Å²	30.1	41%	0.405	17%	0.172	S	C	.	.	S	Bend	trans	-136	177.1	-177.3	58.7	0	0	0	0	111.2	Y254 A255 T258	Y254-T260 WeakPolarHBondContact CD1-O 3.47Å; Y254-T260 WeakPolarHBondContact CE1-O 3.11Å; Y254-T260 WeakPolarHBondContact CE1-OG1 3.36Å; A255-T260 VanDerWaalsContact CA-O 3.29Å; A255-T260 WeakPolarHBondContact CA-O 3.41Å; T258-T260 VanDerWaalsContact C-N 3.29Å; T258-T260 PolarHBondContact OG1-N 3.23Å; T258-T260 VanDerWaalsContact OG1-N 3.11Å; T258-T260 PolarHBondContact OG1-O 3.49Å; T258-T260 PolarHBondContact OG1-OG1 2.95Å; T258-T260 VanDerWaalsContact OG1-OG1 3.09Å
261	L	94.4	Very high	93.6	Very high	6 Å²	6	40 Å²	40	3%	0.031	21%	0.209	C	C	.	.			trans	-89.7	148.7	172.9	-79.5	162.6	0	0	0	111.8	A228 Y229 V251 Y254 F263 T264 N283 L429	A228-L261 HydrophobicContact CB-CD1 3.7Å; A228-L261 HydrophobicContact CB-CD2 4.1Å; Y229-L261 HydrophobicContact CE1-CD2 4.44Å; Y229-L261 HydrophobicContact CE2-CD2 4.33Å; V251-L261 HydrophobicContact CG1-CD2 3.69Å; Y254-L261 VanDerWaalsContact CD1-C 3.45Å; Y254-L261 VanDerWaalsContact CE1-O 3.25Å; Y254-L261 WeakPolarHBondContact CE1-O 3.35Å; L261-F263 VanDerWaalsContact C-N 3.3Å; L261-F263 PolarHBondContact O-N 3.37Å; L261-T264 HydrophobicContact CB-CG2 3.83Å; L261-T264 HydrophobicContact CD1-CG2 4.5Å; L261-N283 PolarHBondContact O-ND2 3.17Å; L261-L429 HydrophobicContact CD1-CB 4.21Å; L261-L429 HydrophobicContact CD1-CD2 3.56Å; L261-L429 HydrophobicContact CD1-CG 4.49Å; L261-L429 HydrophobicContact CD2-CD2 4.42Å; L261-L429 HydrophobicContact CG-CD2 3.51Å
262	P	96.3	Very high	93.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	22%	0.224	C	C	.	.	S	Bend	trans	-66.1	-32.5	178	25	-32.2	0	0	0	112.3	V251 Y254 M282 N283 L301	V251-P262 HydrophobicContact CB-CG 4.27Å; V251-P262 HydrophobicContact CG1-CG 3.96Å; V251-P262 HydrophobicContact CG2-CG 4.03Å; Y254-P262 HydrophobicContact CD1-CB 3.92Å; Y254-P262 HydrophobicContact CD1-CG 4.31Å; Y254-P262 HydrophobicContact CD2-CB 3.72Å; Y254-P262 HydrophobicContact CE1-CB 4.37Å; Y254-P262 HydrophobicContact CE2-CB 4.19Å; Y254-P262 HydrophobicContact CG-CB 3.61Å; Y254-P262 HydrophobicContact CG-CG 4.17Å; P262-M282 HydrophobicContact CB-CG 3.67Å; P262-M282 HydrophobicContact CB-SD 3.84Å; P262-M282 CarbonylContact O-C 3.42Å; P262-M282 WeakPolarHBondContact O-CA 3.29Å; P262-M282 WeakPolarHBondContact O-CG 3.45Å; P262-N283 PolarHBondContact O-N 3.07Å; P262-L301 HydrophobicContact CB-CD1 3.96Å; P262-L301 HydrophobicContact CG-CD1 4.3Å
263	F	95.5	Very high	93.1	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.026	23%	0.225	C	C	.	.	S	Bend	trans	-130.3	117.2	-178.4	-52.1	-75.7	0	0	0	109.5	W247 L261 L273 K276 M277 E281 M282 L301	W247-F263 AromaticContact CH2-CE2 3.64Å; W247-F263 HydrophobicContact CH2-CE2 3.64Å; W247-F263 AromaticContact CH2-CZ 3.93Å; W247-F263 HydrophobicContact CH2-CZ 3.93Å; W247-F263 HydrophobicContact CZ2-CD2 4.03Å; W247-F263 AromaticContact CZ2-CE2 3.44Å; W247-F263 HydrophobicContact CZ2-CE2 3.44Å; W247-F263 VanDerWaalsContact CZ2-CE2 3.44Å; W247-F263 HydrophobicContact CZ2-CZ 4.2Å; L261-F263 VanDerWaalsContact C-N 3.3Å; L261-F263 PolarHBondContact O-N 3.37Å; F263-L273 HydrophobicContact CB-CD1 3.62Å; F263-K276 HydrophobicContact CD1-CB 4.25Å; F263-M277 HydrophobicContact CB-CE 4.48Å; F263-M277 HydrophobicContact CB-CG 4.27Å; F263-M277 HydrophobicContact CD1-CG 4.25Å; F263-M277 HydrophobicContact CD2-CE 4.14Å; F263-M277 HydrophobicContact CD2-CG 3.73Å; F263-M277 HydrophobicContact CE2-CG 4.09Å; F263-M277 HydrophobicContact CG-CG 3.82Å; F263-M277 HydrophobicContact CZ-CG 4.49Å; F263-E281 WeakPolarHBondContact CD1-O 3.21Å; F263-M282 HydrophobicContact CE1-CB 3.96Å; F263-M282 HydrophobicContact CE1-CG 4.48Å; F263-M282 HydrophobicContact CZ-CB 4.35Å; F263-L301 HydrophobicContact CE2-CD1 4.38Å; F263-L301 HydrophobicContact CE2-CD2 4.38Å
264	T	90.8	Very high	92.9	Very high	42 Å²	42	45.2 Å²	45.2	26%	0.258	24%	0.237	S	C	.	.			trans	-132	149.5	174.3	55	0	0	0	0	110.6	L261 K276 N283	L261-T264 HydrophobicContact CB-CG2 3.83Å; L261-T264 HydrophobicContact CD1-CG2 4.5Å; T264-K276 PolarHBondContact O-NZ 3.46Å; T264-N283 PolarHBondContact OG1-ND2 3.43Å
265	V	89	Confident	92.8	Very high	22 Å²	22	49.4 Å²	49.4	13%	0.133	26%	0.257	C	S	.	.			trans	-142.5	130.9	179.4	-174.4	0	0	0	0	109.6	A272 L273 K276 H432	V265-A272 HydrophobicContact CG1-CB 3.84Å; V265-A272 HydrophobicContact CG2-CB 4.32Å; V265-L273 HydrophobicContact CG2-CB 4.18Å; V265-L273 HydrophobicContact CG2-CD1 4.39Å; V265-K276 HydrophobicContact CG2-CD 4.1Å; V265-H432 PolarHBondContact O-ND1 2.83Å
266	E	87.4	Confident	92.8	Very high	169 Å²	169	51.6 Å²	51.6	79%	0.79	27%	0.265	S	S	*	.	S	Bend	trans	-128.3	129.9	176.7	-163.1	171	-177	0	0	110.4
267	P	88.3	Confident	92.7	Very high	113 Å²	113	51.6 Å²	51.6	73%	0.734	27%	0.265	S	S	*	.	S	Bend	cis	-62	156.6	-14.5	31	-36.6	0	0	0	111.1	S269	P267-S269 PolarHBondContact O-N 3.08Å
268	F	85.6	Confident	92.6	Very high	46 Å²	46	54.2 Å²	54.2	20%	0.202	28%	0.281	C	S	.	.			trans	-61.1	129.1	-176.5	175.8	-103.3	0	0	0	112.9	L270 L273 H432 A433	F268-L270 HydrophobicContact CE1-CB 4.16Å; F268-L270 HydrophobicContact CZ-CB 3.87Å; F268-L270 HydrophobicContact CZ-CD1 4.01Å; F268-L273 HydrophobicContact CE2-CB 4.33Å; F268-L273 HydrophobicContact CE2-CD2 3.97Å; F268-H432 HydrophobicContact CD2-CB 4.35Å; F268-H432 WeakPolarHBondContact CD2-O 3.17Å; F268-H432 VanDerWaalsContact CE2-O 3.24Å; F268-H432 WeakPolarHBondContact CE2-O 3.35Å; F268-H432 VanDerWaalsContact CG-C 3.47Å; F268-A433 VanDerWaalsContact CD1-O 3.31Å; F268-A433 WeakPolarHBondContact CD1-O 3.44Å; F268-A433 VanDerWaalsContact CE1-C 3.48Å; F268-A433 WeakPolarHBondContact CE1-O 3.4Å
269	S	91.2	Very high	92.7	Very high	51 Å²	51	57.2 Å²	57.2	36%	0.357	30%	0.296	S	S	.	.			trans	-140.4	119.8	169.2	168.1	0	0	0	0	109.1	P267 R271 A272 L273	P267-S269 PolarHBondContact O-N 3.08Å; S269-R271 PolarHBondContact O-N 3.01Å; S269-A272 PolarHBondContact O-N 2.69Å; S269-A272 VanDerWaalsContact O-N 3.1Å; S269-A272 PolarHBondContact OG-N 3.19Å; S269-L273 PolarHBondContact O-N 2.89Å
270	L	88.4	Confident	92.7	Very high	72 Å²	72	62.1 Å²	62.1	38%	0.377	32%	0.315	S	S	.	.	H	α-helix	trans	-59	-31.8	178.8	-173	66.8	0	0	0	112.2	P227 L235 F268 Y274	P227-L270 HydrophobicContact CB-CD1 4.05Å; L235-L270 HydrophobicContact CD1-CD1 4.05Å; L235-L270 HydrophobicContact CD2-CD1 4.04Å; F268-L270 HydrophobicContact CE1-CB 4.16Å; F268-L270 HydrophobicContact CZ-CB 3.87Å; F268-L270 HydrophobicContact CZ-CD1 4.01Å; L270-Y274 WeakPolarHBondContact O-CB 3.3Å; L270-Y274 PolarHBondContact O-N 2.8Å
271	R	91.1	Very high	92.8	Very high	208 Å²	208	64.2 Å²	64.2	79%	0.785	32%	0.32	S	S	*	.	H	α-helix	trans	-67.1	-46.5	175.5	-176.9	-174.2	-68.4	173.4	-3.4	111.2	S269 Y274 Q275	S269-R271 PolarHBondContact O-N 3.01Å; R271-Y274 PolarHBondContact O-N 3.23Å; R271-Q275 WeakPolarHBondContact O-CB 3.3Å; R271-Q275 PolarHBondContact O-N 3.17Å
272	A	93.4	Very high	92.8	Very high	37 Å²	37	66 Å²	66	31%	0.306	33%	0.329	S	S	.	.	H	α-helix	trans	-71.9	-33	-180	0	0	0	0	0	112.2	V265 S269 Q275 K276	V265-A272 HydrophobicContact CG1-CB 3.84Å; V265-A272 HydrophobicContact CG2-CB 4.32Å; S269-A272 PolarHBondContact O-N 2.69Å; S269-A272 VanDerWaalsContact O-N 3.1Å; S269-A272 PolarHBondContact OG-N 3.19Å; A272-Q275 PolarHBondContact O-N 2.79Å; A272-K276 PolarHBondContact O-N 2.9Å
273	L	92.7	Very high	92.7	Very high	6 Å²	6	67.5 Å²	67.5	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-49	171.6	-179.7	65.7	0	0	0	110.5	P227 F263 V265 F268 S269 Q275 K276 M277	P227-L273 HydrophobicContact CB-CD2 4.42Å; F263-L273 HydrophobicContact CB-CD1 3.62Å; V265-L273 HydrophobicContact CG2-CB 4.18Å; V265-L273 HydrophobicContact CG2-CD1 4.39Å; F268-L273 HydrophobicContact CE2-CB 4.33Å; F268-L273 HydrophobicContact CE2-CD2 3.97Å; S269-L273 PolarHBondContact O-N 2.89Å; L273-Q275 VanDerWaalsContact C-N 3.29Å; L273-Q275 PolarHBondContact O-N 3.49Å; L273-K276 PolarHBondContact O-N 3.38Å; L273-M277 HydrophobicContact CD1-CE 4.1Å; L273-M277 HydrophobicContact CD2-CE 4.11Å; L273-M277 HydrophobicContact CG-CE 3.92Å; L273-M277 HydrophobicContact CG-SD 4.4Å; L273-M277 VanDerWaalsContact O-CG 3.27Å; L273-M277 WeakPolarHBondContact O-CG 3.28Å; L273-M277 PolarHBondContact O-N 2.84Å
274	Y	94.4	Very high	92.5	Very high	66 Å²	66	72.9 Å²	72.9	26%	0.259	37%	0.373	S	S	.	.	H	α-helix	trans	-58.3	-40.5	174.1	171.2	-94.5	0	0	0	112.2	P232 L235 A236 L270 R271 M277 V278	P232-Y274 HydrophobicContact CB-CD2 3.91Å; P232-Y274 HydrophobicContact CB-CE2 3.8Å; P232-Y274 VanDerWaalsContact O-CE2 3.31Å; P232-Y274 WeakPolarHBondContact O-CE2 3.33Å; L235-Y274 HydrophobicContact CB-CD2 4.19Å; A236-Y274 HydrophobicContact CB-CE2 3.74Å; L270-Y274 WeakPolarHBondContact O-CB 3.3Å; L270-Y274 PolarHBondContact O-N 2.8Å; R271-Y274 PolarHBondContact O-N 3.23Å; Y274-M277 WeakPolarHBondContact O-CB 3.48Å; Y274-M277 PolarHBondContact O-N 2.86Å; Y274-V278 HydrophobicContact CD1-CG2 4.34Å; Y274-V278 HydrophobicContact CD2-CG2 4.36Å; Y274-V278 HydrophobicContact CE1-CG2 3.82Å; Y274-V278 HydrophobicContact CE2-CG2 3.84Å; Y274-V278 WeakPolarHBondContact O-CG2 3.3Å; Y274-V278 PolarHBondContact O-N 3.42Å
275	Q	95.7	Very high	92.6	Very high	89 Å²	89	72.7 Å²	72.7	42%	0.416	37%	0.37	S	S	.	.	H	α-helix	trans	-61.9	-52.9	178.2	-165.1	58.7	48.6	0	0	111.2	R271 A272 L273 M277 V278 D279	R271-Q275 WeakPolarHBondContact O-CB 3.3Å; R271-Q275 PolarHBondContact O-N 3.17Å; A272-Q275 PolarHBondContact O-N 2.79Å; L273-Q275 VanDerWaalsContact C-N 3.29Å; L273-Q275 PolarHBondContact O-N 3.49Å; Q275-M277 VanDerWaalsContact C-N 3.25Å; Q275-M277 PolarHBondContact O-N 3.12Å; Q275-V278 PolarHBondContact O-N 3.43Å; Q275-D279 WeakPolarHBondContact CG-OD2 3.31Å; Q275-D279 VanDerWaalsContact NE2-CG 3.27Å; Q275-D279 PolarHBondContact NE2-OD1 3.38Å; Q275-D279 PolarHBondContact NE2-OD2 3.08Å; Q275-D279 PolarHBondContact O-N 3.15Å
276	K	95.6	Very high	92.7	Very high	54 Å²	54	73 Å²	73	24%	0.235	37%	0.372	C	S	.	.	H	α-helix	trans	-53.7	-40.4	173.4	-78.5	-158.6	170.1	-176.1	0	113.4	F263 T264 V265 A272 L273 K280 E281	F263-K276 HydrophobicContact CD1-CB 4.25Å; T264-K276 PolarHBondContact O-NZ 3.46Å; V265-K276 HydrophobicContact CG2-CD 4.1Å; A272-K276 PolarHBondContact O-N 2.9Å; L273-K276 PolarHBondContact O-N 3.38Å; K276-K280 PolarHBondContact O-N 2.99Å; K276-K280 VanDerWaalsContact O-N 3.09Å; K276-E281 HydrophobicContact CB-CB 4.14Å; K276-E281 HydrophobicContact CD-CB 4.35Å; K276-E281 HydrophobicContact CG-CB 4.03Å; K276-E281 PolarHBondContact O-N 2.93Å
277	M	96.1	Very high	92.9	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-45.6	176.5	-71	176.3	168.7	0	0	111.5	P232 L235 W247 F263 L273 Y274 Q275 K280 P303	P232-M277 HydrophobicContact CB-CB 4.26Å; L235-M277 HydrophobicContact CD1-CE 4.34Å; L235-M277 HydrophobicContact CD1-SD 3.81Å; W247-M277 HydrophobicContact CH2-CB 3.94Å; W247-M277 HydrophobicContact CH2-CG 4.13Å; W247-M277 HydrophobicContact CZ2-CB 4.03Å; W247-M277 HydrophobicContact CZ2-CE 4.18Å; W247-M277 HydrophobicContact CZ2-CG 3.73Å; W247-M277 HydrophobicContact CZ2-SD 3.88Å; F263-M277 HydrophobicContact CB-CE 4.48Å; F263-M277 HydrophobicContact CB-CG 4.27Å; F263-M277 HydrophobicContact CD1-CG 4.25Å; F263-M277 HydrophobicContact CD2-CE 4.14Å; F263-M277 HydrophobicContact CD2-CG 3.73Å; F263-M277 HydrophobicContact CE2-CG 4.09Å; F263-M277 HydrophobicContact CG-CG 3.82Å; F263-M277 HydrophobicContact CZ-CG 4.49Å; L273-M277 HydrophobicContact CD1-CE 4.1Å; L273-M277 HydrophobicContact CD2-CE 4.11Å; L273-M277 HydrophobicContact CG-CE 3.92Å; L273-M277 HydrophobicContact CG-SD 4.4Å; L273-M277 VanDerWaalsContact O-CG 3.27Å; L273-M277 WeakPolarHBondContact O-CG 3.28Å; L273-M277 PolarHBondContact O-N 2.84Å; Y274-M277 WeakPolarHBondContact O-CB 3.48Å; Y274-M277 PolarHBondContact O-N 2.86Å; Q275-M277 VanDerWaalsContact C-N 3.25Å; Q275-M277 PolarHBondContact O-N 3.12Å; M277-K280 PolarHBondContact O-N 3.21Å; M277-P303 WeakPolarHBondContact O-CG 3.35Å
278	V	95.8	Very high	93.1	Very high	54 Å²	54	72.1 Å²	72.1	33%	0.327	37%	0.368	S	S	.	.	H	α-helix	trans	-67.2	-44.1	179.4	170.1	0	0	0	0	111.9	P232 Y274 Q275 K280	P232-V278 HydrophobicContact CB-CG2 4.43Å; Y274-V278 HydrophobicContact CD1-CG2 4.34Å; Y274-V278 HydrophobicContact CD2-CG2 4.36Å; Y274-V278 HydrophobicContact CE1-CG2 3.82Å; Y274-V278 HydrophobicContact CE2-CG2 3.84Å; Y274-V278 WeakPolarHBondContact O-CG2 3.3Å; Y274-V278 PolarHBondContact O-N 3.42Å; Q275-V278 PolarHBondContact O-N 3.43Å; V278-K280 PolarHBondContact O-N 3.12Å
279	D	96.3	Very high	93.5	Very high	85 Å²	85	70.6 Å²	70.6	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-76.9	-4.1	-178.1	-59	-24.6	0	0	0	112.8	Q275 E281	Q275-D279 WeakPolarHBondContact CG-OD2 3.31Å; Q275-D279 VanDerWaalsContact NE2-CG 3.27Å; Q275-D279 PolarHBondContact NE2-OD1 3.38Å; Q275-D279 PolarHBondContact NE2-OD2 3.08Å; Q275-D279 PolarHBondContact O-N 3.15Å; D279-E281 HydrophobicContact CB-CG 4.11Å; D279-E281 PolarHBondContact O-N 3.36Å
280	K	95.7	Very high	93.7	Very high	111 Å²	111	70 Å²	70	48%	0.483	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	26	-178.5	-45.2	-174.5	-169.8	-164.1	0	113.3	K276 M277 V278 M282 E302 P303	K276-K280 PolarHBondContact O-N 2.99Å; K276-K280 VanDerWaalsContact O-N 3.09Å; M277-K280 PolarHBondContact O-N 3.21Å; V278-K280 PolarHBondContact O-N 3.12Å; K280-M282 PolarHBondContact O-N 3.08Å; K280-E302 IonicContact NZ-OE1 2.64Å; K280-E302 PolarHBondContact NZ-OE1 3.19Å; K280-E302 IonicContact NZ-OE2 2.69Å; K280-E302 PolarHBondContact NZ-OE2 3.13Å; K280-P303 HydrophobicContact CD-CG 4.4Å; K280-P303 VanDerWaalsContact CE-CD 3.47Å; K280-P303 HydrophobicContact CG-CG 3.86Å
281	E	94.6	Very high	94.1	Very high	111 Å²	111	72.4 Å²	72.4	52%	0.519	38%	0.375	S	S	.	.			trans	-72	67.4	173.8	-68	-164.8	163.5	0	0	111.4	F263 K276 D279	F263-E281 WeakPolarHBondContact CD1-O 3.21Å; K276-E281 HydrophobicContact CB-CB 4.14Å; K276-E281 HydrophobicContact CD-CB 4.35Å; K276-E281 HydrophobicContact CG-CB 4.03Å; K276-E281 PolarHBondContact O-N 2.93Å; D279-E281 HydrophobicContact CB-CG 4.11Å; D279-E281 PolarHBondContact O-N 3.36Å
282	M	94	Very high	94.3	Very high	43 Å²	43	64 Å²	64	21%	0.212	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-77.8	142.4	175.5	-169.5	170.2	67	0	0	110.7	Y254 P262 F263 K280 L285 L297 L301	Y254-M282 HydrophobicContact CD2-CE 4.21Å; Y254-M282 HydrophobicContact CD2-CG 4.02Å; Y254-M282 HydrophobicContact CD2-SD 3.52Å; Y254-M282 VanDerWaalsContact CD2-SD 3.52Å; Y254-M282 HydrophobicContact CE2-CE 4.24Å; Y254-M282 HydrophobicContact CE2-CG 3.76Å; Y254-M282 HydrophobicContact CE2-SD 3.83Å; P262-M282 HydrophobicContact CB-CG 3.67Å; P262-M282 HydrophobicContact CB-SD 3.84Å; P262-M282 CarbonylContact O-C 3.42Å; P262-M282 WeakPolarHBondContact O-CA 3.29Å; P262-M282 WeakPolarHBondContact O-CG 3.45Å; F263-M282 HydrophobicContact CE1-CB 3.96Å; F263-M282 HydrophobicContact CE1-CG 4.48Å; F263-M282 HydrophobicContact CZ-CB 4.35Å; K280-M282 PolarHBondContact O-N 3.08Å; M282-L285 HydrophobicContact CE-CD1 3.64Å; M282-L285 HydrophobicContact CE-CD2 4.02Å; M282-L285 HydrophobicContact CE-CG 3.85Å; M282-L297 HydrophobicContact CE-CD2 4.5Å; M282-L301 HydrophobicContact SD-CD1 3.58Å; M282-L301 VanDerWaalsContact SD-CD1 3.58Å
283	N	94.4	Very high	94.4	Very high	33 Å²	33	62.3 Å²	62.3	18%	0.176	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-56.9	152.8	174.5	-72.7	-26.9	0	0	0	111.8	Y254 L261 P262 T264 L285	Y254-N283 VanDerWaalsContact OH-CB 3.24Å; Y254-N283 WeakPolarHBondContact OH-CB 2.97Å; Y254-N283 PolarHBondContact OH-O 3.17Å; L261-N283 PolarHBondContact O-ND2 3.17Å; P262-N283 PolarHBondContact O-N 3.07Å; T264-N283 PolarHBondContact OG1-ND2 3.43Å; N283-L285 PolarHBondContact O-N 2.93Å
284	P	92.6	Very high	94.7	Very high	119 Å²	119	63.6 Å²	63.6	77%	0.773	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-61.3	131.5	-170.4	-26	35.8	0	0	0	114.4	Y254	Y254-P284 PolarHBondContact OH-O 3.37Å
285	L	93.1	Very high	94.8	Very high	38 Å²	38	64.1 Å²	64.1	20%	0.199	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-83.2	143.2	175	-68.7	171.4	0	0	0	111.5	Y254 T258 M282 N283 T287 L289 I294 L297	Y254-L285 HydrophobicContact CD2-CD2 3.74Å; Y254-L285 HydrophobicContact CE2-CD2 3.5Å; Y254-L285 HydrophobicContact CE2-CG 4.36Å; T258-L285 HydrophobicContact CG2-CD2 4.26Å; M282-L285 HydrophobicContact CE-CD1 3.64Å; M282-L285 HydrophobicContact CE-CD2 4.02Å; M282-L285 HydrophobicContact CE-CG 3.85Å; N283-L285 PolarHBondContact O-N 2.93Å; L285-T287 PolarHBondContact O-N 3.21Å; L285-L289 HydrophobicContact CB-CD1 4.39Å; L285-L289 HydrophobicContact CD2-CD1 4.07Å; L285-I294 HydrophobicContact CD1-CB 4.46Å; L285-I294 HydrophobicContact CD1-CG1 4.1Å; L285-I294 HydrophobicContact CD1-CG2 3.85Å; L285-L297 HydrophobicContact CD2-CD2 3.87Å
286	P	91.1	Very high	94.9	Very high	29 Å²	29	59.9 Å²	59.9	19%	0.188	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-57.9	134.7	169.5	-22.6	31.9	0	0	0	112	T258 Q288 L289	T258-P286 HydrophobicContact CG2-CG 4.31Å; P286-Q288 PolarHBondContact O-N 2.67Å; P286-Q288 VanDerWaalsContact O-N 3.11Å; P286-L289 HydrophobicContact CB-CG 4.35Å; P286-L289 PolarHBondContact O-N 3.49Å
287	T	90.3	Very high	95	Very high	131 Å²	131	57.3 Å²	57.3	80%	0.804	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-10.9	-178.2	50.9	0	0	0	0	114.2	L285	L285-T287 PolarHBondContact O-N 3.21Å
288	Q	92.1	Very high	95.1	Very high	132 Å²	132	64.9 Å²	64.9	62%	0.617	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	1.2	179.1	-51.5	80.6	11.8	0	0	113.9	P286	P286-Q288 PolarHBondContact O-N 2.67Å; P286-Q288 VanDerWaalsContact O-N 3.11Å
289	L	94.9	Very high	95.2	Very high	13 Å²	13	64.1 Å²	64.1	7%	0.068	35%	0.353	C	S	.	.	S	Bend	trans	-78.7	140.3	175.5	-65.4	-178.2	0	0	0	111.2	L257 L285 P286 I294	L257-L289 HydrophobicContact CB-CD1 4.22Å; L257-L289 HydrophobicContact CB-CD2 4.25Å; L257-L289 HydrophobicContact CD1-CD1 4.28Å; L257-L289 HydrophobicContact CD1-CD2 4.41Å; L257-L289 HydrophobicContact CD2-CD2 3.95Å; L257-L289 HydrophobicContact CG-CD2 4.43Å; L285-L289 HydrophobicContact CB-CD1 4.39Å; L285-L289 HydrophobicContact CD2-CD1 4.07Å; P286-L289 HydrophobicContact CB-CG 4.35Å; P286-L289 PolarHBondContact O-N 3.49Å; L289-I294 HydrophobicContact CB-CD1 4.12Å; L289-I294 HydrophobicContact CB-CG1 3.93Å
290	S	96.1	Very high	95.3	Very high	39 Å²	39	60 Å²	60	27%	0.273	33%	0.332	S	S	.	.			trans	-66.8	148.7	178.8	73.7	0	0	0	0	112.1	E160 G292 A293 I294	E160-S290 VanDerWaalsContact CD-OG 3.22Å; E160-S290 WeakPolarHBondContact OE1-CB 3.32Å; E160-S290 PolarHBondContact OE1-OG 3.37Å; E160-S290 WeakPolarHBondContact OE2-CB 3.39Å; E160-S290 PolarHBondContact OE2-N 2.85Å; E160-S290 PolarHBondContact OE2-OG 2.67Å; E160-S290 VanDerWaalsContact OE2-OG 3.07Å; S290-G292 PolarHBondContact O-N 3.25Å; S290-G292 VanDerWaalsContact O-N 3.1Å; S290-A293 WeakPolarHBondContact O-CB 3.31Å; S290-A293 PolarHBondContact O-N 2.99Å; S290-A293 PolarHBondContact OG-N 3.24Å; S290-A293 VanDerWaalsContact OG-N 3.08Å; S290-I294 WeakPolarHBondContact O-CG1 3.48Å; S290-I294 PolarHBondContact O-N 3.12Å
291	T	95.4	Very high	95.4	Very high	123 Å²	123	55.1 Å²	55.1	76%	0.755	31%	0.311	S	S	*	.	H	α-helix	trans	-55.3	-30	173.1	-43.5	0	0	0	0	111.8	S295	T291-S295 WeakPolarHBondContact O-CB 3.47Å; T291-S295 PolarHBondContact O-N 2.92Å
292	G	95.8	Very high	95.6	Very high	32 Å²	32	51.5 Å²	51.5	33%	0.33	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-49.1	172.2	0	0	0	0	0	113	S290 S295 F296	S290-G292 PolarHBondContact O-N 3.25Å; S290-G292 VanDerWaalsContact O-N 3.1Å; G292-S295 PolarHBondContact O-N 2.98Å; G292-F296 WeakPolarHBondContact O-CB 3.46Å; G292-F296 PolarHBondContact O-N 2.88Å
293	A	96.8	Very high	95.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-46.7	176.6	0	0	0	0	0	111.5	E160 M253 S290 F296 L297 W319	E160-A293 HydrophobicContact CG-CB 4.14Å; M253-A293 HydrophobicContact CE-CB 4.3Å; M253-A293 WeakPolarHBondContact CE-O 3.47Å; S290-A293 WeakPolarHBondContact O-CB 3.31Å; S290-A293 PolarHBondContact O-N 2.99Å; S290-A293 PolarHBondContact OG-N 3.24Å; S290-A293 VanDerWaalsContact OG-N 3.08Å; A293-F296 PolarHBondContact O-N 3.15Å; A293-L297 WeakPolarHBondContact O-CB 3.08Å; A293-L297 PolarHBondContact O-N 3.47Å; A293-W319 HydrophobicContact CB-CZ2 4.17Å; A293-W319 VanDerWaalsContact N-CD1 3.28Å
294	I	97.2	Very high	95.8	Very high	34 Å²	34	50.9 Å²	50.9	17%	0.174	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-43.3	-179.7	-60.5	176.3	0	0	0	110.9	L285 L289 S290 R298	L285-I294 HydrophobicContact CD1-CB 4.46Å; L285-I294 HydrophobicContact CD1-CG1 4.1Å; L285-I294 HydrophobicContact CD1-CG2 3.85Å; L289-I294 HydrophobicContact CB-CD1 4.12Å; L289-I294 HydrophobicContact CB-CG1 3.93Å; S290-I294 WeakPolarHBondContact O-CG1 3.48Å; S290-I294 PolarHBondContact O-N 3.12Å; I294-R298 WeakPolarHBondContact O-CB 3.39Å; I294-R298 VanDerWaalsContact O-CG 3.31Å; I294-R298 WeakPolarHBondContact O-CG 3.44Å; I294-R298 PolarHBondContact O-N 2.98Å
295	S	97.1	Very high	95.8	Very high	76 Å²	76	47.6 Å²	47.6	53%	0.531	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-47.4	177.8	-178	0	0	0	0	111.8	T291 G292 R298 S299	T291-S295 WeakPolarHBondContact O-CB 3.47Å; T291-S295 PolarHBondContact O-N 2.92Å; G292-S295 PolarHBondContact O-N 2.98Å; S295-R298 PolarHBondContact O-N 3Å; S295-S299 PolarHBondContact O-N 2.7Å
296	F	98	Very high	95.8	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-46.1	177.6	-178	-134.4	0	0	0	111.9	I167 I171 M253 G292 A293 R298 S299 L300 A314 N317 W319 L320	I167-F296 HydrophobicContact CG2-CE1 4.1Å; I171-F296 HydrophobicContact CD1-CE1 4.23Å; I171-F296 HydrophobicContact CD1-CZ 3.73Å; M253-F296 HydrophobicContact CE-CD1 3.93Å; M253-F296 HydrophobicContact SD-CD1 3.71Å; M253-F296 HydrophobicContact SD-CE1 4.11Å; G292-F296 WeakPolarHBondContact O-CB 3.46Å; G292-F296 PolarHBondContact O-N 2.88Å; A293-F296 PolarHBondContact O-N 3.15Å; F296-R298 PolarHBondContact O-N 2.97Å; F296-S299 WeakPolarHBondContact O-CB 3.33Å; F296-S299 PolarHBondContact O-N 3.06Å; F296-S299 PolarHBondContact O-OG 2.78Å; F296-L300 HydrophobicContact CD1-CD1 4.22Å; F296-L300 HydrophobicContact CD2-CD1 4.48Å; F296-L300 HydrophobicContact CD2-CG 4.26Å; F296-L300 HydrophobicContact CE1-CD1 3.89Å; F296-L300 HydrophobicContact CE2-CD1 4.16Å; F296-L300 HydrophobicContact CE2-CD2 3.89Å; F296-L300 HydrophobicContact CE2-CG 3.99Å; F296-L300 HydrophobicContact CZ-CD1 3.88Å; F296-L300 HydrophobicContact CZ-CD2 4.07Å; F296-L300 HydrophobicContact CZ-CG 4.2Å; F296-L300 WeakPolarHBondContact O-CG 3.47Å; F296-L300 PolarHBondContact O-N 3.34Å; F296-A314 HydrophobicContact CE2-CB 4.2Å; F296-A314 HydrophobicContact CZ-CB 4.39Å; F296-N317 HydrophobicContact CD2-CB 3.65Å; F296-N317 VanDerWaalsContact CD2-ND2 3.28Å; F296-N317 WeakPolarHBondContact CD2-ND2 3.25Å; F296-N317 HydrophobicContact CE2-CB 3.53Å; F296-N317 HydrophobicContact CG-CB 4.35Å; F296-N317 HydrophobicContact CZ-CB 4.14Å; F296-W319 HydrophobicContact CB-CB 4.35Å; F296-W319 HydrophobicContact CD1-CD2 4.31Å; F296-W319 AromaticContact CD1-CE3 3.37Å; F296-W319 HydrophobicContact CD1-CE3 3.37Å; F296-W319 AromaticContact CD1-CZ3 3.75Å; F296-W319 HydrophobicContact CD1-CZ3 3.75Å; F296-W319 AromaticContact CE1-CE3 3.88Å; F296-W319 HydrophobicContact CE1-CE3 3.88Å; F296-W319 AromaticContact CE1-CZ3 3.99Å; F296-W319 HydrophobicContact CE1-CZ3 3.99Å; F296-W319 HydrophobicContact CG-CE3 4.3Å; F296-L320 HydrophobicContact CE1-CB 4.44Å; F296-L320 HydrophobicContact CE1-CD1 4.12Å
297	L	98.3	Very high	96.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.4	-45.9	177.4	178.8	55	0	0	0	112.3	G250 M253 Y254 M282 L285 A293 S299 L300 L301	G250-L297 WeakPolarHBondContact O-CD1 3.39Å; M253-L297 HydrophobicContact CB-CD1 4.06Å; M253-L297 HydrophobicContact CE-CB 4Å; M253-L297 HydrophobicContact CG-CD1 4.08Å; M253-L297 HydrophobicContact SD-CB 4.14Å; M253-L297 HydrophobicContact SD-CD1 4.23Å; Y254-L297 HydrophobicContact CD2-CD2 4.07Å; M282-L297 HydrophobicContact CE-CD2 4.5Å; L285-L297 HydrophobicContact CD2-CD2 3.87Å; A293-L297 WeakPolarHBondContact O-CB 3.08Å; A293-L297 PolarHBondContact O-N 3.47Å; L297-S299 VanDerWaalsContact C-N 3.31Å; L297-S299 PolarHBondContact O-N 3.45Å; L297-L300 PolarHBondContact O-N 3.3Å; L297-L301 HydrophobicContact CD1-CD1 3.82Å; L297-L301 HydrophobicContact CD1-CG 4.29Å; L297-L301 HydrophobicContact CG-CD1 4.33Å; L297-L301 PolarHBondContact O-N 3.38Å
298	R	97.6	Very high	96.5	Very high	158 Å²	158	51 Å²	51	60%	0.596	28%	0.28	S	S	*	.	H	α-helix	trans	-62.3	-35.5	174.9	-75.4	173.5	174.4	167.5	-1.6	112.6	I294 S295 F296 L301 E302	I294-R298 WeakPolarHBondContact O-CB 3.39Å; I294-R298 VanDerWaalsContact O-CG 3.31Å; I294-R298 WeakPolarHBondContact O-CG 3.44Å; I294-R298 PolarHBondContact O-N 2.98Å; S295-R298 PolarHBondContact O-N 3Å; F296-R298 PolarHBondContact O-N 2.97Å; R298-L301 CarbonylContact O-C 3.55Å; R298-L301 PolarHBondContact O-N 2.89Å; R298-E302 PolarHBondContact O-N 3.39Å
299	S	98.1	Very high	96.7	Very high	38 Å²	38	45.7 Å²	45.7	27%	0.266	26%	0.257	S	S	.	.	H	α-helix	trans	-67.8	-38	176	77.4	0	0	0	0	112.9	S295 F296 L297 E302 P309	S295-S299 PolarHBondContact O-N 2.7Å; F296-S299 WeakPolarHBondContact O-CB 3.33Å; F296-S299 PolarHBondContact O-N 3.06Å; F296-S299 PolarHBondContact O-OG 2.78Å; L297-S299 VanDerWaalsContact C-N 3.31Å; L297-S299 PolarHBondContact O-N 3.45Å; S299-E302 WeakPolarHBondContact O-CB 3.28Å; S299-E302 PolarHBondContact O-N 3.42Å; S299-P309 WeakPolarHBondContact O-CD 2.95Å
300	L	98.4	Very high	96.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-39.5	175.3	-63.5	173.3	0	0	0	111.5	V246 I249 M253 F296 L297 E302 R308 A314	V246-L300 HydrophobicContact CG1-CD2 3.54Å; I249-L300 HydrophobicContact CG2-CD1 4.28Å; M253-L300 HydrophobicContact SD-CD1 3.98Å; F296-L300 HydrophobicContact CD1-CD1 4.22Å; F296-L300 HydrophobicContact CD2-CD1 4.48Å; F296-L300 HydrophobicContact CD2-CG 4.26Å; F296-L300 HydrophobicContact CE1-CD1 3.89Å; F296-L300 HydrophobicContact CE2-CD1 4.16Å; F296-L300 HydrophobicContact CE2-CD2 3.89Å; F296-L300 HydrophobicContact CE2-CG 3.99Å; F296-L300 HydrophobicContact CZ-CD1 3.88Å; F296-L300 HydrophobicContact CZ-CD2 4.07Å; F296-L300 HydrophobicContact CZ-CG 4.2Å; F296-L300 WeakPolarHBondContact O-CG 3.47Å; F296-L300 PolarHBondContact O-N 3.34Å; L297-L300 PolarHBondContact O-N 3.3Å; L300-E302 VanDerWaalsContact C-N 3.25Å; L300-E302 PolarHBondContact O-N 3.14Å; L300-R308 WeakPolarHBondContact O-CD 3.31Å; L300-A314 HydrophobicContact CD2-CB 3.96Å
301	L	98.3	Very high	96.6	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.042	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	30.8	177.4	-63	178.3	0	0	0	113.2	W247 V251 P262 F263 M282 L297 R298 P303	W247-L301 HydrophobicContact CD2-CD2 3.88Å; W247-L301 HydrophobicContact CE3-CB 4.46Å; W247-L301 HydrophobicContact CE3-CD2 4.13Å; W247-L301 HydrophobicContact CG-CD2 4.31Å; W247-L301 HydrophobicContact CH2-CD2 4.48Å; W247-L301 HydrophobicContact CZ2-CD2 4.25Å; W247-L301 VanDerWaalsContact CZ3-C 3.45Å; W247-L301 HydrophobicContact CZ3-CB 4.26Å; W247-L301 HydrophobicContact CZ3-CD2 4.42Å; W247-L301 VanDerWaalsContact CZ3-O 3.24Å; W247-L301 WeakPolarHBondContact CZ3-O 3.49Å; V251-L301 HydrophobicContact CG2-CD2 3.83Å; P262-L301 HydrophobicContact CB-CD1 3.96Å; P262-L301 HydrophobicContact CG-CD1 4.3Å; F263-L301 HydrophobicContact CE2-CD1 4.38Å; F263-L301 HydrophobicContact CE2-CD2 4.38Å; M282-L301 HydrophobicContact SD-CD1 3.58Å; M282-L301 VanDerWaalsContact SD-CD1 3.58Å; L297-L301 HydrophobicContact CD1-CD1 3.82Å; L297-L301 HydrophobicContact CD1-CG 4.29Å; L297-L301 HydrophobicContact CG-CD1 4.33Å; L297-L301 PolarHBondContact O-N 3.38Å; R298-L301 CarbonylContact O-C 3.55Å; R298-L301 PolarHBondContact O-N 2.89Å; L301-P303 WeakPolarHBondContact O-CD 3.45Å
302	E	98	Very high	96.5	Very high	35 Å²	35	44.2 Å²	44.2	16%	0.164	24%	0.239	C	C	.	.			trans	-74.3	120.9	170.7	-179.8	54.8	-137.1	0	0	109.9	K280 R298 S299 L300 D304 K307 R308	K280-E302 IonicContact NZ-OE1 2.64Å; K280-E302 PolarHBondContact NZ-OE1 3.19Å; K280-E302 IonicContact NZ-OE2 2.69Å; K280-E302 PolarHBondContact NZ-OE2 3.13Å; R298-E302 PolarHBondContact O-N 3.39Å; S299-E302 WeakPolarHBondContact O-CB 3.28Å; S299-E302 PolarHBondContact O-N 3.42Å; L300-E302 VanDerWaalsContact C-N 3.25Å; L300-E302 PolarHBondContact O-N 3.14Å; E302-D304 VanDerWaalsContact C-N 3.33Å; E302-D304 HydrophobicContact CG-CB 4.43Å; E302-D304 PolarHBondContact O-N 2.86Å; E302-K307 HydrophobicContact CG-CB 3.69Å; E302-R308 HydrophobicContact CB-CB 3.99Å; E302-R308 HydrophobicContact CB-CG 4.27Å; E302-R308 HydrophobicContact CG-CB 4.41Å; E302-R308 PolarHBondContact O-NE 2.89Å; E302-R308 PolarHBondContact O-NH2 2.96Å; E302-R308 VanDerWaalsContact O-NH2 3.07Å
303	P	96.5	Very high	96.4	Very high	16 Å²	16	48 Å²	48	10%	0.104	25%	0.248	C	C	.	.	S	Bend	trans	-69.6	-30.7	-174.9	-22.7	36.8	0	0	0	113.1	P232 W247 M277 K280 L301 P305 R308	P232-P303 HydrophobicContact CG-CB 3.98Å; W247-P303 HydrophobicContact CZ3-CB 4.39Å; W247-P303 HydrophobicContact CZ3-CG 4.2Å; M277-P303 WeakPolarHBondContact O-CG 3.35Å; K280-P303 HydrophobicContact CD-CG 4.4Å; K280-P303 VanDerWaalsContact CE-CD 3.47Å; K280-P303 HydrophobicContact CG-CG 3.86Å; L301-P303 WeakPolarHBondContact O-CD 3.45Å; P303-P305 VanDerWaalsContact O-CD 3.3Å; P303-P305 WeakPolarHBondContact O-CD 3.36Å; P303-R308 PolarHBondContact O-NH2 2.93Å
304	D	95.4	Very high	96.3	Very high	46 Å²	46	48 Å²	48	25%	0.246	25%	0.248	C	C	.	.	S	Bend	trans	-76.5	111.6	175.6	-179	-14.5	0	0	0	110.5	E302 V306 K307 R308	E302-D304 VanDerWaalsContact C-N 3.33Å; E302-D304 HydrophobicContact CG-CB 4.43Å; E302-D304 PolarHBondContact O-N 2.86Å; D304-V306 PolarHBondContact O-N 2.87Å; D304-V306 WeakPolarHBondContact OD1-CA 3.28Å; D304-V306 VanDerWaalsContact OD1-CB 3.26Å; D304-V306 WeakPolarHBondContact OD1-CB 3.24Å; D304-V306 PolarHBondContact OD1-N 3.4Å; D304-K307 HydrophobicContact CB-CB 4.15Å; D304-K307 HydrophobicContact CB-CD 4.11Å; D304-K307 HydrophobicContact CB-CG 4.21Å; D304-K307 PolarHBondContact O-N 3.18Å; D304-K307 VanDerWaalsContact O-N 3.15Å; D304-K307 WeakPolarHBondContact OD2-CD 3.26Å; D304-K307 VanDerWaalsContact OD2-CE 3.31Å; D304-K307 WeakPolarHBondContact OD2-CE 3.03Å; D304-K307 WeakPolarHBondContact OD2-CG 3.27Å; D304-K307 IonicContact OD2-NZ 3.73Å; D304-K307 PolarHBondContact OD2-NZ 3.07Å; D304-R308 PolarHBondContact O-N 2.76Å
305	P	93.5	Very high	96.1	Very high	51 Å²	51	46.6 Å²	46.6	33%	0.331	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-10.8	-178.9	31	-36.2	0	0	0	113.4	K243 P303	K243-P305 WeakPolarHBondContact CD-O 3.2Å; K243-P305 WeakPolarHBondContact CE-O 3.28Å; K243-P305 PolarHBondContact NZ-O 3.18Å; P303-P305 VanDerWaalsContact O-CD 3.3Å; P303-P305 WeakPolarHBondContact O-CD 3.36Å
306	V	94.1	Very high	95.8	Very high	120 Å²	120	46 Å²	46	73%	0.727	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-50.6	168.8	-175.1	0	0	0	0	109	K243 D304	K243-V306 PolarHBondContact NZ-O 2.8Å; D304-V306 PolarHBondContact O-N 2.87Å; D304-V306 WeakPolarHBondContact OD1-CA 3.28Å; D304-V306 VanDerWaalsContact OD1-CB 3.26Å; D304-V306 WeakPolarHBondContact OD1-CB 3.24Å; D304-V306 PolarHBondContact OD1-N 3.4Å
307	K	96.8	Very high	95.6	Very high	149 Å²	149	47.9 Å²	47.9	65%	0.648	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-33.2	-177.4	-63.3	177.6	-174.7	114.2	0	114	E302 D304	E302-K307 HydrophobicContact CG-CB 3.69Å; D304-K307 HydrophobicContact CB-CB 4.15Å; D304-K307 HydrophobicContact CB-CD 4.11Å; D304-K307 HydrophobicContact CB-CG 4.21Å; D304-K307 PolarHBondContact O-N 3.18Å; D304-K307 VanDerWaalsContact O-N 3.15Å; D304-K307 WeakPolarHBondContact OD2-CD 3.26Å; D304-K307 VanDerWaalsContact OD2-CE 3.31Å; D304-K307 WeakPolarHBondContact OD2-CE 3.03Å; D304-K307 WeakPolarHBondContact OD2-CG 3.27Å; D304-K307 IonicContact OD2-NZ 3.73Å; D304-K307 PolarHBondContact OD2-NZ 3.07Å
308	R	97.9	Very high	95.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.29	C	S	.	.	S	Bend	trans	-55.8	134.5	174.9	-164.6	-174.3	-51.9	142.4	9.8	110	E233 K243 V246 L300 E302 P303 D304	E233-R308 IonicContact OE1-CZ 3.61Å; E233-R308 IonicContact OE1-NH1 2.76Å; E233-R308 PolarHBondContact OE1-NH1 2.9Å; E233-R308 IonicContact OE1-NH2 3.07Å; E233-R308 PolarHBondContact OE1-NH2 2.98Å; E233-R308 IonicContact OE2-CZ 3.26Å; E233-R308 IonicContact OE2-NH1 2.69Å; E233-R308 IonicContact OE2-NH2 3.09Å; E233-R308 PolarHBondContact OE2-NH2 3.46Å; K243-R308 VanDerWaalsContact CE-O 3.23Å; K243-R308 WeakPolarHBondContact CE-O 3.31Å; K243-R308 PolarHBondContact NZ-O 2.69Å; K243-R308 PolarHBondContact O-NH1 3.03Å; V246-R308 HydrophobicContact CG1-CG 4.35Å; L300-R308 WeakPolarHBondContact O-CD 3.31Å; E302-R308 HydrophobicContact CB-CB 3.99Å; E302-R308 HydrophobicContact CB-CG 4.27Å; E302-R308 HydrophobicContact CG-CB 4.41Å; E302-R308 PolarHBondContact O-NE 2.89Å; E302-R308 PolarHBondContact O-NH2 2.96Å; E302-R308 VanDerWaalsContact O-NH2 3.07Å; P303-R308 PolarHBondContact O-NH2 2.93Å; D304-R308 PolarHBondContact O-N 2.76Å
309	P	97.1	Very high	95.1	Very high	20 Å²	20	51.2 Å²	51.2	13%	0.13	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-61.2	153	179.2	25.3	-33.4	0	0	0	111.7	V246 S299 Q313	V246-P309 HydrophobicContact CG1-CG 4.41Å; S299-P309 WeakPolarHBondContact O-CD 2.95Å; P309-Q313 HydrophobicContact CB-CB 3.72Å
310	N	94.7	Very high	94.8	Very high	54 Å²	54	49.4 Å²	49.4	29%	0.289	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-73.7	170	161.1	71.6	29.2	0	0	0	110.4	Q312 Q313 A314	N310-Q312 VanDerWaalsContact C-N 3.29Å; N310-Q312 PolarHBondContact O-N 2.96Å; N310-Q312 PolarHBondContact OD1-N 3.49Å; N310-Q312 PolarHBondContact OD1-OE1 3.01Å; N310-Q313 PolarHBondContact O-N 2.77Å; N310-Q313 WeakPolarHBondContact OD1-CB 3.15Å; N310-Q313 VanDerWaalsContact OD1-CG 3.27Å; N310-Q313 WeakPolarHBondContact OD1-CG 3.4Å; N310-Q313 PolarHBondContact OD1-N 3.32Å; N310-Q313 PolarHBondContact OD1-OE1 3.29Å; N310-A314 PolarHBondContact O-N 2.82Å
311	I	94.8	Very high	94.3	Very high	3 Å²	3	51 Å²	51	2%	0.015	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-30.9	-173.5	-166.7	70.3	0	0	0	112.5	I171 V174 E175 H178 V246 I249 A314 L315	I171-I311 HydrophobicContact CB-CD1 4.48Å; I171-I311 HydrophobicContact CG2-CD1 3.79Å; I171-I311 HydrophobicContact CG2-CG1 4.14Å; V174-I311 HydrophobicContact CB-CD1 4.06Å; V174-I311 HydrophobicContact CB-CG1 4.49Å; V174-I311 HydrophobicContact CG1-CD1 3.76Å; V174-I311 HydrophobicContact CG1-CG1 4.19Å; E175-I311 HydrophobicContact CB-CG1 3.83Å; E175-I311 HydrophobicContact CB-CG2 4.27Å; E175-I311 HydrophobicContact CG-CG1 4.39Å; E175-I311 HydrophobicContact CG-CG2 4.04Å; H178-I311 HydrophobicContact CB-CG2 4.11Å; H178-I311 WeakPolarHBondContact ND1-CG2 3.38Å; V246-I311 HydrophobicContact CG2-CB 4.21Å; V246-I311 HydrophobicContact CG2-CD1 4.02Å; I249-I311 HydrophobicContact CD1-CD1 3.68Å; I311-A314 PolarHBondContact O-N 3.46Å; I311-L315 WeakPolarHBondContact O-CB 3.39Å; I311-L315 PolarHBondContact O-N 3.05Å
312	Q	91.9	Very high	93.6	Very high	88 Å²	88	54.6 Å²	54.6	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-69.8	-41.6	174.6	-63.8	79.1	11.7	0	0	112.1	E175 N310 A314 L315 A316	E175-Q312 HydrophobicContact CG-CG 4.29Å; E175-Q312 PolarHBondContact OE1-NE2 2.79Å; E175-Q312 VanDerWaalsContact OE1-NE2 3.09Å; N310-Q312 VanDerWaalsContact C-N 3.29Å; N310-Q312 PolarHBondContact O-N 2.96Å; N310-Q312 PolarHBondContact OD1-N 3.49Å; N310-Q312 PolarHBondContact OD1-OE1 3.01Å; Q312-A314 VanDerWaalsContact C-N 3.33Å; Q312-L315 PolarHBondContact O-N 3.28Å; Q312-A316 WeakPolarHBondContact O-CB 3.29Å; Q312-A316 PolarHBondContact O-N 2.83Å
313	Q	94.1	Very high	92.3	Very high	111 Å²	111	60.4 Å²	60.4	52%	0.519	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-38.2	173.8	-73.5	167.7	-33.7	0	0	111.6	P309 N310 A316 N317	P309-Q313 HydrophobicContact CB-CB 3.72Å; N310-Q313 PolarHBondContact O-N 2.77Å; N310-Q313 WeakPolarHBondContact OD1-CB 3.15Å; N310-Q313 VanDerWaalsContact OD1-CG 3.27Å; N310-Q313 WeakPolarHBondContact OD1-CG 3.4Å; N310-Q313 PolarHBondContact OD1-N 3.32Å; N310-Q313 PolarHBondContact OD1-OE1 3.29Å; Q313-A316 PolarHBondContact O-N 3.01Å; Q313-N317 PolarHBondContact O-N 3.13Å
314	A	95.4	Very high	91	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.008	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-40.3	172.7	0	0	0	0	0	112	I171 F296 L300 N310 I311 Q312 A316 N317	I171-A314 HydrophobicContact CD1-CB 4.44Å; F296-A314 HydrophobicContact CE2-CB 4.2Å; F296-A314 HydrophobicContact CZ-CB 4.39Å; L300-A314 HydrophobicContact CD2-CB 3.96Å; N310-A314 PolarHBondContact O-N 2.82Å; I311-A314 PolarHBondContact O-N 3.46Å; Q312-A314 VanDerWaalsContact C-N 3.33Å; A314-A316 VanDerWaalsContact C-N 3.32Å; A314-A316 PolarHBondContact O-N 2.99Å; A314-N317 VanDerWaalsContact O-CB 3.29Å; A314-N317 WeakPolarHBondContact O-CB 3.16Å; A314-N317 PolarHBondContact O-N 2.8Å
315	L	91.6	Very high	89.3	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	35%	0.351	C	S	.	.	H	α-helix	trans	-67.2	-30.7	177.3	-167	53.9	0	0	0	113.1	I171 E175 I311 Q312 N317 L320 N321 P329 C330	I171-L315 HydrophobicContact CB-CD1 4.3Å; I171-L315 HydrophobicContact CG2-CB 3.8Å; I171-L315 HydrophobicContact CG2-CD1 3.73Å; I171-L315 HydrophobicContact CG2-CG 4.27Å; E175-L315 HydrophobicContact CB-CD2 4.43Å; E175-L315 HydrophobicContact CG-CD2 4.22Å; I311-L315 WeakPolarHBondContact O-CB 3.39Å; I311-L315 PolarHBondContact O-N 3.05Å; Q312-L315 PolarHBondContact O-N 3.28Å; L315-N317 VanDerWaalsContact C-N 3.3Å; L315-N317 PolarHBondContact O-N 2.69Å; L315-L320 HydrophobicContact CD1-CD2 3.95Å; L315-N321 PolarHBondContact O-ND2 3.09Å; L315-P329 HydrophobicContact CD1-CB 3.71Å; L315-P329 HydrophobicContact CD1-CG 4.35Å; L315-P329 HydrophobicContact CD2-CB 4.32Å; L315-P329 HydrophobicContact CG-CB 4.19Å; L315-C330 HydrophobicContact CD2-CB 4.46Å
316	A	90.6	Very high	87.8	Confident	65 Å²	65	67.9 Å²	67.9	54%	0.537	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-0.6	175.7	0	0	0	0	0	114.3	Q312 Q313 A314	Q312-A316 WeakPolarHBondContact O-CB 3.29Å; Q312-A316 PolarHBondContact O-N 2.83Å; Q313-A316 PolarHBondContact O-N 3.01Å; A314-A316 VanDerWaalsContact C-N 3.32Å; A314-A316 PolarHBondContact O-N 2.99Å
317	N	93.8	Very high	85.9	Confident	39 Å²	39	70.2 Å²	70.2	21%	0.209	35%	0.352	C	S	.	.			trans	-63.6	140.5	-174.3	-173.3	-79.8	0	0	0	113	F296 Q313 A314 L315 W319 L320 N321	F296-N317 HydrophobicContact CD2-CB 3.65Å; F296-N317 VanDerWaalsContact CD2-ND2 3.28Å; F296-N317 WeakPolarHBondContact CD2-ND2 3.25Å; F296-N317 HydrophobicContact CE2-CB 3.53Å; F296-N317 HydrophobicContact CG-CB 4.35Å; F296-N317 HydrophobicContact CZ-CB 4.14Å; Q313-N317 PolarHBondContact O-N 3.13Å; A314-N317 VanDerWaalsContact O-CB 3.29Å; A314-N317 WeakPolarHBondContact O-CB 3.16Å; A314-N317 PolarHBondContact O-N 2.8Å; L315-N317 VanDerWaalsContact C-N 3.3Å; L315-N317 PolarHBondContact O-N 2.69Å; N317-W319 PolarHBondContact O-N 3.41Å; N317-W319 WeakPolarHBondContact OD1-CB 3.5Å; N317-W319 PolarHBondContact OD1-N 2.97Å; N317-L320 HydrophobicContact CB-CB 4.32Å; N317-L320 PolarHBondContact O-N 3.05Å; N317-N321 PolarHBondContact O-N 3.36Å; N317-N321 PolarHBondContact O-ND2 2.97Å
318	R	92.2	Very high	84	Confident	223 Å²	223	66 Å²	66	84%	0.842	34%	0.339	S	S	*	.	H	α-helix	trans	-57.6	-45.5	-178.6	-175.4	177	178.2	172.4	0.5	113.2	L320 N321 E322	R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 2.98Å; R318-N321 PolarHBondContact O-N 2.91Å; R318-E322 PolarHBondContact O-N 3.44Å
319	W	94.3	Very high	82	Confident	5 Å²	5	66.4 Å²	66.4	2%	0.019	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-37.7	-179.9	175.2	82.5	0	0	0	111.8	E160 R164 M253 A293 F296 N317 N321 E322	E160-W319 HydrophobicContact CG-CZ2 3.63Å; E160-W319 PolarHBondContact OE1-NE1 3.41Å; R164-W319 HydrophobicContact CB-CH2 3.61Å; R164-W319 HydrophobicContact CB-CZ2 3.73Å; R164-W319 HydrophobicContact CB-CZ3 4.15Å; R164-W319 VanDerWaalsContact CD-O 3.24Å; R164-W319 WeakPolarHBondContact CD-O 3.31Å; R164-W319 HydrophobicContact CG-CD2 4.45Å; R164-W319 HydrophobicContact CG-CE3 4.28Å; R164-W319 HydrophobicContact CG-CH2 4.01Å; R164-W319 HydrophobicContact CG-CZ2 4.14Å; R164-W319 HydrophobicContact CG-CZ3 4.07Å; R164-W319 PolarHBondContact NE-O 3.22Å; M253-W319 HydrophobicContact CE-CD2 4.42Å; M253-W319 HydrophobicContact CE-CE3 4.09Å; M253-W319 HydrophobicContact CE-CH2 3.61Å; M253-W319 HydrophobicContact CE-CZ2 3.99Å; M253-W319 HydrophobicContact CE-CZ3 3.67Å; M253-W319 HydrophobicContact SD-CH2 4.42Å; M253-W319 HydrophobicContact SD-CZ3 4.19Å; A293-W319 HydrophobicContact CB-CZ2 4.17Å; A293-W319 VanDerWaalsContact N-CD1 3.28Å; F296-W319 HydrophobicContact CB-CB 4.35Å; F296-W319 HydrophobicContact CD1-CD2 4.31Å; F296-W319 AromaticContact CD1-CE3 3.37Å; F296-W319 HydrophobicContact CD1-CE3 3.37Å; F296-W319 AromaticContact CD1-CZ3 3.75Å; F296-W319 HydrophobicContact CD1-CZ3 3.75Å; F296-W319 AromaticContact CE1-CE3 3.88Å; F296-W319 HydrophobicContact CE1-CE3 3.88Å; F296-W319 AromaticContact CE1-CZ3 3.99Å; F296-W319 HydrophobicContact CE1-CZ3 3.99Å; F296-W319 HydrophobicContact CG-CE3 4.3Å; N317-W319 PolarHBondContact O-N 3.41Å; N317-W319 WeakPolarHBondContact OD1-CB 3.5Å; N317-W319 PolarHBondContact OD1-N 2.97Å; W319-N321 PolarHBondContact O-N 3.3Å; W319-E322 WeakPolarHBondContact O-CB 3.36Å; W319-E322 PolarHBondContact O-N 3.02Å
320	L	91.3	Very high	79.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-28.2	179.7	-164	69.8	0	0	0	112.4	I167 R168 I171 F296 L315 N317 R318	I167-L320 HydrophobicContact CB-CD1 4.38Å; I167-L320 HydrophobicContact CG2-CD1 3.96Å; R168-L320 HydrophobicContact CB-CD1 3.91Å; R168-L320 HydrophobicContact CB-CG 4.19Å; R168-L320 HydrophobicContact CG-CG 4.24Å; R168-L320 PolarHBondContact NE-O 3.42Å; R168-L320 PolarHBondContact NH2-O 3.4Å; I171-L320 HydrophobicContact CD1-CD1 4.22Å; I171-L320 HydrophobicContact CD1-CD2 3.72Å; F296-L320 HydrophobicContact CE1-CB 4.44Å; F296-L320 HydrophobicContact CE1-CD1 4.12Å; L315-L320 HydrophobicContact CD1-CD2 3.95Å; N317-L320 HydrophobicContact CB-CB 4.32Å; N317-L320 PolarHBondContact O-N 3.05Å; R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 2.98Å
321	N	88.6	Confident	78.1	Confident	33 Å²	33	71.6 Å²	71.6	18%	0.176	37%	0.372	C	S	.	.	H	α-helix	trans	-106.4	0.7	-175.8	-63	-63.8	0	0	0	113.6	L315 N317 R318 W319 N323 Y324 V328 P329	L315-N321 PolarHBondContact O-ND2 3.09Å; N317-N321 PolarHBondContact O-N 3.36Å; N317-N321 PolarHBondContact O-ND2 2.97Å; R318-N321 PolarHBondContact O-N 2.91Å; W319-N321 PolarHBondContact O-N 3.3Å; N321-N323 PolarHBondContact O-N 3.33Å; N321-Y324 WeakPolarHBondContact O-CB 3.42Å; N321-Y324 PolarHBondContact O-N 3.03Å; N321-V328 WeakPolarHBondContact OD1-CG1 3.38Å; N321-P329 WeakPolarHBondContact OD1-CD 2.99Å
322	E	83	Confident	76.8	Confident	84 Å²	84	73.8 Å²	73.8	39%	0.393	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	131.5	172.2	-173.5	167.6	-140.4	0	0	111.6	R164 R318 W319 Y324	R164-E322 IonicContact CZ-OE2 3.7Å; R164-E322 IonicContact NE-OE2 2.85Å; R164-E322 IonicContact NH2-OE2 3.57Å; R164-E322 PolarHBondContact NH2-OE2 3.5Å; R318-E322 PolarHBondContact O-N 3.44Å; W319-E322 WeakPolarHBondContact O-CB 3.36Å; W319-E322 PolarHBondContact O-N 3.02Å; E322-Y324 PolarHBondContact O-N 2.81Å; E322-Y324 VanDerWaalsContact O-N 3.08Å
323	N	71.6	Confident	76	Confident	158 Å²	158	74 Å²	74	85%	0.845	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	26.1	-177.4	-58.4	-25.2	0	0	0	114.7	N321	N321-N323 PolarHBondContact O-N 3.33Å
324	Y	69.4	Low	75.4	Confident	86 Å²	86	72 Å²	72	34%	0.337	38%	0.379	S	S	.	.			trans	-90.5	110.4	178.5	-169.2	-114.5	0	0	0	111.5	R168 N321 E322 G326 K327 P329	R168-Y324 VanDerWaalsContact CZ-CD2 3.46Å; N321-Y324 WeakPolarHBondContact O-CB 3.42Å; N321-Y324 PolarHBondContact O-N 3.03Å; E322-Y324 PolarHBondContact O-N 2.81Å; E322-Y324 VanDerWaalsContact O-N 3.08Å; Y324-G326 VanDerWaalsContact C-N 3.35Å; Y324-G326 WeakPolarHBondContact CD1-O 3.09Å; Y324-K327 WeakPolarHBondContact CE1-O 3.42Å; Y324-P329 HydrophobicContact CE1-CG 4.13Å
325	T	59.2	Low	74.9	Confident	150 Å²	150	75.3 Å²	75.3	92%	0.92	40%	0.4	S	S	*	.			trans	-84.3	-3.3	-177.7	51.4	0	0	0	0	114.5
326	G	60.9	Low	74.6	Confident	34 Å²	34	77.7 Å²	77.7	35%	0.351	41%	0.413	S	S	.	.	S	Bend	trans	-89.3	170.5	175.6	0	0	0	0	0	113.1	Y324 V328	Y324-G326 VanDerWaalsContact C-N 3.35Å; Y324-G326 WeakPolarHBondContact CD1-O 3.09Å; G326-V328 PolarHBondContact O-N 3.43Å
327	K	54.8	Low	74.4	Confident	169 Å²	169	82.1 Å²	82.1	74%	0.735	42%	0.416	S	S	*	.			trans	-57.3	121.4	167.7	-70.1	-176	179.2	179.7	0	108.9	Y324 I332	Y324-K327 WeakPolarHBondContact CE1-O 3.42Å; K327-I332 HydrophobicContact CB-CG1 4.48Å
328	V	56	Low	74.1	Confident	61 Å²	61	80.8 Å²	80.8	37%	0.37	41%	0.408	S	S	.	.			trans	-45.8	128	-178.9	-173.2	0	0	0	0	109.7	N321 G326 C330 N331	N321-V328 WeakPolarHBondContact OD1-CG1 3.38Å; G326-V328 PolarHBondContact O-N 3.43Å; V328-C330 VanDerWaalsContact CG1-SG 3.5Å; V328-C330 PolarHBondContact O-N 2.79Å; V328-N331 PolarHBondContact O-N 3.44Å
329	P	56.7	Low	73.9	Confident	8 Å²	8	72.2 Å²	72.2	5%	0.052	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-60	-21.4	-166.1	-28	36	0	0	0	115.5	R168 L315 N321 Y324 N331 I332	R168-P329 HydrophobicContact CG-CG 3.82Å; L315-P329 HydrophobicContact CD1-CB 3.71Å; L315-P329 HydrophobicContact CD1-CG 4.35Å; L315-P329 HydrophobicContact CD2-CB 4.32Å; L315-P329 HydrophobicContact CG-CB 4.19Å; N321-P329 WeakPolarHBondContact OD1-CD 2.99Å; Y324-P329 HydrophobicContact CE1-CG 4.13Å; P329-N331 PolarHBondContact O-N 3.44Å; P329-N331 VanDerWaalsContact O-N 3.12Å; P329-I332 PolarHBondContact O-N 2.94Å
330	C	54.1	Low	73.6	Confident	56 Å²	56	77.6 Å²	77.6	38%	0.378	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-56.5	-23.7	171.8	60.8	0	0	0	0	113.7	L315 V328	L315-C330 HydrophobicContact CD2-CB 4.46Å; V328-C330 VanDerWaalsContact CG1-SG 3.5Å; V328-C330 PolarHBondContact O-N 2.79Å
331	N	56.8	Low	73.5	Confident	127 Å²	127	86.5 Å²	86.5	68%	0.679	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-95.9	-0.9	179	-64.5	6.1	0	0	0	112.9	V328 P329	V328-N331 PolarHBondContact O-N 3.44Å; P329-N331 PolarHBondContact O-N 3.44Å; P329-N331 VanDerWaalsContact O-N 3.12Å
332	I	67	Low	73.5	Confident	49 Å²	49	89.3 Å²	89.3	25%	0.251	47%	0.468	S	S	.	.			trans	-98.6	108.9	178.4	-53.7	-179.6	0	0	0	108.8	K327 P329 Y334	K327-I332 HydrophobicContact CB-CG1 4.48Å; P329-I332 PolarHBondContact O-N 2.94Å; I332-Y334 HydrophobicContact CB-CE2 4.37Å; I332-Y334 HydrophobicContact CG2-CD1 4.48Å; I332-Y334 HydrophobicContact CG2-CD2 4.18Å; I332-Y334 HydrophobicContact CG2-CE1 3.94Å; I332-Y334 HydrophobicContact CG2-CE2 3.61Å; I332-Y334 VanDerWaalsContact CG2-CZ 3.48Å
333	T	75.4	Confident	74	Confident	92 Å²	92	86.1 Å²	86.1	56%	0.564	45%	0.453	S	S	*	.			trans	-100	115.9	172.6	-64.9	0	0	0	0	109.1	R179	R179-T333 VanDerWaalsContact NH1-CG2 3.3Å; R179-T333 PolarHBondContact NH1-OG1 3.02Å
334	Y	81.1	Confident	75	Confident	70 Å²	70	79.5 Å²	79.5	28%	0.275	42%	0.419	S	S	.	.			trans	-84.6	130.1	174.3	-65.1	-78.9	0	0	0	110.2	H120 P121 H176 I332	H120-Y334 AromaticContact CD2-CD2 3.28Å; H120-Y334 WeakPolarHBondContact CD2-CD2 3.38Å; H120-Y334 AromaticContact CD2-CE2 3.88Å; H120-Y334 AromaticContact CD2-CG 3.72Å; H120-Y334 AromaticContact NE2-CD2 3.35Å; H120-Y334 VanDerWaalsContact NE2-CD2 3.35Å; H120-Y334 WeakPolarHBondContact NE2-CD2 3.41Å; H120-Y334 AromaticContact NE2-CE2 3.45Å; H120-Y334 WeakPolarHBondContact NE2-CE2 3.26Å; P121-Y334 VanDerWaalsContact CD-CD1 3.46Å; P121-Y334 HydrophobicContact CG-CD1 3.98Å; P121-Y334 HydrophobicContact CG-CE1 3.49Å; P121-Y334 VanDerWaalsContact CG-CE1 3.49Å; P121-Y334 HydrophobicContact CG-CE2 4.33Å; H176-Y334 PolarHBondContact CE1-O 3.32Å; I332-Y334 HydrophobicContact CB-CE2 4.37Å; I332-Y334 HydrophobicContact CG2-CD1 4.48Å; I332-Y334 HydrophobicContact CG2-CD2 4.18Å; I332-Y334 HydrophobicContact CG2-CE1 3.94Å; I332-Y334 HydrophobicContact CG2-CE2 3.61Å; I332-Y334 VanDerWaalsContact CG2-CZ 3.48Å
335	P	84.8	Confident	76.2	Confident	69 Å²	69	80.4 Å²	80.4	45%	0.448	44%	0.436	S	S	.	.			trans	-80.4	131.9	175.8	31.3	-33.3	0	0	0	110.8	R337	P335-R337 WeakPolarHBondContact CB-O 3.46Å; P335-R337 WeakPolarHBondContact CG-O 3.46Å; P335-R337 PolarHBondContact O-N 3.17Å
336	N	85.2	Confident	77.8	Confident	53 Å²	53	74.6 Å²	74.6	28%	0.283	40%	0.401	S	S	.	.	S	Bend	trans	-64.5	-1.2	172.6	-82.1	-40.7	0	0	0	114.2	M117 I118 R119 H176	M117-N336 WeakPolarHBondContact O-CB 3.42Å; M117-N336 PolarHBondContact O-OD1 3.1Å; I118-N336 WeakPolarHBondContact CA-OD1 3.45Å; R119-N336 PolarHBondContact N-OD1 2.89Å; H176-N336 PolarHBondContact CE1-OD1 3.2Å; H176-N336 PolarHBondContact NE2-OD1 2.95Å
337	R	87.2	Confident	79.4	Confident	159 Å²	159	73 Å²	73	60%	0.6	38%	0.384	S	S	*	.	S	Bend	trans	-133.9	158.3	179.7	-71.7	179	178.5	172.3	3.1	109.2	R119 P335 L367	R119-R337 PolarHBondContact NH1-O 3.01Å; P335-R337 WeakPolarHBondContact CB-O 3.46Å; P335-R337 WeakPolarHBondContact CG-O 3.46Å; P335-R337 PolarHBondContact O-N 3.17Å; R337-L367 VanDerWaalsContact CB-O 3.29Å; R337-L367 WeakPolarHBondContact CB-O 3.46Å; R337-L367 WeakPolarHBondContact CD-O 3.3Å; R337-L367 WeakPolarHBondContact CG-O 3.31Å
338	I	85.9	Confident	81.4	Confident	10 Å²	10	65.4 Å²	65.4	5%	0.051	35%	0.352	C	S	.	.			trans	-78.9	140	167.8	-78.8	167.9	0	0	0	107.4	D342 L343 V366 L367 Y378 F379	I338-D342 HydrophobicContact CG2-CB 3.94Å; I338-L343 HydrophobicContact CG2-CD2 3.72Å; I338-L343 HydrophobicContact CG2-CG 3.94Å; I338-V366 HydrophobicContact CB-CG1 4.2Å; I338-V366 HydrophobicContact CD1-CG1 3.47Å; I338-V366 VanDerWaalsContact CD1-CG1 3.47Å; I338-V366 HydrophobicContact CG1-CG1 4.4Å; I338-V366 HydrophobicContact CG2-CG1 4.06Å; I338-L367 HydrophobicContact CG2-CD2 4.21Å; I338-L367 WeakPolarHBondContact O-CD2 3.27Å; I338-Y378 HydrophobicContact CD1-CE1 4.1Å; I338-F379 HydrophobicContact CD1-CE1 3.93Å; I338-F379 HydrophobicContact CD1-CE2 4.32Å; I338-F379 HydrophobicContact CD1-CZ 3.56Å
339	S	88.1	Confident	83.2	Confident	44 Å²	44	64.7 Å²	64.7	31%	0.308	35%	0.346	S	S	.	.			trans	-80.6	166.3	168.9	74.1	0	0	0	0	110.5	E341 D342	S339-E341 PolarHBondContact O-N 3.42Å; S339-E341 PolarHBondContact OG-N 3.4Å; S339-D342 VanDerWaalsContact CB-OD2 3.28Å; S339-D342 WeakPolarHBondContact CB-OD2 3.44Å; S339-D342 PolarHBondContact N-OD2 3.26Å; S339-D342 VanDerWaalsContact N-OD2 3.15Å; S339-D342 PolarHBondContact O-N 2.75Å; S339-D342 PolarHBondContact OG-N 3.26Å; S339-D342 VanDerWaalsContact OG-N 3.07Å; S339-D342 PolarHBondContact OG-OD2 2.78Å
340	L	88.6	Confident	85	Confident	117 Å²	117	65 Å²	65	61%	0.613	35%	0.347	S	S	*	.	S	Bend	trans	-63.9	-29.9	175.2	-163.5	77.4	0	0	0	111.7	L343 I363 L367	L340-L343 HydrophobicContact CD1-CD1 3.88Å; L340-L343 WeakPolarHBondContact O-CB 3.38Å; L340-L343 PolarHBondContact O-N 2.86Å; L340-I363 HydrophobicContact CD1-CG2 4.08Å; L340-L367 HydrophobicContact CD1-CD1 4.02Å
341	E	88.8	Confident	86.9	Confident	188 Å²	188	62.3 Å²	62.3	88%	0.879	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-29.7	179.1	-65.3	155.5	-133.6	0	0	112.4	S339 L343	S339-E341 PolarHBondContact O-N 3.42Å; S339-E341 PolarHBondContact OG-N 3.4Å; E341-L343 PolarHBondContact O-N 3.2Å
342	D	89.4	Confident	88.8	Confident	92 Å²	92	57.5 Å²	57.5	49%	0.492	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-1.8	174.4	-65.9	-60.5	0	0	0	113.6	I338 S339	I338-D342 HydrophobicContact CG2-CB 3.94Å; S339-D342 VanDerWaalsContact CB-OD2 3.28Å; S339-D342 WeakPolarHBondContact CB-OD2 3.44Å; S339-D342 PolarHBondContact N-OD2 3.26Å; S339-D342 VanDerWaalsContact N-OD2 3.15Å; S339-D342 PolarHBondContact O-N 2.75Å; S339-D342 PolarHBondContact OG-N 3.26Å; S339-D342 VanDerWaalsContact OG-N 3.07Å; S339-D342 PolarHBondContact OG-OD2 2.78Å
343	L	92.9	Very high	90	Very high	17 Å²	17	60.6 Å²	60.6	9%	0.089	32%	0.318	C	S	.	.	S	Bend	trans	-79.8	123.3	179.2	-74.9	172.7	0	0	0	111.2	I338 L340 E341 P345 I363 V366 L367 Y378	I338-L343 HydrophobicContact CG2-CD2 3.72Å; I338-L343 HydrophobicContact CG2-CG 3.94Å; L340-L343 HydrophobicContact CD1-CD1 3.88Å; L340-L343 WeakPolarHBondContact O-CB 3.38Å; L340-L343 PolarHBondContact O-N 2.86Å; E341-L343 PolarHBondContact O-N 3.2Å; L343-P345 WeakPolarHBondContact O-CD 3.32Å; L343-I363 HydrophobicContact CD1-CG1 4.18Å; L343-I363 HydrophobicContact CD1-CG2 4.11Å; L343-V366 HydrophobicContact CD2-CB 4Å; L343-V366 HydrophobicContact CD2-CG1 3.49Å; L343-V366 VanDerWaalsContact CD2-CG1 3.49Å; L343-L367 HydrophobicContact CD1-CD2 4.02Å; L343-L367 HydrophobicContact CD1-CG 4.35Å; L343-L367 HydrophobicContact CG-CD2 4.31Å; L343-Y378 HydrophobicContact CD2-CE2 4.18Å
344	S	93.8	Very high	90.8	Very high	19 Å²	19	62 Å²	62	13%	0.133	32%	0.316	C	S	.	.			trans	-69.9	109.1	174.7	179.3	0	0	0	0	111.1	S346 V347 V348 Y378 N382	S344-S346 VanDerWaalsContact C-N 3.33Å; S344-S346 PolarHBondContact O-N 3.11Å; S344-V347 PolarHBondContact O-N 3.3Å; S344-V347 WeakPolarHBondContact OG-CG2 3.41Å; S344-V348 PolarHBondContact O-N 3.1Å; S344-V348 VanDerWaalsContact O-N 3.13Å; S344-Y378 PolarHBondContact N-OH 3.09Å; S344-N382 WeakPolarHBondContact CB-OD1 3.49Å; S344-N382 PolarHBondContact OG-OD1 3.29Å
345	P	93.2	Very high	91.3	Very high	105 Å²	105	61.6 Å²	61.6	68%	0.682	32%	0.318	S	S	*	.	H	α-helix	trans	-67.4	-34.9	-170.4	-21.8	35.3	0	0	0	112.2	L343 V348 L349	L343-P345 WeakPolarHBondContact O-CD 3.32Å; P345-V348 PolarHBondContact O-N 3.37Å; P345-L349 VanDerWaalsContact O-CB 3.24Å; P345-L349 WeakPolarHBondContact O-CB 3.4Å; P345-L349 PolarHBondContact O-N 2.8Å
346	S	93.1	Very high	91.8	Very high	27 Å²	27	61.4 Å²	61.4	19%	0.189	33%	0.328	C	S	.	.	H	α-helix	trans	-68.8	-33.9	178.5	58.7	0	0	0	0	112.7	S35 S344 H350	S35-S346 WeakPolarHBondContact O-CB 3.47Å; S344-S346 VanDerWaalsContact C-N 3.33Å; S344-S346 PolarHBondContact O-N 3.11Å; S346-H350 WeakPolarHBondContact O-CB 3.35Å; S346-H350 PolarHBondContact O-N 2.97Å
347	V	95.4	Very high	92.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68.2	-45.9	172.1	177.6	0	0	0	0	110.6	L37 S344 H350 M351 Y378 L381 N382 L385	L37-V347 HydrophobicContact CD1-CG2 4.31Å; L37-V347 HydrophobicContact CD2-CG2 3.84Å; S344-V347 PolarHBondContact O-N 3.3Å; S344-V347 WeakPolarHBondContact OG-CG2 3.41Å; V347-H350 PolarHBondContact O-N 3.4Å; V347-M351 HydrophobicContact CG1-SD 4.16Å; V347-M351 WeakPolarHBondContact O-CG 3.32Å; V347-M351 PolarHBondContact O-N 2.97Å; V347-Y378 HydrophobicContact CB-CD2 4.31Å; V347-Y378 HydrophobicContact CB-CE2 4.13Å; V347-Y378 HydrophobicContact CG1-CD2 3.56Å; V347-Y378 HydrophobicContact CG1-CE2 3.88Å; V347-Y378 HydrophobicContact CG1-CG 4.33Å; V347-L381 HydrophobicContact CG1-CB 3.81Å; V347-L381 HydrophobicContact CG1-CD1 4.27Å; V347-L381 HydrophobicContact CG2-CB 4.35Å; V347-N382 HydrophobicContact CG2-CB 4.31Å; V347-L385 HydrophobicContact CG2-CD2 4.15Å
348	V	95.3	Very high	92.7	Very high	10 Å²	10	60.6 Å²	60.6	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-60.4	-49.2	176.8	177.1	0	0	0	0	110.6	S344 P345 H350 M351 T352 V362 I363 Y378	S344-V348 PolarHBondContact O-N 3.1Å; S344-V348 VanDerWaalsContact O-N 3.13Å; P345-V348 PolarHBondContact O-N 3.37Å; V348-H350 VanDerWaalsContact C-N 3.34Å; V348-H350 PolarHBondContact O-N 3.38Å; V348-M351 PolarHBondContact O-N 3.22Å; V348-M351 VanDerWaalsContact O-N 3.12Å; V348-T352 HydrophobicContact CG1-CG2 4.43Å; V348-T352 WeakPolarHBondContact O-CG2 3.44Å; V348-T352 PolarHBondContact O-N 2.67Å; V348-T352 PolarHBondContact O-OG1 2.69Å; V348-V362 HydrophobicContact CG1-CG1 4.37Å; V348-V362 HydrophobicContact CG2-CG1 4.27Å; V348-I363 HydrophobicContact CG1-CG1 4.38Å; V348-Y378 HydrophobicContact CG2-CD2 4.46Å; V348-Y378 HydrophobicContact CG2-CE2 4.08Å
349	L	94.4	Very high	93.2	Very high	46 Å²	46	64.2 Å²	64.2	24%	0.241	35%	0.345	C	S	.	.	H	α-helix	trans	-57.4	-43.7	178.4	-173.5	69.5	0	0	0	112.2	F36 P345 T352 E353	F36-L349 HydrophobicContact CD1-CD2 4.39Å; F36-L349 HydrophobicContact CE1-CD2 4.37Å; F36-L349 HydrophobicContact CE1-CG 4.38Å; P345-L349 VanDerWaalsContact O-CB 3.24Å; P345-L349 WeakPolarHBondContact O-CB 3.4Å; P345-L349 PolarHBondContact O-N 2.8Å; L349-T352 WeakPolarHBondContact CA-OG1 3.37Å; L349-T352 PolarHBondContact O-N 2.92Å; L349-T352 PolarHBondContact O-OG1 3.46Å; L349-E353 HydrophobicContact CD1-CG 4.06Å; L349-E353 WeakPolarHBondContact CD1-OE1 3.27Å; L349-E353 WeakPolarHBondContact O-CB 3.33Å; L349-E353 PolarHBondContact O-N 2.81Å
350	H	93.9	Very high	93.6	Very high	15 Å²	15	64.9 Å²	64.9	7%	0.069	35%	0.35	C	S	.	.	H	α-helix	trans	-64.6	-42.9	175.5	178.5	83.7	0	0	0	112.2	L37 S42 S346 V347 V348 T352 K354 L355	L37-H350 HydrophobicContact CB-CB 4.26Å; L37-H350 HydrophobicContact CD1-CB 3.65Å; L37-H350 HydrophobicContact CG-CB 3.73Å; S42-H350 WeakPolarHBondContact CB-CE1 3.32Å; S346-H350 WeakPolarHBondContact O-CB 3.35Å; S346-H350 PolarHBondContact O-N 2.97Å; V347-H350 PolarHBondContact O-N 3.4Å; V348-H350 VanDerWaalsContact C-N 3.34Å; V348-H350 PolarHBondContact O-N 3.38Å; H350-T352 VanDerWaalsContact C-N 3.28Å; H350-T352 PolarHBondContact O-N 2.92Å; H350-K354 WeakPolarHBondContact O-CA 3.46Å; H350-K354 WeakPolarHBondContact O-CB 3.11Å; H350-K354 PolarHBondContact O-N 3.41Å; H350-L355 PolarHBondContact O-N 2.73Å
351	M	95.4	Very high	93.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-35.1	176.2	-71.8	-179.2	67.5	0	0	112.3	V347 V348 L355 G356 Y357 V362 I374 I377 Y378 L381	V347-M351 HydrophobicContact CG1-SD 4.16Å; V347-M351 WeakPolarHBondContact O-CG 3.32Å; V347-M351 PolarHBondContact O-N 2.97Å; V348-M351 PolarHBondContact O-N 3.22Å; V348-M351 VanDerWaalsContact O-N 3.12Å; M351-L355 HydrophobicContact CG-CD1 4.31Å; M351-L355 CarbonylContact O-C 3.6Å; M351-L355 WeakPolarHBondContact O-CB 3.3Å; M351-G356 PolarHBondContact O-N 3.35Å; M351-Y357 HydrophobicContact CB-CD2 4.44Å; M351-Y357 HydrophobicContact CE-CD2 4.39Å; M351-Y357 WeakPolarHBondContact O-CD2 3.42Å; M351-Y357 PolarHBondContact O-N 3.41Å; M351-Y357 VanDerWaalsContact O-N 3.07Å; M351-V362 HydrophobicContact CB-CG2 4.14Å; M351-V362 HydrophobicContact CE-CG1 3.93Å; M351-V362 HydrophobicContact CE-CG2 3.98Å; M351-V362 HydrophobicContact SD-CG1 3.91Å; M351-I374 HydrophobicContact CE-CG2 3.8Å; M351-I377 HydrophobicContact CE-CB 3.86Å; M351-I377 HydrophobicContact CE-CG2 3.69Å; M351-I377 HydrophobicContact CG-CG2 3.89Å; M351-I377 HydrophobicContact SD-CB 4.44Å; M351-I377 HydrophobicContact SD-CG2 3.85Å; M351-Y378 HydrophobicContact SD-CD2 4.2Å; M351-L381 HydrophobicContact CG-CD1 4.08Å
352	T	95.3	Very high	94.3	Very high	26 Å²	26	53.6 Å²	53.6	16%	0.16	30%	0.296	C	S	.	.	H	α-helix	trans	-78.7	-47.3	179	54.3	0	0	0	0	112.8	V348 L349 H350 G356 Y357 N359 V362	V348-T352 HydrophobicContact CG1-CG2 4.43Å; V348-T352 WeakPolarHBondContact O-CG2 3.44Å; V348-T352 PolarHBondContact O-N 2.67Å; V348-T352 PolarHBondContact O-OG1 2.69Å; L349-T352 WeakPolarHBondContact CA-OG1 3.37Å; L349-T352 PolarHBondContact O-N 2.92Å; L349-T352 PolarHBondContact O-OG1 3.46Å; H350-T352 VanDerWaalsContact C-N 3.28Å; H350-T352 PolarHBondContact O-N 2.92Å; T352-G356 WeakPolarHBondContact O-CA 3.28Å; T352-G356 PolarHBondContact O-N 2.77Å; T352-Y357 VanDerWaalsContact CA-O 3.31Å; T352-Y357 WeakPolarHBondContact CA-O 2.88Å; T352-Y357 WeakPolarHBondContact CG2-O 3.29Å; T352-N359 VanDerWaalsContact CG2-CA 3.47Å; T352-N359 HydrophobicContact CG2-CB 3.72Å; T352-V362 HydrophobicContact CG2-CG2 4.48Å
353	E	93.3	Very high	94.6	Very high	114 Å²	114	51 Å²	51	53%	0.533	28%	0.282	S	S	.	.	H	α-helix	trans	-94.3	-23.9	-169.4	-61.6	-168.7	169.2	0	0	114.9	F36 L349	F36-E353 HydrophobicContact CE1-CB 4.31Å; F36-E353 WeakPolarHBondContact CE1-OE2 3.11Å; F36-E353 WeakPolarHBondContact CZ-OE2 3.47Å; L349-E353 HydrophobicContact CD1-CG 4.06Å; L349-E353 WeakPolarHBondContact CD1-OE1 3.27Å; L349-E353 WeakPolarHBondContact O-CB 3.33Å; L349-E353 PolarHBondContact O-N 2.81Å
354	K	91.4	Very high	94.7	Very high	122 Å²	122	55 Å²	55	53%	0.53	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-28.5	179	-54.2	-52.9	-177.4	-155.4	0	113.1	F36 H350	F36-K354 HydrophobicContact CE1-CD 4.46Å; F36-K354 VanDerWaalsContact CE1-CE 3.43Å; H350-K354 WeakPolarHBondContact O-CA 3.46Å; H350-K354 WeakPolarHBondContact O-CB 3.11Å; H350-K354 PolarHBondContact O-N 3.41Å
355	L	92.6	Very high	94.7	Very high	60 Å²	60	54.8 Å²	54.8	31%	0.314	30%	0.301	S	S	.	.	S	Bend	trans	-105.1	-6.3	176.9	-52.4	-179.2	0	0	0	113.8	H350 M351 Y357 I377 L381	H350-L355 PolarHBondContact O-N 2.73Å; M351-L355 HydrophobicContact CG-CD1 4.31Å; M351-L355 CarbonylContact O-C 3.6Å; M351-L355 WeakPolarHBondContact O-CB 3.3Å; L355-Y357 HydrophobicContact CB-CD2 3.75Å; L355-Y357 HydrophobicContact CB-CE2 3.74Å; L355-Y357 HydrophobicContact CD1-CE2 4.37Å; L355-Y357 PolarHBondContact O-N 2.72Å; L355-I377 HydrophobicContact CD1-CG2 3.78Å; L355-L381 HydrophobicContact CD1-CD1 4.46Å
356	G	94.3	Very high	94.8	Very high	65 Å²	65	49.8 Å²	49.8	67%	0.67	27%	0.269	S	S	*	.			trans	75.2	15	171.2	0	0	0	0	0	116	M351 T352	M351-G356 PolarHBondContact O-N 3.35Å; T352-G356 WeakPolarHBondContact O-CA 3.28Å; T352-G356 PolarHBondContact O-N 2.77Å
357	Y	95.8	Very high	94.8	Very high	52 Å²	52	50.5 Å²	50.5	20%	0.204	27%	0.27	C	S	.	.			trans	-74.1	147.5	175.4	-67.7	-78.8	0	0	0	111	M351 T352 L355 N359 V362 H373 I374 I377	M351-Y357 HydrophobicContact CB-CD2 4.44Å; M351-Y357 HydrophobicContact CE-CD2 4.39Å; M351-Y357 WeakPolarHBondContact O-CD2 3.42Å; M351-Y357 PolarHBondContact O-N 3.41Å; M351-Y357 VanDerWaalsContact O-N 3.07Å; T352-Y357 VanDerWaalsContact CA-O 3.31Å; T352-Y357 WeakPolarHBondContact CA-O 2.88Å; T352-Y357 WeakPolarHBondContact CG2-O 3.29Å; L355-Y357 HydrophobicContact CB-CD2 3.75Å; L355-Y357 HydrophobicContact CB-CE2 3.74Å; L355-Y357 HydrophobicContact CD1-CE2 4.37Å; L355-Y357 PolarHBondContact O-N 2.72Å; Y357-N359 PolarHBondContact O-N 2.6Å; Y357-V362 HydrophobicContact CG-CG2 4.46Å; Y357-H373 AromaticContact CE1-NE2 3.79Å; Y357-I374 HydrophobicContact CD1-CD1 4.03Å; Y357-I374 HydrophobicContact CD1-CG1 3.98Å; Y357-I374 HydrophobicContact CE1-CD1 4.31Å; Y357-I374 HydrophobicContact CE1-CG1 3.88Å; Y357-I377 HydrophobicContact CE2-CD1 3.71Å; Y357-I377 WeakPolarHBondContact OH-CD1 3.22Å
358	K	96.6	Very high	94.7	Very high	144 Å²	144	52.8 Å²	52.8	63%	0.626	29%	0.286	S	S	*	.			trans	-69.2	135.2	171.5	-60.8	-179.1	-174.4	171.8	0	109.5	S360 D361 V362	K358-S360 VanDerWaalsContact C-N 3.27Å; K358-S360 PolarHBondContact O-N 3.47Å; K358-D361 HydrophobicContact CB-CB 4.19Å; K358-D361 PolarHBondContact O-N 3.43Å; K358-V362 PolarHBondContact O-N 2.9Å; K358-V362 VanDerWaalsContact O-N 3.14Å
359	N	95.8	Very high	94.6	Very high	86 Å²	86	52.5 Å²	52.5	46%	0.46	28%	0.284	S	S	.	.	H	α-helix	trans	-54.1	-44.1	179.4	-173.1	-73.3	0	0	0	112	T352 Y357 D361 V362 I363	T352-N359 VanDerWaalsContact CG2-CA 3.47Å; T352-N359 HydrophobicContact CG2-CB 3.72Å; Y357-N359 PolarHBondContact O-N 2.6Å; N359-D361 VanDerWaalsContact C-N 3.26Å; N359-D361 PolarHBondContact O-N 2.89Å; N359-V362 PolarHBondContact O-N 3.42Å; N359-I363 WeakPolarHBondContact O-CG1 3.46Å; N359-I363 PolarHBondContact O-N 3.04Å; N359-I363 WeakPolarHBondContact OD1-CD1 3.23Å
360	S	96.1	Very high	94.6	Very high	58 Å²	58	57.7 Å²	57.7	41%	0.406	30%	0.301	S	S	.	.	H	α-helix	trans	-51.1	-42.6	172.2	53.2	0	0	0	0	113.5	K358 N364	K358-S360 VanDerWaalsContact C-N 3.27Å; K358-S360 PolarHBondContact O-N 3.47Å; S360-N364 WeakPolarHBondContact O-CB 3.26Å; S360-N364 PolarHBondContact O-N 3.25Å; S360-N364 PolarHBondContact O-ND2 2.76Å
361	D	95.9	Very high	94.7	Very high	67 Å²	67	57.4 Å²	57.4	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-81.4	-32.8	-169	-58.1	5.5	0	0	0	110	K358 N359 T365 I374	K358-D361 HydrophobicContact CB-CB 4.19Å; K358-D361 PolarHBondContact O-N 3.43Å; N359-D361 VanDerWaalsContact C-N 3.26Å; N359-D361 PolarHBondContact O-N 2.89Å; D361-T365 WeakPolarHBondContact O-CB 3.36Å; D361-T365 PolarHBondContact O-N 2.65Å; D361-T365 PolarHBondContact O-OG1 2.86Å; D361-I374 HydrophobicContact CB-CD1 4.38Å
362	V	95.9	Very high	94.7	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.8	-58.5	168.8	-176.5	0	0	0	0	110.1	V348 M351 T352 Y357 K358 N359 N364 T365 V366 I374	V348-V362 HydrophobicContact CG1-CG1 4.37Å; V348-V362 HydrophobicContact CG2-CG1 4.27Å; M351-V362 HydrophobicContact CB-CG2 4.14Å; M351-V362 HydrophobicContact CE-CG1 3.93Å; M351-V362 HydrophobicContact CE-CG2 3.98Å; M351-V362 HydrophobicContact SD-CG1 3.91Å; T352-V362 HydrophobicContact CG2-CG2 4.48Å; Y357-V362 HydrophobicContact CG-CG2 4.46Å; K358-V362 PolarHBondContact O-N 2.9Å; K358-V362 VanDerWaalsContact O-N 3.14Å; N359-V362 PolarHBondContact O-N 3.42Å; V362-N364 PolarHBondContact O-N 3.46Å; V362-T365 PolarHBondContact O-N 2.67Å; V362-V366 HydrophobicContact CG1-CG2 4.47Å; V362-V366 VanDerWaalsContact O-CG2 3.31Å; V362-V366 WeakPolarHBondContact O-CG2 3.05Å; V362-V366 PolarHBondContact O-N 3.27Å; V362-I374 HydrophobicContact CB-CG2 4.45Å; V362-I374 HydrophobicContact CG2-CG2 4.28Å
363	I	95.4	Very high	94.8	Very high	37 Å²	37	60.9 Å²	60.9	19%	0.19	32%	0.317	C	S	.	.	H	α-helix	trans	-59.5	-52	-176.3	-67.3	-175.9	0	0	0	110.9	L340 L343 V348 N359 T365 V366 L367	L340-I363 HydrophobicContact CD1-CG2 4.08Å; L343-I363 HydrophobicContact CD1-CG1 4.18Å; L343-I363 HydrophobicContact CD1-CG2 4.11Å; V348-I363 HydrophobicContact CG1-CG1 4.38Å; N359-I363 WeakPolarHBondContact O-CG1 3.46Å; N359-I363 PolarHBondContact O-N 3.04Å; N359-I363 WeakPolarHBondContact OD1-CD1 3.23Å; I363-T365 VanDerWaalsContact C-N 3.29Å; I363-T365 PolarHBondContact O-N 3.47Å; I363-V366 PolarHBondContact O-N 3.48Å; I363-L367 HydrophobicContact CG2-CD1 3.5Å; I363-L367 HydrophobicContact CG2-CG 4Å; I363-L367 WeakPolarHBondContact O-CB 3.39Å; I363-L367 VanDerWaalsContact O-CG 3.29Å; I363-L367 WeakPolarHBondContact O-CG 3.23Å; I363-L367 PolarHBondContact O-N 3.46Å
364	N	95.2	Very high	95	Very high	103 Å²	103	56.2 Å²	56.2	55%	0.551	30%	0.296	S	S	*	.	H	α-helix	trans	-62.4	-34.3	-178.8	-72	-37.9	0	0	0	112.8	S360 V362 S368	S360-N364 WeakPolarHBondContact O-CB 3.26Å; S360-N364 PolarHBondContact O-N 3.25Å; S360-N364 PolarHBondContact O-ND2 2.76Å; V362-N364 PolarHBondContact O-N 3.46Å; N364-S368 VanDerWaalsContact O-CB 3.24Å; N364-S368 WeakPolarHBondContact O-CB 3.44Å; N364-S368 PolarHBondContact O-N 3.18Å; N364-S368 PolarHBondContact O-OG 3.43Å
365	T	94.9	Very high	95.3	Very high	13 Å²	13	50.4 Å²	50.4	8%	0.08	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-47.2	176	-64.2	0	0	0	0	111.5	D361 V362 I363 S368 N369 R370 C372 I374 L375	D361-T365 WeakPolarHBondContact O-CB 3.36Å; D361-T365 PolarHBondContact O-N 2.65Å; D361-T365 PolarHBondContact O-OG1 2.86Å; V362-T365 PolarHBondContact O-N 2.67Å; I363-T365 VanDerWaalsContact C-N 3.29Å; I363-T365 PolarHBondContact O-N 3.47Å; T365-S368 PolarHBondContact O-N 3.02Å; T365-S368 PolarHBondContact O-OG 3.06Å; T365-S368 VanDerWaalsContact O-OG 3.1Å; T365-N369 PolarHBondContact O-N 3.41Å; T365-R370 HydrophobicContact CG2-CB 4.41Å; T365-R370 WeakPolarHBondContact CG2-O 3.04Å; T365-R370 PolarHBondContact O-N 3.26Å; T365-C372 VanDerWaalsContact CG2-SG 3.53Å; T365-I374 HydrophobicContact CG2-CB 4.08Å; T365-I374 HydrophobicContact CG2-CG2 4.14Å; T365-L375 HydrophobicContact CG2-CB 3.87Å; T365-L375 HydrophobicContact CG2-CD1 4.24Å
366	V	94.5	Very high	95.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.9	-45.6	-175.9	179.2	0	0	0	0	111.1	I338 L343 V362 I363 S368 N369 L375 Y378	I338-V366 HydrophobicContact CB-CG1 4.2Å; I338-V366 HydrophobicContact CD1-CG1 3.47Å; I338-V366 VanDerWaalsContact CD1-CG1 3.47Å; I338-V366 HydrophobicContact CG1-CG1 4.4Å; I338-V366 HydrophobicContact CG2-CG1 4.06Å; L343-V366 HydrophobicContact CD2-CB 4Å; L343-V366 HydrophobicContact CD2-CG1 3.49Å; L343-V366 VanDerWaalsContact CD2-CG1 3.49Å; V362-V366 HydrophobicContact CG1-CG2 4.47Å; V362-V366 VanDerWaalsContact O-CG2 3.31Å; V362-V366 WeakPolarHBondContact O-CG2 3.05Å; V362-V366 PolarHBondContact O-N 3.27Å; I363-V366 PolarHBondContact O-N 3.48Å; V366-S368 VanDerWaalsContact C-N 3.25Å; V366-S368 PolarHBondContact O-N 3.28Å; V366-N369 PolarHBondContact O-N 3.13Å; V366-N369 VanDerWaalsContact O-N 3.15Å; V366-L375 HydrophobicContact CB-CD1 4.42Å; V366-L375 HydrophobicContact CG2-CD1 4.25Å; V366-Y378 HydrophobicContact CB-CD1 4.43Å; V366-Y378 HydrophobicContact CG1-CD1 3.67Å; V366-Y378 HydrophobicContact CG1-CE1 3.62Å; V366-Y378 HydrophobicContact CG1-CG 4.2Å; V366-Y378 HydrophobicContact CG2-CD1 3.77Å; V366-Y378 HydrophobicContact CG2-CD2 3.97Å; V366-Y378 HydrophobicContact CG2-CE1 4.45Å; V366-Y378 HydrophobicContact CG2-CG 3.52Å
367	L	93.9	Very high	95.7	Very high	43 Å²	43	44.5 Å²	44.5	23%	0.225	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-29.2	175.2	-64.4	-178.1	0	0	0	112.7	R337 I338 L340 L343 I363	R337-L367 VanDerWaalsContact CB-O 3.29Å; R337-L367 WeakPolarHBondContact CB-O 3.46Å; R337-L367 WeakPolarHBondContact CD-O 3.3Å; R337-L367 WeakPolarHBondContact CG-O 3.31Å; I338-L367 HydrophobicContact CG2-CD2 4.21Å; I338-L367 WeakPolarHBondContact O-CD2 3.27Å; L340-L367 HydrophobicContact CD1-CD1 4.02Å; L343-L367 HydrophobicContact CD1-CD2 4.02Å; L343-L367 HydrophobicContact CD1-CG 4.35Å; L343-L367 HydrophobicContact CG-CD2 4.31Å; I363-L367 HydrophobicContact CG2-CD1 3.5Å; I363-L367 HydrophobicContact CG2-CG 4Å; I363-L367 WeakPolarHBondContact O-CB 3.39Å; I363-L367 VanDerWaalsContact O-CG 3.29Å; I363-L367 WeakPolarHBondContact O-CG 3.23Å; I363-L367 PolarHBondContact O-N 3.46Å
368	S	92.4	Very high	95.7	Very high	48 Å²	48	42.1 Å²	42.1	34%	0.336	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.6	177	61.9	0	0	0	0	114.8	N364 T365 V366 R370	N364-S368 VanDerWaalsContact O-CB 3.24Å; N364-S368 WeakPolarHBondContact O-CB 3.44Å; N364-S368 PolarHBondContact O-N 3.18Å; N364-S368 PolarHBondContact O-OG 3.43Å; T365-S368 PolarHBondContact O-N 3.02Å; T365-S368 PolarHBondContact O-OG 3.06Å; T365-S368 VanDerWaalsContact O-OG 3.1Å; V366-S368 VanDerWaalsContact C-N 3.25Å; V366-S368 PolarHBondContact O-N 3.28Å; S368-R370 PolarHBondContact O-N 3.04Å; S368-R370 WeakPolarHBondContact OG-CB 3.26Å
369	N	93.8	Very high	95.7	Very high	3 Å²	3	37 Å²	37	2%	0.016	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	33.1	-170.5	-161	50	0	0	0	112.8	Q116 I118 Q125 T365 V366 A371	Q116-N369 VanDerWaalsContact CG-O 3.3Å; Q116-N369 WeakPolarHBondContact CG-O 3.18Å; Q116-N369 PolarHBondContact O-ND2 3.05Å; I118-N369 PolarHBondContact O-ND2 3.35Å; Q125-N369 PolarHBondContact NE2-OD1 2.96Å; T365-N369 PolarHBondContact O-N 3.41Å; V366-N369 PolarHBondContact O-N 3.13Å; V366-N369 VanDerWaalsContact O-N 3.15Å; N369-A371 PolarHBondContact O-N 3.34Å; N369-A371 VanDerWaalsContact O-N 3.16Å
370	R	93.5	Very high	95.8	Very high	155 Å²	155	33.4 Å²	33.4	59%	0.585	17%	0.173	S	C	*	.			trans	-79.6	101.3	-174.5	-178.2	-176.5	178.2	-171.8	0.2	110.9	T365 S368 C372 L375	T365-R370 HydrophobicContact CG2-CB 4.41Å; T365-R370 WeakPolarHBondContact CG2-O 3.04Å; T365-R370 PolarHBondContact O-N 3.26Å; S368-R370 PolarHBondContact O-N 3.04Å; S368-R370 WeakPolarHBondContact OG-CB 3.26Å; R370-C372 PolarHBondContact O-N 3.09Å; R370-L375 WeakPolarHBondContact O-CB 3.38Å
371	A	96.1	Very high	95.7	Very high	10 Å²	10	30.7 Å²	30.7	8%	0.083	15%	0.154	C	C	.	.			trans	-53.2	109.6	177.8	0	0	0	0	0	111.8	Q116 L126 I129 N369	Q116-A371 HydrophobicContact CG-CB 4.03Å; L126-A371 HydrophobicContact CD2-CB 3.82Å; L126-A371 HydrophobicContact CG-CB 3.94Å; I129-A371 HydrophobicContact CD1-CB 4.09Å; I129-A371 HydrophobicContact CG1-CB 3.92Å; N369-A371 PolarHBondContact O-N 3.34Å; N369-A371 VanDerWaalsContact O-N 3.16Å
372	C	96.9	Very high	95.7	Very high	22 Å²	22	28.8 Å²	28.8	15%	0.149	14%	0.144	C	C	.	.	S	Bend	trans	-166	170.7	178.3	80.9	0	0	0	0	109.5	L127 D128 T365 R370 I374 L375 A376	L127-C372 PolarHBondContact O-N 2.89Å; L127-C372 VanDerWaalsContact O-N 3.11Å; L127-C372 VanDerWaalsContact O-O 3.07Å; D128-C372 VanDerWaalsContact CG-C 3.45Å; D128-C372 VanDerWaalsContact OD1-C 3.32Å; D128-C372 WeakPolarHBondContact OD1-CA 3.12Å; T365-C372 VanDerWaalsContact CG2-SG 3.53Å; R370-C372 PolarHBondContact O-N 3.09Å; C372-I374 PolarHBondContact O-N 3.04Å; C372-I374 VanDerWaalsContact O-N 3.1Å; C372-I374 PolarHBondContact SG-N 3.4Å; C372-I374 VanDerWaalsContact SG-N 3.44Å; C372-L375 WeakPolarHBondContact O-CB 3.25Å; C372-L375 PolarHBondContact O-N 3.25Å; C372-A376 PolarHBondContact O-N 3.07Å
373	H	96.7	Very high	95.5	Very high	76 Å²	76	31.1 Å²	31.1	35%	0.352	15%	0.154	S	C	.	.	H	α-helix	trans	-51	-35.5	178.5	68.8	-83.6	0	0	0	115.1	D128 Y357 A376 I377	D128-H373 VanDerWaalsContact CG-N 3.32Å; D128-H373 PolarHBondContact OD1-N 2.93Å; D128-H373 WeakPolarHBondContact OD2-CA 3.23Å; D128-H373 PolarHBondContact OD2-N 3.38Å; Y357-H373 AromaticContact CE1-NE2 3.79Å; H373-A376 PolarHBondContact O-N 3.24Å; H373-I377 VanDerWaalsContact O-CD1 3.3Å; H373-I377 WeakPolarHBondContact O-CD1 3.47Å; H373-I377 WeakPolarHBondContact O-CG1 3.48Å; H373-I377 PolarHBondContact O-N 3.5Å
374	I	97.3	Very high	95.3	Very high	17 Å²	17	30.3 Å²	30.3	9%	0.087	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-46.5	176.6	-60.1	178.6	0	0	0	110.6	M351 Y357 D361 V362 T365 C372 A376 I377 Y378	M351-I374 HydrophobicContact CE-CG2 3.8Å; Y357-I374 HydrophobicContact CD1-CD1 4.03Å; Y357-I374 HydrophobicContact CD1-CG1 3.98Å; Y357-I374 HydrophobicContact CE1-CD1 4.31Å; Y357-I374 HydrophobicContact CE1-CG1 3.88Å; D361-I374 HydrophobicContact CB-CD1 4.38Å; V362-I374 HydrophobicContact CB-CG2 4.45Å; V362-I374 HydrophobicContact CG2-CG2 4.28Å; T365-I374 HydrophobicContact CG2-CB 4.08Å; T365-I374 HydrophobicContact CG2-CG2 4.14Å; C372-I374 PolarHBondContact O-N 3.04Å; C372-I374 VanDerWaalsContact O-N 3.1Å; C372-I374 PolarHBondContact SG-N 3.4Å; C372-I374 VanDerWaalsContact SG-N 3.44Å; I374-A376 VanDerWaalsContact C-N 3.29Å; I374-A376 PolarHBondContact O-N 2.85Å; I374-I377 PolarHBondContact O-N 3.21Å; I374-Y378 PolarHBondContact O-N 2.89Å
375	L	97.2	Very high	95.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-42.6	176.7	-166.1	76.5	0	0	0	111	T365 V366 R370 C372 Y378 F379	T365-L375 HydrophobicContact CG2-CB 3.87Å; T365-L375 HydrophobicContact CG2-CD1 4.24Å; V366-L375 HydrophobicContact CB-CD1 4.42Å; V366-L375 HydrophobicContact CG2-CD1 4.25Å; R370-L375 WeakPolarHBondContact O-CB 3.38Å; C372-L375 WeakPolarHBondContact O-CB 3.25Å; C372-L375 PolarHBondContact O-N 3.25Å; L375-Y378 PolarHBondContact O-N 2.85Å; L375-F379 HydrophobicContact CD1-CD2 4.18Å; L375-F379 HydrophobicContact CD1-CE2 3.84Å; L375-F379 HydrophobicContact CD2-CD2 4.44Å; L375-F379 HydrophobicContact CD2-CE2 4.2Å; L375-F379 HydrophobicContact CG-CD2 3.86Å; L375-F379 HydrophobicContact CG-CE2 3.88Å; L375-F379 WeakPolarHBondContact O-CD2 3.33Å; L375-F379 PolarHBondContact O-N 3.24Å
376	A	97.8	Very high	95	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64	-44.5	177.8	0	0	0	0	0	112.9	Y61 L127 D128 C372 H373 I374 Y378 L380	Y61-A376 WeakPolarHBondContact OH-CB 3.09Å; L127-A376 HydrophobicContact CB-CB 3.86Å; D128-A376 HydrophobicContact CB-CB 4.22Å; C372-A376 PolarHBondContact O-N 3.07Å; H373-A376 PolarHBondContact O-N 3.24Å; I374-A376 VanDerWaalsContact C-N 3.29Å; I374-A376 PolarHBondContact O-N 2.85Å; A376-Y378 PolarHBondContact O-N 3.43Å; A376-L380 VanDerWaalsContact O-CB 3.25Å; A376-L380 WeakPolarHBondContact O-CB 3.29Å; A376-L380 WeakPolarHBondContact O-CD1 3.34Å; A376-L380 WeakPolarHBondContact O-CG 3.11Å; A376-L380 PolarHBondContact O-N 3.17Å
377	I	97.3	Very high	94.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.7	-48.8	175.4	-67.5	155.6	0	0	0	110	L83 T84 M351 L355 Y357 H373 I374 L380 L381	L83-I377 HydrophobicContact CD1-CD1 3.92Å; L83-I377 HydrophobicContact CD1-CG1 4.31Å; T84-I377 HydrophobicContact CG2-CG2 4.47Å; M351-I377 HydrophobicContact CE-CB 3.86Å; M351-I377 HydrophobicContact CE-CG2 3.69Å; M351-I377 HydrophobicContact CG-CG2 3.89Å; M351-I377 HydrophobicContact SD-CB 4.44Å; M351-I377 HydrophobicContact SD-CG2 3.85Å; L355-I377 HydrophobicContact CD1-CG2 3.78Å; Y357-I377 HydrophobicContact CE2-CD1 3.71Å; Y357-I377 WeakPolarHBondContact OH-CD1 3.22Å; H373-I377 VanDerWaalsContact O-CD1 3.3Å; H373-I377 WeakPolarHBondContact O-CD1 3.47Å; H373-I377 WeakPolarHBondContact O-CG1 3.48Å; H373-I377 PolarHBondContact O-N 3.5Å; I374-I377 PolarHBondContact O-N 3.21Å; I377-L380 PolarHBondContact O-N 2.99Å; I377-L381 HydrophobicContact CG2-CD1 3.77Å; I377-L381 HydrophobicContact CG2-CG 4.34Å; I377-L381 WeakPolarHBondContact O-CB 3.24Å; I377-L381 WeakPolarHBondContact O-CG 3.34Å; I377-L381 PolarHBondContact O-N 2.92Å
378	Y	97.1	Very high	94.4	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-57.4	-57.3	-179.5	177	-93	0	0	0	112	I338 L343 S344 V347 V348 M351 V366 I374 L375 A376 L380 L381 N382	I338-Y378 HydrophobicContact CD1-CE1 4.1Å; L343-Y378 HydrophobicContact CD2-CE2 4.18Å; S344-Y378 PolarHBondContact N-OH 3.09Å; V347-Y378 HydrophobicContact CB-CD2 4.31Å; V347-Y378 HydrophobicContact CB-CE2 4.13Å; V347-Y378 HydrophobicContact CG1-CD2 3.56Å; V347-Y378 HydrophobicContact CG1-CE2 3.88Å; V347-Y378 HydrophobicContact CG1-CG 4.33Å; V348-Y378 HydrophobicContact CG2-CD2 4.46Å; V348-Y378 HydrophobicContact CG2-CE2 4.08Å; M351-Y378 HydrophobicContact SD-CD2 4.2Å; V366-Y378 HydrophobicContact CB-CD1 4.43Å; V366-Y378 HydrophobicContact CG1-CD1 3.67Å; V366-Y378 HydrophobicContact CG1-CE1 3.62Å; V366-Y378 HydrophobicContact CG1-CG 4.2Å; V366-Y378 HydrophobicContact CG2-CD1 3.77Å; V366-Y378 HydrophobicContact CG2-CD2 3.97Å; V366-Y378 HydrophobicContact CG2-CE1 4.45Å; V366-Y378 HydrophobicContact CG2-CG 3.52Å; I374-Y378 PolarHBondContact O-N 2.89Å; L375-Y378 PolarHBondContact O-N 2.85Å; A376-Y378 PolarHBondContact O-N 3.43Å; Y378-L380 VanDerWaalsContact C-N 3.35Å; Y378-L380 PolarHBondContact O-N 3.36Å; Y378-L381 PolarHBondContact O-N 3.45Å; Y378-N382 WeakPolarHBondContact O-CB 3.43Å; Y378-N382 PolarHBondContact O-N 2.8Å
379	F	96.4	Very high	94.2	Very high	36 Å²	36	37.6 Å²	37.6	16%	0.158	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-37	-177.3	-86.2	-69.8	0	0	0	112.9	Q125 L127 I338 L375 N382 K383	Q125-F379 HydrophobicContact CG-CD2 4.29Å; Q125-F379 HydrophobicContact CG-CE2 4.15Å; Q125-F379 HydrophobicContact CG-CZ 4.31Å; L127-F379 HydrophobicContact CD2-CB 3.67Å; L127-F379 HydrophobicContact CD2-CD2 4.1Å; L127-F379 HydrophobicContact CD2-CG 4.13Å; I338-F379 HydrophobicContact CD1-CE1 3.93Å; I338-F379 HydrophobicContact CD1-CE2 4.32Å; I338-F379 HydrophobicContact CD1-CZ 3.56Å; L375-F379 HydrophobicContact CD1-CD2 4.18Å; L375-F379 HydrophobicContact CD1-CE2 3.84Å; L375-F379 HydrophobicContact CD2-CD2 4.44Å; L375-F379 HydrophobicContact CD2-CE2 4.2Å; L375-F379 HydrophobicContact CG-CD2 3.86Å; L375-F379 HydrophobicContact CG-CE2 3.88Å; L375-F379 WeakPolarHBondContact O-CD2 3.33Å; L375-F379 PolarHBondContact O-N 3.24Å; F379-N382 PolarHBondContact O-N 2.92Å; F379-K383 WeakPolarHBondContact O-CB 3.28Å; F379-K383 PolarHBondContact O-N 3.04Å
380	L	96.6	Very high	93.8	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.052	19%	0.192	C	C	.	.	H	α-helix	trans	-72.2	-35.9	-180	-66.6	169.2	0	0	0	112.1	H81 T84 E86 V88 L127 A376 I377 Y378 K384	H81-L380 HydrophobicContact CB-CD1 3.77Å; T84-L380 HydrophobicContact CG2-CB 4.2Å; E86-L380 HydrophobicContact CB-CB 4.04Å; E86-L380 HydrophobicContact CB-CD1 4.42Å; E86-L380 HydrophobicContact CB-CD2 3.8Å; E86-L380 HydrophobicContact CB-CG 4.3Å; E86-L380 HydrophobicContact CG-CB 4.29Å; V88-L380 HydrophobicContact CG1-CD1 4Å; V88-L380 HydrophobicContact CG1-CD2 3.97Å; L127-L380 HydrophobicContact CD1-CD1 4.43Å; L127-L380 HydrophobicContact CD1-CD2 3.99Å; L127-L380 HydrophobicContact CD1-CG 4.22Å; A376-L380 VanDerWaalsContact O-CB 3.25Å; A376-L380 WeakPolarHBondContact O-CB 3.29Å; A376-L380 WeakPolarHBondContact O-CD1 3.34Å; A376-L380 WeakPolarHBondContact O-CG 3.11Å; A376-L380 PolarHBondContact O-N 3.17Å; I377-L380 PolarHBondContact O-N 2.99Å; Y378-L380 VanDerWaalsContact C-N 3.35Å; Y378-L380 PolarHBondContact O-N 3.36Å; L380-K384 WeakPolarHBondContact O-CB 3.49Å; L380-K384 PolarHBondContact O-N 2.64Å
381	L	95.7	Very high	93	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-42.5	170.2	-72.5	176.9	0	0	0	111.4	L37 T84 V347 M351 L355 I377 Y378 K384 L385	L37-L381 HydrophobicContact CD1-CB 4.29Å; L37-L381 HydrophobicContact CD1-CD1 4.11Å; L37-L381 HydrophobicContact CD1-CD2 4.22Å; L37-L381 HydrophobicContact CD1-CG 4.44Å; T84-L381 HydrophobicContact CG2-CD2 3.77Å; T84-L381 HydrophobicContact CG2-CG 3.74Å; V347-L381 HydrophobicContact CG1-CB 3.81Å; V347-L381 HydrophobicContact CG1-CD1 4.27Å; V347-L381 HydrophobicContact CG2-CB 4.35Å; M351-L381 HydrophobicContact CG-CD1 4.08Å; L355-L381 HydrophobicContact CD1-CD1 4.46Å; I377-L381 HydrophobicContact CG2-CD1 3.77Å; I377-L381 HydrophobicContact CG2-CG 4.34Å; I377-L381 WeakPolarHBondContact O-CB 3.24Å; I377-L381 WeakPolarHBondContact O-CG 3.34Å; I377-L381 PolarHBondContact O-N 2.92Å; Y378-L381 PolarHBondContact O-N 3.45Å; L381-K384 WeakPolarHBondContact O-CB 3.47Å; L381-K384 PolarHBondContact O-N 3.41Å; L381-K384 VanDerWaalsContact O-N 3.16Å; L381-L385 PolarHBondContact O-N 3.31Å
382	N	94.8	Very high	91.5	Very high	26 Å²	26	37.9 Å²	37.9	14%	0.139	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-46.9	179.6	-152.7	66	0	0	0	111.9	S344 V347 Y378 F379 K384 L385 E386	S344-N382 WeakPolarHBondContact CB-OD1 3.49Å; S344-N382 PolarHBondContact OG-OD1 3.29Å; V347-N382 HydrophobicContact CG2-CB 4.31Å; Y378-N382 WeakPolarHBondContact O-CB 3.43Å; Y378-N382 PolarHBondContact O-N 2.8Å; F379-N382 PolarHBondContact O-N 2.92Å; N382-K384 PolarHBondContact O-N 2.95Å; N382-L385 CarbonylContact O-C 3.55Å; N382-L385 WeakPolarHBondContact O-CB 3.45Å; N382-L385 PolarHBondContact O-N 2.83Å; N382-E386 PolarHBondContact ND2-OE1 2.99Å; N382-E386 WeakPolarHBondContact O-CG 3.49Å; N382-E386 PolarHBondContact O-N 2.78Å
383	K	92.3	Very high	89.5	Confident	49 Å²	49	38.4 Å²	38.4	21%	0.213	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-21.5	176	-163.9	170.4	-171	179.4	0	113	E141 E196 F379 E386 R387	E141-K383 IonicContact OE2-NZ 2.81Å; E141-K383 PolarHBondContact OE2-NZ 3.21Å; E196-K383 WeakPolarHBondContact OE1-CE 3.48Å; E196-K383 IonicContact OE1-NZ 3.82Å; F379-K383 WeakPolarHBondContact O-CB 3.28Å; F379-K383 PolarHBondContact O-N 3.04Å; K383-E386 WeakPolarHBondContact CA-OE2 3.29Å; K383-R387 WeakPolarHBondContact O-CG 3.24Å; K383-R387 PolarHBondContact O-N 3.31Å; K383-R387 PolarHBondContact O-NE 3.44Å
384	K	91.8	Very high	87.2	Confident	20 Å²	20	40.3 Å²	40.3	9%	0.087	22%	0.215	C	C	.	.	H	α-helix	trans	-82.3	-35.1	172.2	-168	178.6	177.3	-162.9	0	112	W40 V41 G43 T84 E86 L380 L381 N382 Y388	W40-K384 WeakPolarHBondContact O-CE 3.24Å; W40-K384 PolarHBondContact O-NZ 2.94Å; W40-K384 VanDerWaalsContact O-NZ 3.08Å; V41-K384 HydrophobicContact CG1-CB 4.19Å; V41-K384 HydrophobicContact CG1-CD 4.4Å; V41-K384 HydrophobicContact CG1-CG 4.17Å; V41-K384 WeakPolarHBondContact O-CD 3.46Å; V41-K384 WeakPolarHBondContact O-CE 3.46Å; V41-K384 PolarHBondContact O-NZ 2.86Å; G43-K384 PolarHBondContact O-NZ 3.39Å; T84-K384 PolarHBondContact O-NZ 3Å; T84-K384 VanDerWaalsContact O-NZ 3.17Å; E86-K384 HydrophobicContact CG-CB 4.49Å; E86-K384 HydrophobicContact CG-CD 4.26Å; E86-K384 WeakPolarHBondContact OE1-CD 3.09Å; L380-K384 WeakPolarHBondContact O-CB 3.49Å; L380-K384 PolarHBondContact O-N 2.64Å; L381-K384 WeakPolarHBondContact O-CB 3.47Å; L381-K384 PolarHBondContact O-N 3.41Å; L381-K384 VanDerWaalsContact O-N 3.16Å; N382-K384 PolarHBondContact O-N 2.95Å; K384-Y388 PolarHBondContact O-N 2.9Å
385	L	92.9	Very high	84.7	Confident	15 Å²	15	45.2 Å²	45.2	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-46.5	170.4	-178.3	63.7	0	0	0	111.6	L37 V41 V347 L381 N382 R387 Y388 L389	L37-L385 HydrophobicContact CD2-CD1 4.16Å; L37-L385 HydrophobicContact CD2-CD2 3.92Å; L37-L385 HydrophobicContact CD2-CG 4.43Å; V41-L385 HydrophobicContact CG1-CB 4.11Å; V41-L385 HydrophobicContact CG2-CD1 4.32Å; V347-L385 HydrophobicContact CG2-CD2 4.15Å; L381-L385 PolarHBondContact O-N 3.31Å; N382-L385 CarbonylContact O-C 3.55Å; N382-L385 WeakPolarHBondContact O-CB 3.45Å; N382-L385 PolarHBondContact O-N 2.83Å; L385-R387 VanDerWaalsContact C-N 3.35Å; L385-R387 PolarHBondContact O-N 2.71Å; L385-Y388 WeakPolarHBondContact O-CB 3.37Å; L385-Y388 PolarHBondContact O-N 3.1Å; L385-Y388 VanDerWaalsContact O-N 3.12Å; L385-L389 HydrophobicContact CD1-CD1 4.13Å; L385-L389 HydrophobicContact CD1-CG 4.12Å; L385-L389 HydrophobicContact CD2-CD1 4.46Å; L385-L389 HydrophobicContact CG-CD1 3.88Å; L385-L389 HydrophobicContact CG-CG 4.28Å; L385-L389 WeakPolarHBondContact O-CG 3.37Å; L385-L389 PolarHBondContact O-N 3.19Å
386	E	90.7	Very high	82.5	Confident	99 Å²	99	47.3 Å²	47.3	46%	0.463	25%	0.25	S	C	.	.	H	α-helix	trans	-54.2	-47.7	176.8	-73.5	162.7	-169.9	0	0	111.8	N382 K383 Y388 L389 S390	N382-E386 PolarHBondContact ND2-OE1 2.99Å; N382-E386 WeakPolarHBondContact O-CG 3.49Å; N382-E386 PolarHBondContact O-N 2.78Å; K383-E386 WeakPolarHBondContact CA-OE2 3.29Å; E386-Y388 VanDerWaalsContact C-N 3.35Å; E386-Y388 PolarHBondContact O-N 3.34Å; E386-L389 PolarHBondContact O-N 3.08Å; E386-S390 WeakPolarHBondContact O-CB 3.2Å; E386-S390 PolarHBondContact O-N 3.39Å; E386-S390 PolarHBondContact O-OG 3.05Å; E386-S390 VanDerWaalsContact O-OG 3.08Å
387	R	88.9	Confident	80.1	Confident	47 Å²	47	50.5 Å²	50.5	18%	0.177	27%	0.267	C	S	.	.	H	α-helix	trans	-68.1	-30.5	178.2	-71.5	176.5	-64.1	141.3	2.6	113.7	E86 E196 K383 L385 S390 K392 Q396	E86-R387 IonicContact OE1-CZ 3.47Å; E86-R387 IonicContact OE1-NH1 3.37Å; E86-R387 IonicContact OE1-NH2 2.85Å; E86-R387 PolarHBondContact OE1-NH2 2.83Å; E86-R387 IonicContact OE2-CZ 2.69Å; E86-R387 IonicContact OE2-NH2 3.67Å; E86-R387 PolarHBondContact OE2-NH2 2.93Å; E196-R387 VanDerWaalsContact OE2-CD 3.28Å; E196-R387 WeakPolarHBondContact OE2-CD 3.32Å; K383-R387 WeakPolarHBondContact O-CG 3.24Å; K383-R387 PolarHBondContact O-N 3.31Å; K383-R387 PolarHBondContact O-NE 3.44Å; L385-R387 VanDerWaalsContact C-N 3.35Å; L385-R387 PolarHBondContact O-N 2.71Å; R387-S390 PolarHBondContact O-OG 2.86Å; R387-K392 HydrophobicContact CB-CB 4.48Å; R387-K392 PolarHBondContact O-N 3.43Å; R387-Q396 VanDerWaalsContact CD-OE1 3.26Å
388	Y	87.1	Confident	77.3	Confident	81 Å²	81	53.5 Å²	53.5	32%	0.318	29%	0.288	S	S	.	.	H	α-helix	trans	-68.9	-50.8	171.9	176.5	-99	0	0	0	110.9	P38 V41 K384 L385 E386 S390 G391	P38-Y388 HydrophobicContact CB-CE1 4.07Å; P38-Y388 HydrophobicContact CG-CD1 4.02Å; P38-Y388 HydrophobicContact CG-CE1 3.61Å; V41-Y388 HydrophobicContact CG2-CD1 4.36Å; V41-Y388 HydrophobicContact CG2-CG 4.04Å; K384-Y388 PolarHBondContact O-N 2.9Å; L385-Y388 WeakPolarHBondContact O-CB 3.37Å; L385-Y388 PolarHBondContact O-N 3.1Å; L385-Y388 VanDerWaalsContact O-N 3.12Å; E386-Y388 VanDerWaalsContact C-N 3.35Å; E386-Y388 PolarHBondContact O-N 3.34Å; Y388-S390 VanDerWaalsContact C-N 3.3Å; Y388-S390 PolarHBondContact O-N 3.17Å; Y388-G391 PolarHBondContact O-N 3.4Å
389	L	87.9	Confident	74.7	Confident	118 Å²	118	57.7 Å²	57.7	62%	0.618	31%	0.31	S	S	*	.	H	α-helix	trans	-63.7	-32.6	179.2	-67.2	175.3	0	0	0	112.9	L385 E386 G391	L385-L389 HydrophobicContact CD1-CD1 4.13Å; L385-L389 HydrophobicContact CD1-CG 4.12Å; L385-L389 HydrophobicContact CD2-CD1 4.46Å; L385-L389 HydrophobicContact CG-CD1 3.88Å; L385-L389 HydrophobicContact CG-CG 4.28Å; L385-L389 WeakPolarHBondContact O-CG 3.37Å; L385-L389 PolarHBondContact O-N 3.19Å; E386-L389 PolarHBondContact O-N 3.08Å; L389-G391 VanDerWaalsContact C-N 3.25Å; L389-G391 PolarHBondContact O-N 2.77Å
390	S	84.9	Confident	72.3	Confident	64 Å²	64	58.2 Å²	58.2	45%	0.448	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	8	174.9	70.5	0	0	0	0	114.3	E386 R387 Y388 K392	E386-S390 WeakPolarHBondContact O-CB 3.2Å; E386-S390 PolarHBondContact O-N 3.39Å; E386-S390 PolarHBondContact O-OG 3.05Å; E386-S390 VanDerWaalsContact O-OG 3.08Å; R387-S390 PolarHBondContact O-OG 2.86Å; Y388-S390 VanDerWaalsContact C-N 3.3Å; Y388-S390 PolarHBondContact O-N 3.17Å; S390-K392 PolarHBondContact O-N 2.73Å; S390-K392 VanDerWaalsContact O-N 3.17Å; S390-K392 WeakPolarHBondContact OG-CD 3.42Å; S390-K392 WeakPolarHBondContact OG-CG 3.47Å
391	G	76.2	Confident	69.5	Low	55 Å²	55	64.7 Å²	64.7	57%	0.567	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	17.3	178.3	0	0	0	0	0	115.4	Y388 L389 S393	Y388-G391 PolarHBondContact O-N 3.4Å; L389-G391 VanDerWaalsContact C-N 3.25Å; L389-G391 PolarHBondContact O-N 2.77Å; G391-S393 VanDerWaalsContact C-N 3.27Å; G391-S393 PolarHBondContact O-N 3.14Å
392	K	65.4	Low	66.6	Low	56 Å²	56	71.2 Å²	71.2	24%	0.243	37%	0.371	C	S	.	.			trans	-83.2	-1.4	-177.7	-66.3	-178.9	-168.2	-176.2	0	113	D197 R387 S390 D394 Q396	D197-K392 IonicContact OD1-NZ 2.9Å; D197-K392 PolarHBondContact OD1-NZ 3.29Å; D197-K392 IonicContact OD2-NZ 3.44Å; D197-K392 PolarHBondContact OD2-NZ 3.09Å; R387-K392 HydrophobicContact CB-CB 4.48Å; R387-K392 PolarHBondContact O-N 3.43Å; S390-K392 PolarHBondContact O-N 2.73Å; S390-K392 VanDerWaalsContact O-N 3.17Å; S390-K392 WeakPolarHBondContact OG-CD 3.42Å; S390-K392 WeakPolarHBondContact OG-CG 3.47Å; K392-D394 PolarHBondContact O-N 2.94Å; K392-Q396 HydrophobicContact CB-CG 4.21Å; K392-Q396 WeakPolarHBondContact O-CB 3.49Å; K392-Q396 WeakPolarHBondContact O-CG 3.21Å; K392-Q396 PolarHBondContact O-N 3.01Å
393	S	55	Low	64.2	Low	32 Å²	32	73.5 Å²	73.5	22%	0.224	39%	0.386	C	S	.	.	H	α-helix	trans	-52.1	-58.5	-162.3	49.8	0	0	0	0	115	G391	G391-S393 VanDerWaalsContact C-N 3.27Å; G391-S393 PolarHBondContact O-N 3.14Å
394	D	47.5	Very low	62	Low	116 Å²	116	74 Å²	74	62%	0.62	39%	0.386	S	S	*	.	H	α-helix	trans	-99.2	-23.9	-164.3	-63.3	-82.1	0	0	0	113.2	K392 Q396	K392-D394 PolarHBondContact O-N 2.94Å; D394-Q396 VanDerWaalsContact C-N 3.34Å
395	I	45.9	Very low	59.6	Low	120 Å²	120	76.2 Å²	76.2	62%	0.615	40%	0.399	S	S	*	.	H	α-helix	trans	-69	-35	171.2	-63.5	174.6	0	0	0	110	S398 L399	I395-S398 CarbonylContact O-C 3.57Å; I395-S398 PolarHBondContact O-N 2.8Å; I395-L399 HydrophobicContact CG2-CB 4.15Å; I395-L399 HydrophobicContact CG2-CD2 4.37Å; I395-L399 WeakPolarHBondContact O-CA 3.34Å; I395-L399 WeakPolarHBondContact O-CB 3.45Å; I395-L399 PolarHBondContact O-N 2.76Å
396	Q	49.7	Very low	57.2	Low	44 Å²	44	84.3 Å²	84.3	21%	0.206	43%	0.43	C	S	.	.	H	α-helix	trans	-71.6	-41	-168.8	-90	-167.5	-18.7	0	0	116.4	E196 R387 K392 D394 S398 L399 C400	E196-Q396 PolarHBondContact OE2-NE2 3.39Å; R387-Q396 VanDerWaalsContact CD-OE1 3.26Å; K392-Q396 HydrophobicContact CB-CG 4.21Å; K392-Q396 WeakPolarHBondContact O-CB 3.49Å; K392-Q396 WeakPolarHBondContact O-CG 3.21Å; K392-Q396 PolarHBondContact O-N 3.01Å; D394-Q396 VanDerWaalsContact C-N 3.34Å; Q396-S398 VanDerWaalsContact C-N 3.29Å; Q396-L399 PolarHBondContact O-N 3.17Å; Q396-C400 WeakPolarHBondContact O-CB 3.29Å; Q396-C400 PolarHBondContact O-N 2.81Å
397	D	48.7	Very low	55	Low	68 Å²	68	83.6 Å²	83.6	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-70.3	-32.4	176.3	-97.1	-36.6	0	0	0	110.7	R48 Y401	R48-D397 IonicContact CZ-OD2 2.62Å; R48-D397 IonicContact NH1-OD1 3.79Å; R48-D397 IonicContact NH1-OD2 2.75Å; R48-D397 PolarHBondContact NH1-OD2 2.96Å; D397-Y401 WeakPolarHBondContact O-CB 3.29Å; D397-Y401 PolarHBondContact O-N 3.39Å
398	S	37.4	Very low	52.8	Low	63 Å²	63	86 Å²	86	44%	0.441	44%	0.442	S	S	.	.	H	α-helix	trans	-70.3	-36.4	172.4	-172.3	0	0	0	0	113.3	I395 Q396 Y401 K402	I395-S398 CarbonylContact O-C 3.57Å; I395-S398 PolarHBondContact O-N 2.8Å; Q396-S398 VanDerWaalsContact C-N 3.29Å; S398-Y401 CarbonylContact O-C 3.59Å; S398-Y401 WeakPolarHBondContact O-CA 3.11Å; S398-Y401 VanDerWaalsContact O-CB 3.29Å; S398-Y401 WeakPolarHBondContact O-CB 3.3Å; S398-Y401 PolarHBondContact O-N 2.78Å; S398-K402 PolarHBondContact O-N 3.39Å
399	L	42.4	Very low	50.6	Low	90 Å²	90	87.8 Å²	87.8	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-81.1	-34.6	177.8	-170	68.6	0	0	0	111.4	I395 Q396 Y401 K402 T403	I395-L399 HydrophobicContact CG2-CB 4.15Å; I395-L399 HydrophobicContact CG2-CD2 4.37Å; I395-L399 WeakPolarHBondContact O-CA 3.34Å; I395-L399 WeakPolarHBondContact O-CB 3.45Å; I395-L399 PolarHBondContact O-N 2.76Å; Q396-L399 PolarHBondContact O-N 3.17Å; L399-Y401 PolarHBondContact O-N 3.29Å; L399-K402 HydrophobicContact CD1-CB 4.42Å; L399-K402 PolarHBondContact O-N 3.34Å; L399-K402 VanDerWaalsContact O-N 3.17Å; L399-T403 WeakPolarHBondContact O-CB 3.47Å; L399-T403 PolarHBondContact O-N 3.1Å; L399-T403 PolarHBondContact O-OG1 3.1Å
400	C	45.5	Very low	48.2	Very low	47 Å²	47	88.4 Å²	88.4	32%	0.318	45%	0.451	S	S	.	.	H	α-helix	trans	-55.8	-39.4	161.8	178.9	0	0	0	0	109.5	Q396 R404	Q396-C400 WeakPolarHBondContact O-CB 3.29Å; Q396-C400 PolarHBondContact O-N 2.81Å; C400-R404 WeakPolarHBondContact O-CB 3.39Å; C400-R404 WeakPolarHBondContact O-CD 3.38Å; C400-R404 WeakPolarHBondContact O-CG 3.4Å; C400-R404 PolarHBondContact O-N 3.22Å
401	Y	39.8	Very low	46	Very low	146 Å²	146	89.6 Å²	89.6	57%	0.573	45%	0.446	S	S	*	.	H	α-helix	trans	-69.9	-40	171.3	-110.6	-89.8	0	0	0	114.4	D397 S398 L399 R404 L405	D397-Y401 WeakPolarHBondContact O-CB 3.29Å; D397-Y401 PolarHBondContact O-N 3.39Å; S398-Y401 CarbonylContact O-C 3.59Å; S398-Y401 WeakPolarHBondContact O-CA 3.11Å; S398-Y401 VanDerWaalsContact O-CB 3.29Å; S398-Y401 WeakPolarHBondContact O-CB 3.3Å; S398-Y401 PolarHBondContact O-N 2.78Å; L399-Y401 PolarHBondContact O-N 3.29Å; Y401-R404 CarbonylContact O-C 3.4Å; Y401-R404 WeakPolarHBondContact O-CB 3.29Å; Y401-R404 PolarHBondContact O-N 3.41Å; Y401-L405 HydrophobicContact CD1-CD1 4.34Å; Y401-L405 WeakPolarHBondContact O-CB 3.49Å; Y401-L405 VanDerWaalsContact O-CG 3.25Å; Y401-L405 WeakPolarHBondContact O-CG 3.42Å; Y401-L405 PolarHBondContact O-N 3.01Å
402	K	34.5	Very low	44.1	Very low	139 Å²	139	97.4 Å²	97.4	60%	0.604	46%	0.458	S	S	*	.	H	α-helix	trans	-74	-40.5	-179.7	-77.6	-177.9	177.1	-179.4	0	112.7	S398 L399 R404 L405 Y406	S398-K402 PolarHBondContact O-N 3.39Å; L399-K402 HydrophobicContact CD1-CB 4.42Å; L399-K402 PolarHBondContact O-N 3.34Å; L399-K402 VanDerWaalsContact O-N 3.17Å; K402-R404 VanDerWaalsContact C-N 3.34Å; K402-L405 PolarHBondContact O-N 3.25Å; K402-Y406 WeakPolarHBondContact O-CB 3.39Å; K402-Y406 PolarHBondContact O-N 3.03Å
403	T	43.3	Very low	42.6	Very low	74 Å²	74	97.5 Å²	97.5	45%	0.454	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-35.7	169.1	-55.1	0	0	0	0	110.8	L399 Q407	L399-T403 WeakPolarHBondContact O-CB 3.47Å; L399-T403 PolarHBondContact O-N 3.1Å; L399-T403 PolarHBondContact O-OG1 3.1Å; T403-Q407 VanDerWaalsContact O-CG 3.29Å; T403-Q407 WeakPolarHBondContact O-CG 3.46Å; T403-Q407 PolarHBondContact O-N 3.47Å; T403-Q407 VanDerWaalsContact O-N 3.1Å
404	R	47.1	Very low	41.9	Very low	60 Å²	60	101.3 Å²	101.3	23%	0.226	49%	0.494	C	S	.	.	H	α-helix	trans	-63.7	-36.2	167.2	-83.9	172.9	170.5	-158.5	-6.6	112.7	E78 C400 Y401 K402 Q407 I408	E78-R404 IonicContact OE1-NH2 3.91Å; E78-R404 PolarHBondContact OE1-NH2 3.25Å; E78-R404 IonicContact OE2-NH2 2.67Å; E78-R404 PolarHBondContact OE2-NH2 3.04Å; C400-R404 WeakPolarHBondContact O-CB 3.39Å; C400-R404 WeakPolarHBondContact O-CD 3.38Å; C400-R404 WeakPolarHBondContact O-CG 3.4Å; C400-R404 PolarHBondContact O-N 3.22Å; Y401-R404 CarbonylContact O-C 3.4Å; Y401-R404 WeakPolarHBondContact O-CB 3.29Å; Y401-R404 PolarHBondContact O-N 3.41Å; K402-R404 VanDerWaalsContact C-N 3.34Å; R404-Q407 CarbonylContact O-C 3.53Å; R404-Q407 WeakPolarHBondContact O-CB 3.36Å; R404-Q407 PolarHBondContact O-N 3.29Å; R404-I408 HydrophobicContact CB-CD1 4.19Å; R404-I408 VanDerWaalsContact O-CB 3.23Å; R404-I408 WeakPolarHBondContact O-CB 3.29Å; R404-I408 WeakPolarHBondContact O-CD1 3.49Å; R404-I408 WeakPolarHBondContact O-CG1 3.1Å; R404-I408 PolarHBondContact O-N 3.46Å
405	L	40.6	Very low	41.4	Very low	67 Å²	67	102 Å²	102	35%	0.351	49%	0.491	S	S	.	.	H	α-helix	trans	-75.8	-41.2	179.5	-78.9	165.4	0	0	0	111.1	Y401 K402 Q407 I408 E409	Y401-L405 HydrophobicContact CD1-CD1 4.34Å; Y401-L405 WeakPolarHBondContact O-CB 3.49Å; Y401-L405 VanDerWaalsContact O-CG 3.25Å; Y401-L405 WeakPolarHBondContact O-CG 3.42Å; Y401-L405 PolarHBondContact O-N 3.01Å; K402-L405 PolarHBondContact O-N 3.25Å; L405-Q407 CarbonylContact O-C 3.41Å; L405-Q407 PolarHBondContact O-N 2.91Å; L405-Q407 VanDerWaalsContact O-N 3.14Å; L405-I408 PolarHBondContact O-N 3.43Å; L405-I408 VanDerWaalsContact O-N 3.09Å; L405-E409 HydrophobicContact CD2-CG 4.31Å; L405-E409 VanDerWaalsContact O-CB 3.3Å; L405-E409 WeakPolarHBondContact O-CB 3.15Å; L405-E409 WeakPolarHBondContact O-CG 3.45Å; L405-E409 PolarHBondContact O-N 3.4Å
406	Y	43.7	Very low	41	Very low	185 Å²	185	104.3 Å²	104.3	73%	0.725	50%	0.499	S	S	*	.	H	α-helix	trans	-60.1	-25.6	170.6	-135.8	-98.2	0	0	0	112.6	K402 K410	K402-Y406 WeakPolarHBondContact O-CB 3.39Å; K402-Y406 PolarHBondContact O-N 3.03Å; Y406-K410 WeakPolarHBondContact O-CB 3.3Å
407	Q	44.2	Very low	40.4	Very low	83 Å²	83	106.3 Å²	106.3	39%	0.388	52%	0.518	S	S	.	.	H	α-helix	trans	-77.8	-58.6	165.1	-69.8	167.9	2	0	0	111.4	T403 R404 L405 E409 K410 Y411	T403-Q407 VanDerWaalsContact O-CG 3.29Å; T403-Q407 WeakPolarHBondContact O-CG 3.46Å; T403-Q407 PolarHBondContact O-N 3.47Å; T403-Q407 VanDerWaalsContact O-N 3.1Å; R404-Q407 CarbonylContact O-C 3.53Å; R404-Q407 WeakPolarHBondContact O-CB 3.36Å; R404-Q407 PolarHBondContact O-N 3.29Å; L405-Q407 CarbonylContact O-C 3.41Å; L405-Q407 PolarHBondContact O-N 2.91Å; L405-Q407 VanDerWaalsContact O-N 3.14Å; Q407-E409 PolarHBondContact O-N 3.45Å; Q407-K410 CarbonylContact O-C 3.18Å; Q407-K410 PolarHBondContact O-N 3Å; Q407-Y411 VanDerWaalsContact O-CB 3.24Å; Q407-Y411 WeakPolarHBondContact O-CB 2.97Å; Q407-Y411 WeakPolarHBondContact O-CD2 3.24Å; Q407-Y411 PolarHBondContact O-N 3.25Å
408	I	43	Very low	39.7	Very low	98 Å²	98	105.7 Å²	105.7	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-38.6	-171.8	-72.7	163.7	0	0	0	113.5	R404 L405 Y411 R412	R404-I408 HydrophobicContact CB-CD1 4.19Å; R404-I408 VanDerWaalsContact O-CB 3.23Å; R404-I408 WeakPolarHBondContact O-CB 3.29Å; R404-I408 WeakPolarHBondContact O-CD1 3.49Å; R404-I408 WeakPolarHBondContact O-CG1 3.1Å; R404-I408 PolarHBondContact O-N 3.46Å; L405-I408 PolarHBondContact O-N 3.43Å; L405-I408 VanDerWaalsContact O-N 3.09Å; I408-Y411 CarbonylContact O-C 3.56Å; I408-Y411 PolarHBondContact O-N 3.08Å; I408-R412 PolarHBondContact O-N 2.87Å; I408-R412 VanDerWaalsContact O-N 3.1Å
409	E	39.3	Very low	39.7	Very low	118 Å²	118	107.2 Å²	107.2	55%	0.551	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-42.4	177.8	-63.3	-177	130.8	0	0	110.8	L405 Q407 Y411 R412	L405-E409 HydrophobicContact CD2-CG 4.31Å; L405-E409 VanDerWaalsContact O-CB 3.3Å; L405-E409 WeakPolarHBondContact O-CB 3.15Å; L405-E409 WeakPolarHBondContact O-CG 3.45Å; L405-E409 PolarHBondContact O-N 3.4Å; Q407-E409 PolarHBondContact O-N 3.45Å; E409-Y411 PolarHBondContact O-N 2.74Å; E409-R412 VanDerWaalsContact O-CB 3.24Å; E409-R412 WeakPolarHBondContact O-CB 3.26Å; E409-R412 PolarHBondContact O-N 3.32Å
410	K	37.3	Very low	39.8	Very low	131 Å²	131	105.1 Å²	105.1	57%	0.57	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-64	-28.2	170.9	-163.5	175.9	-178.2	-174.4	0	111.9	Y406 Q407 R412	Y406-K410 WeakPolarHBondContact O-CB 3.3Å; Q407-K410 CarbonylContact O-C 3.18Å; Q407-K410 PolarHBondContact O-N 3Å; K410-R412 VanDerWaalsContact C-N 3.31Å
411	Y	40.6	Very low	39.7	Very low	90 Å²	90	105.2 Å²	105.2	35%	0.353	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-87	4.5	174.2	-69.9	-158.6	0	0	0	112.9	Q407 I408 E409 Y418	Q407-Y411 VanDerWaalsContact O-CB 3.24Å; Q407-Y411 WeakPolarHBondContact O-CB 2.97Å; Q407-Y411 WeakPolarHBondContact O-CD2 3.24Å; Q407-Y411 PolarHBondContact O-N 3.25Å; I408-Y411 CarbonylContact O-C 3.56Å; I408-Y411 PolarHBondContact O-N 3.08Å; E409-Y411 PolarHBondContact O-N 2.74Å; Y411-Y418 HydrophobicContact CD1-CE1 4.35Å; Y411-Y418 AromaticContact CD1-CE2 3.75Å; Y411-Y418 HydrophobicContact CD1-CE2 3.75Å; Y411-Y418 AromaticContact CD1-CZ 3.46Å; Y411-Y418 VanDerWaalsContact CD1-CZ 3.46Å; Y411-Y418 WeakPolarHBondContact CD1-OH 3.36Å; Y411-Y418 HydrophobicContact CD2-CD2 4.41Å; Y411-Y418 HydrophobicContact CD2-CE1 4.09Å; Y411-Y418 AromaticContact CD2-CE2 3.94Å; Y411-Y418 HydrophobicContact CD2-CE2 3.94Å; Y411-Y418 AromaticContact CD2-CZ 3.82Å; Y411-Y418 HydrophobicContact CE1-CD2 4.49Å; Y411-Y418 AromaticContact CE1-CE2 3.47Å; Y411-Y418 HydrophobicContact CE1-CE2 3.47Å; Y411-Y418 VanDerWaalsContact CE1-CE2 3.47Å; Y411-Y418 AromaticContact CE1-CZ 3.73Å; Y411-Y418 HydrophobicContact CE2-CD2 4.02Å; Y411-Y418 AromaticContact CE2-CE2 3.7Å; Y411-Y418 HydrophobicContact CE2-CE2 3.7Å; Y411-Y418 AromaticContact CG-CE1 3.95Å; Y411-Y418 HydrophobicContact CG-CE1 3.95Å; Y411-Y418 AromaticContact CG-CE2 3.97Å; Y411-Y418 HydrophobicContact CG-CE2 3.97Å; Y411-Y418 AromaticContact CG-CZ 3.51Å; Y411-Y418 AromaticContact CZ-CE2 3.45Å; Y411-Y418 VanDerWaalsContact CZ-CE2 3.45Å
412	R	34.3	Very low	39.9	Very low	218 Å²	218	100.1 Å²	100.1	82%	0.823	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-90.5	-14.2	171.6	-138.1	173.6	-171.2	171.4	1.7	112.3	I408 E409 K410	I408-R412 PolarHBondContact O-N 2.87Å; I408-R412 VanDerWaalsContact O-N 3.1Å; E409-R412 VanDerWaalsContact O-CB 3.24Å; E409-R412 WeakPolarHBondContact O-CB 3.26Å; E409-R412 PolarHBondContact O-N 3.32Å; K410-R412 VanDerWaalsContact C-N 3.31Å
413	A	34.5	Very low	40.5	Very low	58 Å²	58	98.5 Å²	98.5	48%	0.479	49%	0.489	S	S	.	.	S	Bend	trans	-75.4	165.2	160.7	0	0	0	0	0	110.9	K415	A413-K415 PolarHBondContact O-N 3.01Å; A413-K415 VanDerWaalsContact O-N 3.1Å
414	P	40	Very low	40.7	Very low	113 Å²	113	97.7 Å²	97.7	73%	0.734	48%	0.484	S	S	*	.			trans	-51.9	113.8	-162.2	-32.3	37.9	0	0	0	116.1	E416 S417	P414-E416 PolarHBondContact O-N 2.93Å; P414-S417 PolarHBondContact O-N 3.43Å
415	K	37.5	Very low	40.7	Very low	129 Å²	129	96.9 Å²	96.9	56%	0.561	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-1.2	-167.1	-140.3	-179.6	-175.4	-177.7	0	116	A413 Y418	A413-K415 PolarHBondContact O-N 3.01Å; A413-K415 VanDerWaalsContact O-N 3.1Å; K415-Y418 VanDerWaalsContact CE-OH 3.29Å; K415-Y418 WeakPolarHBondContact CE-OH 3.47Å; K415-Y418 HydrophobicContact CG-CE1 3.85Å; K415-Y418 WeakPolarHBondContact CG-OH 3.11Å
416	E	37.8	Very low	41.1	Very low	169 Å²	169	95 Å²	95	79%	0.79	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-7.2	-176.6	-58.7	-167	135.8	0	0	113.4	P414 A420	P414-E416 PolarHBondContact O-N 2.93Å; E416-A420 WeakPolarHBondContact O-CB 3.4Å
417	S	36.4	Very low	41.4	Very low	86 Å²	86	91.6 Å²	91.6	60%	0.601	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-51.7	-176.9	-174.4	0	0	0	0	113.5	P414 S421	P414-S417 PolarHBondContact O-N 3.43Å; S417-S421 VanDerWaalsContact O-CB 3.26Å; S417-S421 WeakPolarHBondContact O-CB 3.24Å; S417-S421 PolarHBondContact O-N 2.95Å
418	Y	35	Very low	41.5	Very low	56 Å²	56	91.5 Å²	91.5	22%	0.22	46%	0.46	C	S	.	.	H	α-helix	trans	-75.8	-41.2	-171.5	74.4	-91.2	0	0	0	113.6	Y411 K415 A420 S421 L422	Y411-Y418 HydrophobicContact CD1-CE1 4.35Å; Y411-Y418 AromaticContact CD1-CE2 3.75Å; Y411-Y418 HydrophobicContact CD1-CE2 3.75Å; Y411-Y418 AromaticContact CD1-CZ 3.46Å; Y411-Y418 VanDerWaalsContact CD1-CZ 3.46Å; Y411-Y418 WeakPolarHBondContact CD1-OH 3.36Å; Y411-Y418 HydrophobicContact CD2-CD2 4.41Å; Y411-Y418 HydrophobicContact CD2-CE1 4.09Å; Y411-Y418 AromaticContact CD2-CE2 3.94Å; Y411-Y418 HydrophobicContact CD2-CE2 3.94Å; Y411-Y418 AromaticContact CD2-CZ 3.82Å; Y411-Y418 HydrophobicContact CE1-CD2 4.49Å; Y411-Y418 AromaticContact CE1-CE2 3.47Å; Y411-Y418 HydrophobicContact CE1-CE2 3.47Å; Y411-Y418 VanDerWaalsContact CE1-CE2 3.47Å; Y411-Y418 AromaticContact CE1-CZ 3.73Å; Y411-Y418 HydrophobicContact CE2-CD2 4.02Å; Y411-Y418 AromaticContact CE2-CE2 3.7Å; Y411-Y418 HydrophobicContact CE2-CE2 3.7Å; Y411-Y418 AromaticContact CG-CE1 3.95Å; Y411-Y418 HydrophobicContact CG-CE1 3.95Å; Y411-Y418 AromaticContact CG-CE2 3.97Å; Y411-Y418 HydrophobicContact CG-CE2 3.97Å; Y411-Y418 AromaticContact CG-CZ 3.51Å; Y411-Y418 AromaticContact CZ-CE2 3.45Å; Y411-Y418 VanDerWaalsContact CZ-CE2 3.45Å; K415-Y418 VanDerWaalsContact CE-OH 3.29Å; K415-Y418 WeakPolarHBondContact CE-OH 3.47Å; K415-Y418 HydrophobicContact CG-CE1 3.85Å; K415-Y418 WeakPolarHBondContact CG-OH 3.11Å; Y418-A420 VanDerWaalsContact C-N 3.33Å; Y418-S421 PolarHBondContact O-N 2.92Å; Y418-L422 PolarHBondContact O-N 3.19Å
419	E	37.3	Very low	41.7	Very low	94 Å²	94	87.7 Å²	87.7	44%	0.439	44%	0.441	S	S	.	.	H	α-helix	trans	-65.4	-41.4	173.6	-59.2	-170.5	178.6	0	0	109.7	S421 L422 D423	E419-S421 VanDerWaalsContact C-N 3.33Å; E419-S421 PolarHBondContact O-N 3.47Å; E419-L422 PolarHBondContact O-N 3.2Å; E419-D423 VanDerWaalsContact O-CB 3.26Å; E419-D423 WeakPolarHBondContact O-CB 3.31Å; E419-D423 PolarHBondContact O-N 2.8Å
420	A	43.7	Very low	41.9	Very low	46 Å²	46	85.8 Å²	85.8	38%	0.38	43%	0.432	S	S	.	.	H	α-helix	trans	-64.2	-35.1	174.7	0	0	0	0	0	112.8	E416 Y418 T424	E416-A420 WeakPolarHBondContact O-CB 3.4Å; Y418-A420 VanDerWaalsContact C-N 3.33Å; A420-T424 WeakPolarHBondContact O-CA 3.41Å; A420-T424 WeakPolarHBondContact O-CB 3.19Å; A420-T424 PolarHBondContact O-N 3.41Å; A420-T424 PolarHBondContact O-OG1 2.94Å
421	S	42.8	Very low	41.8	Very low	50 Å²	50	85.3 Å²	85.3	35%	0.35	43%	0.43	S	S	.	.	H	α-helix	trans	-78.8	-28.2	179.3	-161.3	0	0	0	0	112.9	Y153 S417 Y418 E419 W425	Y153-S421 WeakPolarHBondContact OH-CB 3.23Å; Y153-S421 PolarHBondContact OH-OG 2.81Å; S417-S421 VanDerWaalsContact O-CB 3.26Å; S417-S421 WeakPolarHBondContact O-CB 3.24Å; S417-S421 PolarHBondContact O-N 2.95Å; Y418-S421 PolarHBondContact O-N 2.92Å; E419-S421 VanDerWaalsContact C-N 3.33Å; E419-S421 PolarHBondContact O-N 3.47Å; S421-W425 WeakPolarHBondContact O-CB 3.45Å; S421-W425 PolarHBondContact O-N 2.88Å
422	L	45.4	Very low	41.9	Very low	38 Å²	38	83.3 Å²	83.3	20%	0.199	42%	0.424	C	S	.	.	H	α-helix	trans	-78.5	-39.7	170.8	-170.3	75.5	0	0	0	111.5	Y153 Y418 E419 T424 W425 T426	Y153-L422 HydrophobicContact CD1-CD1 4.35Å; Y153-L422 HydrophobicContact CD2-CD1 4.29Å; Y153-L422 HydrophobicContact CG-CD1 4.07Å; Y418-L422 PolarHBondContact O-N 3.19Å; E419-L422 PolarHBondContact O-N 3.2Å; L422-T424 PolarHBondContact O-N 3.49Å; L422-W425 HydrophobicContact CD1-CE3 4.14Å; L422-W425 PolarHBondContact O-N 3.46Å; L422-T426 VanDerWaalsContact O-CB 3.26Å; L422-T426 WeakPolarHBondContact O-CB 3.39Å; L422-T426 PolarHBondContact O-N 3.26Å; L422-T426 PolarHBondContact O-OG1 3.47Å
423	D	46.2	Very low	42	Very low	106 Å²	106	74.1 Å²	74.1	57%	0.567	39%	0.394	S	S	*	.	H	α-helix	trans	-63.7	-33	168.7	-84.6	1.2	0	0	0	110.8	E419 R427	E419-D423 VanDerWaalsContact O-CB 3.26Å; E419-D423 WeakPolarHBondContact O-CB 3.31Å; E419-D423 PolarHBondContact O-N 2.8Å; D423-R427 VanDerWaalsContact O-CB 3.23Å; D423-R427 WeakPolarHBondContact O-CB 3.24Å; D423-R427 WeakPolarHBondContact O-CD 3.41Å; D423-R427 WeakPolarHBondContact O-CG 3.01Å; D423-R427 PolarHBondContact O-N 2.78Å
424	T	48.2	Very low	42	Very low	57 Å²	57	75.2 Å²	75.2	35%	0.35	40%	0.395	S	S	.	.	H	α-helix	trans	-72	-47.7	173.9	-61.3	0	0	0	0	110.3	A420 L422 T426 R427 D428	A420-T424 WeakPolarHBondContact O-CA 3.41Å; A420-T424 WeakPolarHBondContact O-CB 3.19Å; A420-T424 PolarHBondContact O-N 3.41Å; A420-T424 PolarHBondContact O-OG1 2.94Å; L422-T424 PolarHBondContact O-N 3.49Å; T424-T426 VanDerWaalsContact C-N 3.32Å; T424-T426 PolarHBondContact O-N 3.42Å; T424-R427 CarbonylContact O-C 3.57Å; T424-R427 VanDerWaalsContact O-C 3.29Å; T424-R427 VanDerWaalsContact O-CA 3.27Å; T424-R427 WeakPolarHBondContact O-CA 3.43Å; T424-R427 VanDerWaalsContact O-CB 3.31Å; T424-R427 WeakPolarHBondContact O-CB 3.39Å; T424-R427 PolarHBondContact O-N 3.11Å; T424-D428 PolarHBondContact O-N 3.09Å
425	W	46.1	Very low	41.5	Very low	42 Å²	42	76.8 Å²	76.8	16%	0.159	39%	0.392	C	S	.	.	H	α-helix	trans	-63.4	-37.5	175.1	-174.8	59.6	0	0	0	112.5	M149 I152 Y153 G259 S421 L422 R427 D428 L429	M149-W425 HydrophobicContact CE-CE3 3.76Å; M149-W425 HydrophobicContact CE-CZ3 3.82Å; M149-W425 HydrophobicContact CG-CE3 4.19Å; M149-W425 HydrophobicContact CG-CH2 4.12Å; M149-W425 HydrophobicContact CG-CZ3 3.4Å; M149-W425 VanDerWaalsContact CG-CZ3 3.4Å; M149-W425 WeakPolarHBondContact O-CZ3 3.34Å; I152-W425 HydrophobicContact CB-CH2 4.22Å; I152-W425 HydrophobicContact CG2-CH2 3.91Å; I152-W425 HydrophobicContact CG2-CZ2 4.29Å; Y153-W425 HydrophobicContact CD2-CB 4.21Å; Y153-W425 AromaticContact CD2-CD2 3.75Å; Y153-W425 HydrophobicContact CD2-CD2 3.75Å; Y153-W425 AromaticContact CD2-CE3 3.61Å; Y153-W425 HydrophobicContact CD2-CE3 3.61Å; Y153-W425 HydrophobicContact CD2-CG 4.02Å; Y153-W425 HydrophobicContact CD2-CZ3 4.2Å; Y153-W425 HydrophobicContact CE2-CB 4.07Å; Y153-W425 HydrophobicContact CE2-CD2 4.47Å; Y153-W425 HydrophobicContact CE2-CG 4.28Å; Y153-W425 HydrophobicContact CG-CE3 4.18Å; Y153-W425 HydrophobicContact CG-CZ3 4.4Å; G259-W425 WeakPolarHBondContact O-CZ2 3.23Å; G259-W425 PolarHBondContact O-NE1 3.24Å; S421-W425 WeakPolarHBondContact O-CB 3.45Å; S421-W425 PolarHBondContact O-N 2.88Å; L422-W425 HydrophobicContact CD1-CE3 4.14Å; L422-W425 PolarHBondContact O-N 3.46Å; W425-R427 PolarHBondContact O-N 3.16Å; W425-D428 CarbonylContact O-C 3.55Å; W425-D428 PolarHBondContact O-N 3.25Å; W425-D428 VanDerWaalsContact O-N 3.11Å; W425-L429 HydrophobicContact CD2-CD1 4.05Å; W425-L429 HydrophobicContact CE3-CD1 4.32Å; W425-L429 HydrophobicContact CH2-CD1 4.48Å; W425-L429 HydrophobicContact CZ2-CD1 4.2Å; W425-L429 WeakPolarHBondContact O-CD1 3.38Å; W425-L429 WeakPolarHBondContact O-CG 3.48Å; W425-L429 PolarHBondContact O-N 2.98Å; W425-L429 VanDerWaalsContact O-N 3.1Å
426	T	48.6	Very low	41.2	Very low	28 Å²	28	77.2 Å²	77.2	17%	0.172	40%	0.401	C	S	.	.	H	α-helix	trans	-62	-34.7	170.4	-53.2	0	0	0	0	110.9	M149 L422 T424 L429 E430	M149-T426 HydrophobicContact CE-CG2 4.1Å; M149-T426 VanDerWaalsContact CE-OG1 3.23Å; M149-T426 WeakPolarHBondContact CE-OG1 3.11Å; L422-T426 VanDerWaalsContact O-CB 3.26Å; L422-T426 WeakPolarHBondContact O-CB 3.39Å; L422-T426 PolarHBondContact O-N 3.26Å; L422-T426 PolarHBondContact O-OG1 3.47Å; T424-T426 VanDerWaalsContact C-N 3.32Å; T424-T426 PolarHBondContact O-N 3.42Å; T426-L429 CarbonylContact O-C 3.38Å; T426-L429 WeakPolarHBondContact O-CB 3.44Å; T426-L429 PolarHBondContact O-N 3.22Å; T426-E430 HydrophobicContact CG2-CG 4.31Å; T426-E430 VanDerWaalsContact O-CB 3.29Å; T426-E430 WeakPolarHBondContact O-CB 3.35Å; T426-E430 WeakPolarHBondContact O-CG 3.16Å; T426-E430 PolarHBondContact O-N 2.81Å
427	R	52	Low	40.8	Very low	113 Å²	113	78.5 Å²	78.5	43%	0.426	40%	0.404	S	S	.	.	H	α-helix	trans	-75.4	-30.1	170.3	-78.4	168.8	60.4	-154.7	-8	113.2	D423 T424 W425 L429 E430 F431	D423-R427 VanDerWaalsContact O-CB 3.23Å; D423-R427 WeakPolarHBondContact O-CB 3.24Å; D423-R427 WeakPolarHBondContact O-CD 3.41Å; D423-R427 WeakPolarHBondContact O-CG 3.01Å; D423-R427 PolarHBondContact O-N 2.78Å; T424-R427 CarbonylContact O-C 3.57Å; T424-R427 VanDerWaalsContact O-C 3.29Å; T424-R427 VanDerWaalsContact O-CA 3.27Å; T424-R427 WeakPolarHBondContact O-CA 3.43Å; T424-R427 VanDerWaalsContact O-CB 3.31Å; T424-R427 WeakPolarHBondContact O-CB 3.39Å; T424-R427 PolarHBondContact O-N 3.11Å; W425-R427 PolarHBondContact O-N 3.16Å; R427-L429 PolarHBondContact O-N 3.38Å; R427-L429 VanDerWaalsContact O-N 3.09Å; R427-E430 PolarHBondContact O-N 2.69Å; R427-F431 HydrophobicContact CB-CB 3.86Å; R427-F431 HydrophobicContact CB-CD2 4.36Å; R427-F431 HydrophobicContact CB-CG 4.37Å; R427-F431 HydrophobicContact CG-CB 4.39Å; R427-F431 HydrophobicContact CG-CD2 4.17Å; R427-F431 VanDerWaalsContact O-CA 3.29Å; R427-F431 WeakPolarHBondContact O-CA 3.25Å; R427-F431 WeakPolarHBondContact O-CB 3.41Å; R427-F431 PolarHBondContact O-N 2.87Å
428	D	46	Very low	40.8	Very low	81 Å²	81	84.1 Å²	84.1	43%	0.433	42%	0.417	S	S	.	.	H	α-helix	trans	-70.3	-8.7	171.7	-53.4	-29.2	0	0	0	110.5	T424 W425 H432	T424-D428 PolarHBondContact O-N 3.09Å; W425-D428 CarbonylContact O-C 3.55Å; W425-D428 PolarHBondContact O-N 3.25Å; W425-D428 VanDerWaalsContact O-N 3.11Å; D428-H432 PolarHBondContact O-CD2 3.5Å
429	L	47.1	Very low	40.5	Very low	18 Å²	18	87 Å²	87	9%	0.094	44%	0.443	C	S	.	.	H	α-helix	trans	-103.6	-31.4	169.5	-57.8	163.4	0	0	0	113.7	M149 L261 W425 T426 R427	M149-L429 HydrophobicContact CE-CD1 3.49Å; M149-L429 VanDerWaalsContact CE-CD1 3.49Å; L261-L429 HydrophobicContact CD1-CB 4.21Å; L261-L429 HydrophobicContact CD1-CD2 3.56Å; L261-L429 HydrophobicContact CD1-CG 4.49Å; L261-L429 HydrophobicContact CD2-CD2 4.42Å; L261-L429 HydrophobicContact CG-CD2 3.51Å; W425-L429 HydrophobicContact CD2-CD1 4.05Å; W425-L429 HydrophobicContact CE3-CD1 4.32Å; W425-L429 HydrophobicContact CH2-CD1 4.48Å; W425-L429 HydrophobicContact CZ2-CD1 4.2Å; W425-L429 WeakPolarHBondContact O-CD1 3.38Å; W425-L429 WeakPolarHBondContact O-CG 3.48Å; W425-L429 PolarHBondContact O-N 2.98Å; W425-L429 VanDerWaalsContact O-N 3.1Å; T426-L429 CarbonylContact O-C 3.38Å; T426-L429 WeakPolarHBondContact O-CB 3.44Å; T426-L429 PolarHBondContact O-N 3.22Å; R427-L429 PolarHBondContact O-N 3.38Å; R427-L429 VanDerWaalsContact O-N 3.09Å
430	E	42.4	Very low	40	Very low	79 Å²	79	92 Å²	92	37%	0.369	46%	0.463	S	S	.	.	H	α-helix	trans	-109.2	-26.1	-175.8	-71.1	-166.4	142.3	0	0	115.8	K188 T426 R427 H432 A433	K188-E430 IonicContact NZ-OE1 2.82Å; T426-E430 HydrophobicContact CG2-CG 4.31Å; T426-E430 VanDerWaalsContact O-CB 3.29Å; T426-E430 WeakPolarHBondContact O-CB 3.35Å; T426-E430 WeakPolarHBondContact O-CG 3.16Å; T426-E430 PolarHBondContact O-N 2.81Å; R427-E430 PolarHBondContact O-N 2.69Å; E430-H432 VanDerWaalsContact C-N 3.34Å; E430-A433 WeakPolarHBondContact O-CB 3.26Å; E430-A433 PolarHBondContact O-N 3.37Å
431	F	36.4	Very low	39.2	Very low	120 Å²	120	99 Å²	99	53%	0.526	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-24.8	-176.9	-151.3	-107.7	0	0	0	110.9	R427 A433	R427-F431 HydrophobicContact CB-CB 3.86Å; R427-F431 HydrophobicContact CB-CD2 4.36Å; R427-F431 HydrophobicContact CB-CG 4.37Å; R427-F431 HydrophobicContact CG-CB 4.39Å; R427-F431 HydrophobicContact CG-CD2 4.17Å; R427-F431 VanDerWaalsContact O-CA 3.29Å; R427-F431 WeakPolarHBondContact O-CA 3.25Å; R427-F431 WeakPolarHBondContact O-CB 3.41Å; R427-F431 PolarHBondContact O-N 2.87Å; F431-A433 PolarHBondContact O-N 3.19Å
432	H	41.9	Very low	38.5	Very low	49 Å²	49	106 Å²	106	23%	0.227	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	51.9	157	-64.3	-86.7	0	0	0	111.7	V265 F268 D428 E430	V265-H432 PolarHBondContact O-ND1 2.83Å; F268-H432 HydrophobicContact CD2-CB 4.35Å; F268-H432 WeakPolarHBondContact CD2-O 3.17Å; F268-H432 VanDerWaalsContact CE2-O 3.24Å; F268-H432 WeakPolarHBondContact CE2-O 3.35Å; F268-H432 VanDerWaalsContact CG-C 3.47Å; D428-H432 PolarHBondContact O-CD2 3.5Å; E430-H432 VanDerWaalsContact C-N 3.34Å
433	A	37.4	Very low	37.8	Very low	24 Å²	24	112.5 Å²	112.5	20%	0.198	54%	0.544	C	S	.	.	T	Hydrogen-bonded Turn	trans	-150.4	-26.7	173.7	0	0	0	0	0	115.8	F268 E430 F431	F268-A433 VanDerWaalsContact CD1-O 3.31Å; F268-A433 WeakPolarHBondContact CD1-O 3.44Å; F268-A433 VanDerWaalsContact CE1-C 3.48Å; F268-A433 WeakPolarHBondContact CE1-O 3.4Å; E430-A433 WeakPolarHBondContact O-CB 3.26Å; E430-A433 PolarHBondContact O-N 3.37Å; F431-A433 PolarHBondContact O-N 3.19Å
434	V	33.7	Very low	37	Very low	81 Å²	81	117.5 Å²	117.5	49%	0.491	56%	0.561	S	S	.	*			trans	-147.8	88.7	-172.3	-165.6	0	0	0	0	114.9	M666	V434-M666 HydrophobicContact CG1-CE 3.63Å
435	Q	29.4	Very low	35.9	Very low	147 Å²	147	125.3 Å²	125.3	69%	0.687	58%	0.584	S	S	*	*			trans	-144.9	115.3	150.4	-81.5	-62.5	-9.1	0	0	109.2
436	D	30.5	Very low	35	Very low	137 Å²	137	126.9 Å²	126.9	73%	0.733	61%	0.613	S	S	*	*			trans	-150.7	82.4	177.5	179.3	25.7	0	0	0	111.2
437	K	30.7	Very low	33.9	Very low	197 Å²	197	131.5 Å²	131.5	86%	0.857	64%	0.637	S	S	*	*			trans	-152.7	117	163.4	-72.4	-160.8	178	-173.8	0	111.5
438	K	35.2	Very low	32.6	Very low	203 Å²	203	135.9 Å²	135.9	88%	0.883	66%	0.659	S	S	*	*			trans	-83	146.4	157.6	-69.9	-170.5	176.2	-171.2	0	110.6
439	P	29.2	Very low	31.6	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	67%	0.673	S	S	*	*				-113.2	124.9	125.2	32.9	-27	0	0	0	108.2
440	K	26.6	Very low	30.6	Very low	199 Å²	199	146.5 Å²	146.5	87%	0.865	71%	0.709	S	S	*	*				50.7	102.9	80.6	-84.4	-158.1	169.7	-166.7	0	112.6
441	E	28.1	Very low	29.6	Very low	195 Å²	195	152.6 Å²	152.6	91%	0.911	73%	0.729	S	S	*	*			trans	-65.2	151.5	163.9	-63.8	152.1	115.2	0	0	110.7
442	Q	26.9	Very low	29.6	Very low	195 Å²	195	151.6 Å²	151.6	91%	0.911	74%	0.735	S	S	*	*			trans	-147.9	122.4	147.8	-163	164.4	19.7	0	0	109.4
443	E	31.1	Very low	28.7	Very low	175 Å²	175	157.6 Å²	157.6	82%	0.818	76%	0.76	S	S	*	*			trans	-74.2	140.1	177.7	-179.5	-173.3	-170.2	0	0	111.1
444	K	28.7	Very low	28.1	Very low	212 Å²	212	161.2 Å²	161.2	92%	0.922	78%	0.784	S	S	*	*			trans	-159.1	143.7	143.1	-116.2	167.5	-172.1	-178.7	0	113.6
445	R	27	Very low	27.8	Very low	221 Å²	221	166.2 Å²	166.2	83%	0.834	80%	0.799	S	S	*	*			trans	-87.3	151.5	-174.8	-171.1	-177.8	-174.5	176.2	5	111.2
446	G	25.3	Very low	27.6	Very low	74 Å²	74	167.4 Å²	167.4	76%	0.763	80%	0.802	S	S	*	*			trans	-177.4	101.4	173.9	0	0	0	0	0	112.1
447	D	25.8	Very low	27.3	Very low	125 Å²	125	167.2 Å²	167.2	67%	0.668	80%	0.8	S	S	*	*			trans	-75.4	154.5	178.4	-54.4	-87.6	0	0	0	112.2
448	F	25.3	Very low	27.1	Very low	205 Å²	205	163.6 Å²	163.6	90%	0.899	79%	0.79	S	S	*	*				-176.2	163.6	117.5	-106.8	-76	0	0	0	112.1
449	L	24.9	Very low	26.8	Very low	140 Å²	140	162.1 Å²	162.1	73%	0.733	78%	0.784	S	S	*	*			trans	-106.8	142.6	-167	-63.3	147.6	0	0	0	112.2
450	H	25.4	Very low	26.6	Very low	182 Å²	182	163.5 Å²	163.5	84%	0.843	79%	0.785	S	S	*	*				172.3	157.2	108.1	-103.4	-87	0	0	0	116.3
451	R	21.3	Very low	26.6	Very low	207 Å²	207	162.2 Å²	162.2	78%	0.781	79%	0.787	S	S	*	*			trans	-85.4	-175.7	170.8	-111.7	179.2	180	-178.9	1.6	110.9
452	P	36.6	Very low	26.8	Very low	100 Å²	100	157.9 Å²	157.9	65%	0.649	78%	0.775	S	S	*	*			cis	-140.5	-179.9	-2.5	24.5	2	0	0	0	117.7
453	F	23.5	Very low	26.7	Very low	175 Å²	175	153.4 Å²	153.4	77%	0.768	77%	0.766	S	S	*	*			trans	27.5	137.2	148.5	-62.1	-60.9	0	0	0	122
454	S	24.7	Very low	26.5	Very low	100 Å²	100	153.7 Å²	153.7	70%	0.699	77%	0.767	S	S	*	*				-173.2	152.5	68.8	-68.6	0	0	0	0	116.2
455	K	26.9	Very low	26.3	Very low	186 Å²	186	153.1 Å²	153.1	81%	0.809	76%	0.764	S	S	*	*			trans	24.6	147.1	131.2	-58.4	166.7	-176.4	168.4	0	119.4
456	K	25.5	Very low	26.2	Very low	172 Å²	172	151 Å²	151	75%	0.748	76%	0.764	S	S	*	*			cis	-175.8	164.8	12.6	-125.8	179.8	164.7	-165.4	0	111.3
457	L	25.8	Very low	27.5	Very low	133 Å²	133	152.9 Å²	152.9	70%	0.696	76%	0.763	S	S	*	*			trans	62.2	158	160.2	-86	55.2	0	0	0	117
458	D	26	Very low	27.5	Very low	120 Å²	120	153 Å²	153	64%	0.642	77%	0.773	S	S	*	*			cis	-142.1	141.9	-11.8	-102.1	-42.5	0	0	0	107.9
459	K	28.7	Very low	27.6	Very low	173 Å²	173	147.8 Å²	147.8	75%	0.752	77%	0.768	S	S	*	*				62.9	111.7	79.2	-79.9	-172.2	171.8	-178.6	0	118.5
460	N	25.3	Very low	27.6	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	77%	0.771	S	S	*	*			trans	65.9	118	140.9	-55.8	-14.5	0	0	0	121.8
461	L	26.1	Very low	27.7	Very low	172 Å²	172	145.4 Å²	145.4	90%	0.901	77%	0.77	S	S	*	*				-163.2	150.1	117.1	-154.6	60.7	0	0	0	111.2
462	P	32.6	Very low	28	Very low	103 Å²	103	143.5 Å²	143.5	67%	0.669	77%	0.772	S	S	*	*			trans	-121.4	158.1	-171.1	42.6	-33.1	0	0	0	117.8
463	S	24.6	Very low	27.6	Very low	102 Å²	102	144.4 Å²	144.4	71%	0.713	78%	0.776	S	S	*	*			trans	55.9	136	138.2	68.2	0	0	0	0	124.6
464	H	26.5	Very low	27.7	Very low	180 Å²	180	143.4 Å²	143.4	83%	0.833	77%	0.774	S	S	*	*			trans	77.2	113.4	140.9	-106.9	-80.1	0	0	0	121.6
465	K	25.3	Very low	27.9	Very low	200 Å²	200	147 Å²	147	87%	0.87	78%	0.783	S	S	*	*				-177.7	169.1	113.4	-99.5	171.9	-174.8	-179.9	0	113.5
466	Q	25.4	Very low	28	Very low	177 Å²	177	144.5 Å²	144.5	83%	0.827	78%	0.775	S	S	*	*			trans	-146.3	172.5	170.2	-85.3	-133.7	-5.3	0	0	107.3
467	P	50.8	Low	28.1	Very low	114 Å²	114	142.5 Å²	142.5	74%	0.74	77%	0.772	S	S	*	*			cis	-127.6	-178.2	-34.9	36.1	-20.4	0	0	0	111.8
468	S	26.4	Very low	28.2	Very low	127 Å²	127	141.1 Å²	141.1	89%	0.888	77%	0.769	S	S	*	*			trans	-152.5	174.6	163.1	61.9	0	0	0	0	111.6
469	A	27.6	Very low	28.4	Very low	96 Å²	96	146.4 Å²	146.4	79%	0.793	78%	0.78	S	S	*	*			trans	-140.2	177.6	-160.2	0	0	0	0	0	114.7
470	S	25.8	Very low	28.5	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	77%	0.773	S	S	*	*			trans	71.2	155.7	178.7	-114	0	0	0	0	115.1
471	L	26.1	Very low	28.7	Very low	157 Å²	157	142.1 Å²	142.1	82%	0.822	78%	0.775	S	S	*	*			cis	-148.2	167.8	16.8	-168.5	70.2	0	0	0	110.3
472	M	28.3	Very low	28.9	Very low	166 Å²	166	141.5 Å²	141.5	82%	0.818	77%	0.772	S	S	*	*			trans	-76	160	161.8	-68.6	-164.1	-70.5	0	0	111.6
473	T	27.1	Very low	28.7	Very low	120 Å²	120	145.8 Å²	145.8	74%	0.736	78%	0.78	S	S	*	*				159.5	113.6	119.2	-65.6	0	0	0	0	112.6
474	Q	27.2	Very low	29	Very low	154 Å²	154	147.3 Å²	147.3	72%	0.72	78%	0.78	S	S	*	*			trans	30	128.1	137.5	-172.6	-178.2	-2.7	0	0	121.2
475	I	28.9	Very low	29.2	Very low	174 Å²	174	149.6 Å²	149.6	89%	0.892	78%	0.781	S	S	*	*			trans	-151.1	156.4	142	-106.9	155.5	0	0	0	109.3
476	Q	27.5	Very low	29.4	Very low	135 Å²	135	149.2 Å²	149.2	63%	0.631	78%	0.78	S	S	*	*			trans	-112.9	177.5	-170	-59.2	175	-33.5	0	0	112.8
477	N	28.5	Very low	29.6	Very low	130 Å²	130	145 Å²	145	70%	0.695	78%	0.776	S	S	*	*			trans	76.7	149.7	150.3	-63.5	-31.9	0	0	0	116.8
478	T	28.1	Very low	28.5	Very low	103 Å²	103	145 Å²	145	63%	0.632	78%	0.778	S	S	*	*			cis	-161	166.4	6.3	-2.8	0	0	0	0	113.5
479	R	30.3	Very low	28.6	Very low	231 Å²	231	148.5 Å²	148.5	87%	0.872	78%	0.777	S	S	*	*			trans	71.5	157.7	147	-73	160.1	-176.1	172.6	0.8	119.5
480	A	30.9	Very low	28.5	Very low	74 Å²	74	149.7 Å²	149.7	61%	0.612	78%	0.78	S	S	*	*			cis	-175.1	161.1	-29.1	0	0	0	0	0	112
481	L	29.5	Very low	28.5	Very low	154 Å²	154	149.8 Å²	149.8	81%	0.806	78%	0.781	S	S	*	*			trans	63.2	126.6	159.7	-61.5	141.1	0	0	0	117.1
482	L	29.3	Very low	28.6	Very low	159 Å²	159	151.5 Å²	151.5	83%	0.832	78%	0.782	S	S	*	*			cis	91.6	120.2	35	-71.8	172	0	0	0	115.7
483	K	27.8	Very low	29.5	Very low	193 Å²	193	148.7 Å²	148.7	84%	0.839	78%	0.776	S	S	*	*			trans	-179.7	146	152.3	-100.5	179.5	178.6	179.6	0	108.1
484	D	31.8	Very low	29.6	Very low	135 Å²	135	148.3 Å²	148.3	72%	0.722	77%	0.769	S	S	*	*			cis	-165.9	170.2	-19	-146	-35.6	0	0	0	111.1
485	R	31.2	Very low	29.9	Very low	227 Å²	227	148 Å²	148	86%	0.857	77%	0.766	S	S	*	*			trans	70	163	165.2	-60	169.5	66.9	155	0.1	120.6
486	K	28.8	Very low	29.8	Very low	192 Å²	192	145.6 Å²	145.6	84%	0.835	76%	0.755	S	S	*	*				-171.2	111.5	-51.2	-165.7	166.2	-177.9	176.8	0	112.1
487	A	29.4	Very low	30	Very low	90 Å²	90	143.1 Å²	143.1	74%	0.744	75%	0.752	S	S	*	*			trans	53	153.5	147.3	0	0	0	0	0	126.1
488	S	27.7	Very low	30	Very low	112 Å²	112	146.4 Å²	146.4	78%	0.783	76%	0.761	S	S	*	*			trans	87.8	99.4	141.5	61.4	0	0	0	0	125.7
489	K	29.1	Very low	29.9	Very low	201 Å²	201	144.6 Å²	144.6	87%	0.874	76%	0.762	S	S	*	*				57	149.9	122.3	-78.8	-171.5	173.6	-176.1	0	125.1
490	S	25.3	Very low	29.9	Very low	122 Å²	122	139 Å²	139	85%	0.853	76%	0.757	S	S	*	*			trans	68.2	151.5	167.2	56.7	0	0	0	0	117.7
491	S	25	Very low	29.8	Very low	117 Å²	117	145.9 Å²	145.9	82%	0.818	77%	0.767	S	S	*	*			cis	-143.7	165.7	7.3	-168.4	0	0	0	0	113.7
492	F	28.4	Very low	29.7	Very low	192 Å²	192	144.5 Å²	144.5	84%	0.842	76%	0.761	S	S	*	*			trans	-82.6	177	159	-89	-74.7	0	0	0	110.6
493	P	48	Very low	29.7	Very low	108 Å²	108	143.1 Å²	143.1	70%	0.701	75%	0.753	S	S	*	*			cis	-134.6	-161.1	22.1	45.2	-24.4	0	0	0	114
494	D	28.9	Very low	29.7	Very low	112 Å²	112	142.3 Å²	142.3	60%	0.599	75%	0.749	S	S	*	*			cis	-156.9	158.4	6.7	-143.4	0.8	0	0	0	113.2
495	K	32.9	Very low	29.5	Very low	147 Å²	147	145.7 Å²	145.7	64%	0.639	75%	0.752	S	S	*	*			trans	36.4	156.3	147.6	-77	178.1	-157.9	76.4	0	124
496	D	28.1	Very low	29.2	Very low	124 Å²	124	143.5 Å²	143.5	66%	0.663	75%	0.749	S	S	*	*			cis	-136.8	143.4	-2.6	-96.9	-50	0	0	0	108.4
497	S	31.6	Very low	29.1	Very low	82 Å²	82	139.6 Å²	139.6	57%	0.573	74%	0.741	S	S	*	*				76.7	137	62.5	-142.5	0	0	0	0	113.5
498	F	28.7	Very low	29.1	Very low	200 Å²	200	139.8 Å²	139.8	88%	0.877	74%	0.737	S	S	*	*			cis	-136.1	169.7	8.5	-76.9	-94.5	0	0	0	110.3
499	G	26.2	Very low	29.1	Very low	64 Å²	64	141.7 Å²	141.7	66%	0.66	74%	0.739	S	S	*	*			cis	166.3	164.3	-6.6	0	0	0	0	0	113.8
500	C	28.7	Very low	29	Very low	114 Å²	114	136.6 Å²	136.6	77%	0.77	73%	0.728	S	S	*	*			trans	67.3	118.5	165.5	-69.4	0	0	0	0	119.7
501	R	29	Very low	29.1	Very low	219 Å²	219	137.9 Å²	137.9	83%	0.826	73%	0.725	S	S	*	*				75.8	140.9	77.6	-73	-177.8	175.4	-177.2	-0	113.7
502	N	29	Very low	29.2	Very low	125 Å²	125	138 Å²	138	67%	0.668	73%	0.725	S	S	*	*			cis	-160.7	149.1	1.4	-116.1	-0.7	0	0	0	113.7
503	I	29.2	Very low	29.2	Very low	129 Å²	129	136 Å²	136	66%	0.662	73%	0.729	S	S	*	*			trans	10.5	122.2	145.3	-31	169	0	0	0	119.7
504	F	27.2	Very low	28.3	Very low	176 Å²	176	135.4 Å²	135.4	77%	0.772	73%	0.732	S	S	*	*				-179.9	171.1	112.4	-113.1	-89.1	0	0	0	116.3
505	R	26.9	Very low	28.3	Very low	207 Å²	207	135.4 Å²	135.4	78%	0.781	74%	0.741	S	S	*	*			trans	-62.3	159.2	-165.4	-64.4	164.3	168.2	160.6	-6.1	119.4
506	K	26.1	Very low	28.2	Very low	180 Å²	180	133.8 Å²	133.8	78%	0.783	75%	0.748	S	S	*	*				102.2	144.1	125	-109.1	-168.9	177	-167.4	0	121.8
507	T	26.2	Very low	28.3	Very low	111 Å²	111	133.1 Å²	133.1	68%	0.681	75%	0.754	S	S	*	*			trans	61.6	106.4	149.6	43.5	0	0	0	0	122.4
508	S	28.2	Very low	28.3	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	77%	0.77	S	S	*	*				60.1	147.2	122.2	75.2	0	0	0	0	123.9
509	D	27.9	Very low	28.4	Very low	152 Å²	152	137.4 Å²	137.4	81%	0.813	77%	0.769	S	S	*	*			trans	87.5	152.3	153.5	-51.2	-46.5	0	0	0	121.3
510	S	28.2	Very low	28.4	Very low	93 Å²	93	143.8 Å²	143.8	65%	0.65	78%	0.779	S	S	*	*			trans	-49.6	147	-165.8	43.6	0	0	0	0	118.6
511	N	27.1	Very low	28.5	Very low	149 Å²	149	145.5 Å²	145.5	80%	0.797	78%	0.779	S	S	*	*				-173.4	174.6	98.5	-99.3	-53.5	0	0	0	115.7
512	C	27.1	Very low	28.6	Very low	121 Å²	121	140.4 Å²	140.4	82%	0.818	77%	0.774	S	S	*	*			trans	-71.5	156.7	-174	-53	0	0	0	0	114.9
513	V	28.6	Very low	28.8	Very low	150 Å²	150	140.7 Å²	140.7	91%	0.909	78%	0.78	S	S	*	*			trans	-130.9	151.8	160.2	-179.6	0	0	0	0	109.8
514	A	27.5	Very low	29.1	Very low	94 Å²	94	139.8 Å²	139.8	78%	0.777	78%	0.783	S	S	*	*			trans	-75.9	167.8	-157.4	0	0	0	0	0	117.3
515	S	28.8	Very low	29.6	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	78%	0.782	S	S	*	*			trans	-64.3	147.4	162.1	172.9	0	0	0	0	111.7
516	S	31.7	Very low	29.9	Very low	113 Å²	113	133.2 Å²	133.2	79%	0.79	79%	0.785	S	S	*	*			trans	-116.7	138.4	155.7	55.8	0	0	0	0	110.3
517	S	29.3	Very low	30.1	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	79%	0.792	S	S	*	*			trans	-83.8	154.9	171.3	-54.2	0	0	0	0	110.4
518	M	32.8	Very low	30.4	Very low	187 Å²	187	137.4 Å²	137.4	92%	0.921	80%	0.798	S	S	*	*			trans	-119	145.4	162	-90.1	-162.7	72	0	0	110.4
519	E	31	Very low	30.6	Very low	184 Å²	184	139 Å²	139	86%	0.86	81%	0.806	S	S	*	*			trans	-90.7	165.7	-165.7	-61	174.4	127.4	0	0	113
520	F	26.3	Very low	30.6	Very low	199 Å²	199	143.3 Å²	143.3	87%	0.873	81%	0.811	S	S	*	*			trans	-103.9	111.2	-170.4	-150.2	-90.2	0	0	0	110.4	P522	F520-P522 WeakPolarHBondContact O-CD 3.47Å
521	I	29.4	Very low	30.5	Very low	150 Å²	150	146.5 Å²	146.5	77%	0.769	82%	0.819	S	S	*	*			trans	-95.6	115.7	178.1	-57.4	177.8	0	0	0	109.6
522	P	31.8	Very low	30.6	Very low	111 Å²	111	146.1 Å²	146.1	72%	0.721	82%	0.822	S	S	*	*			trans	-80.2	139.1	178.4	31.7	-33.7	0	0	0	112.2	F520	F520-P522 WeakPolarHBondContact O-CD 3.47Å
523	V	33.6	Very low	30.5	Very low	131 Å²	131	149.1 Å²	149.1	79%	0.794	82%	0.821	S	S	*	*			trans	-107.6	133	177	-179.6	0	0	0	0	109.6
524	P	35.6	Very low	30.3	Very low	110 Å²	110	150.6 Å²	150.6	71%	0.714	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.4	154.1	-177.4	30.8	-35.8	0	0	0	113.5
525	P	37.3	Very low	30.4	Very low	115 Å²	115	151.7 Å²	151.7	75%	0.747	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-77.5	155.3	-177.1	31.8	-36.1	0	0	0	113.8
526	P	32.4	Very low	30.2	Very low	131 Å²	131	154 Å²	154	85%	0.851	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.9	154.4	178.8	30.7	-35.5	0	0	0	113.2
527	R	31.6	Very low	29.9	Very low	247 Å²	247	153.9 Å²	153.9	93%	0.932	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-86.8	147.1	-176.4	-63.2	174.4	178.2	165.4	-1.6	112.4
528	T	31.5	Very low	29.8	Very low	131 Å²	131	157.8 Å²	157.8	80%	0.804	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.8	144.8	170.2	45.1	0	0	0	0	112.2
529	P	32.1	Very low	29.6	Very low	128 Å²	128	157.7 Å²	157.7	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76	157.3	170.3	32	-33.9	0	0	0	111.8
530	R	28.3	Very low	29.7	Very low	242 Å²	242	155.3 Å²	155.3	91%	0.913	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.9	150.3	-175.7	-71.2	178.3	172.1	172.3	-4.1	112.8
531	I	27.3	Very low	29.7	Very low	160 Å²	160	148.6 Å²	148.6	82%	0.821	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-78.9	141.7	171.6	-63.9	166.8	0	0	0	110.1
532	V	28.3	Very low	29.5	Very low	141 Å²	141	147.9 Å²	147.9	86%	0.855	81%	0.81	S	S	*	*			trans	-114.6	152.8	167.5	-179.6	0	0	0	0	108.6
533	K	25.3	Very low	29.4	Very low	185 Å²	185	146.5 Å²	146.5	80%	0.804	82%	0.817	S	S	*	*			trans	-123.8	161.5	-171.1	-81.6	-170.3	173.4	-173.2	0	113.4
534	K	24.5	Very low	29	Very low	180 Å²	180	145.7 Å²	145.7	78%	0.783	82%	0.817	S	S	*	*			trans	75.1	158.9	161.3	-88.9	-158.3	163.4	-162.1	0	117.7
535	P	30.8	Very low	28.8	Very low	117 Å²	117	147.2 Å²	147.2	76%	0.76	82%	0.824	S	S	*	*			cis	-118.1	-176.1	-2.6	31.9	-12.8	0	0	0	114.9
536	E	22.9	Very low	28.3	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.762	83%	0.827	S	S	*	*			trans	-97.4	156.4	-176.9	-55.8	125.3	110.9	0	0	113.9
537	S	25.7	Very low	28.2	Very low	109 Å²	109	147 Å²	147	76%	0.762	83%	0.826	S	S	*	*			trans	-158.8	120	153.4	49	0	0	0	0	115.1
538	H	27.6	Very low	28.5	Very low	192 Å²	192	140.4 Å²	140.4	89%	0.889	82%	0.815	S	S	*	*			trans	30.3	132.2	150.2	-56.1	-77.4	0	0	0	124.6
539	Q	27.5	Very low	28.4	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.864	82%	0.815	S	S	*	*			trans	-80.9	159.8	151.9	-61.6	-172.8	-14.9	0	0	110.9
540	P	34	Very low	28.1	Very low	135 Å²	135	146.5 Å²	146.5	88%	0.877	82%	0.82	S	S	*	*				-135.5	179.1	71.5	34.5	-16.3	0	0	0	113.4
541	G	26.2	Very low	28.1	Very low	58 Å²	58	143.1 Å²	143.1	60%	0.598	82%	0.815	S	S	*	*			cis	161.8	150.9	-8	0	0	0	0	0	112.5
542	S	26.3	Very low	28.1	Very low	134 Å²	134	143 Å²	143	94%	0.937	82%	0.816	S	S	*	*			trans	49.4	124.6	164.2	61.4	0	0	0	0	121.9
543	G	27.8	Very low	28.7	Very low	83 Å²	83	141 Å²	141	86%	0.856	81%	0.806	S	S	*	*			trans	-174.6	137.3	161.5	0	0	0	0	0	111.8
544	S	26.9	Very low	28.9	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	81%	0.806	S	S	*	*			trans	-142.2	175.1	-175	-171.4	0	0	0	0	111.9
545	T	30	Very low	28.9	Very low	142 Å²	142	138.2 Å²	138.2	87%	0.871	80%	0.804	S	S	*	*			trans	74.5	148	-173.6	76.2	0	0	0	0	115.1
546	G	27.7	Very low	28.9	Very low	78 Å²	78	139.9 Å²	139.9	80%	0.804	81%	0.806	S	S	*	*			cis	-170	158.3	-3.2	0	0	0	0	0	114.4
547	I	29.1	Very low	29.2	Very low	162 Å²	162	139.9 Å²	139.9	83%	0.831	81%	0.811	S	S	*	*			trans	-73.5	156.3	177.2	-78.7	163.7	0	0	0	110.8
548	P	39.3	Very low	29.2	Very low	109 Å²	109	142.4 Å²	142.4	71%	0.708	81%	0.813	S	S	*	*			cis	-145.7	172.6	35.8	25.7	1.8	0	0	0	121.6
549	H	28.2	Very low	29.2	Very low	173 Å²	173	139.1 Å²	139.1	80%	0.801	81%	0.806	S	S	*	*			trans	11.5	138	147.5	-63.4	-91.4	0	0	0	124.1
550	K	27.2	Very low	29.2	Very low	214 Å²	214	141.5 Å²	141.5	93%	0.93	81%	0.807	S	S	*	*				-158.2	165.7	116.9	-126	176.9	-179	-178.9	0	112.8
551	E	26.8	Very low	28.9	Very low	172 Å²	172	140.2 Å²	140.2	80%	0.804	80%	0.802	S	S	*	*			trans	-114.3	144.3	-174	-58.6	174.8	138.5	0	0	112.3
552	D	27.4	Very low	29	Very low	156 Å²	156	146.5 Å²	146.5	83%	0.834	81%	0.813	S	S	*	*			trans	49.8	163	145.7	-84.1	17.1	0	0	0	123
553	P	42.3	Very low	29.1	Very low	101 Å²	101	148.8 Å²	148.8	66%	0.656	81%	0.809	S	S	*	*			cis	-134.5	-166.8	-24.7	30.4	-8.1	0	0	0	113.4
554	L	28.8	Very low	29.1	Very low	152 Å²	152	149.9 Å²	149.9	80%	0.796	80%	0.803	S	S	*	*			trans	113.9	113.1	151.7	-60.6	177.3	0	0	0	120
555	M	25.3	Very low	29.1	Very low	153 Å²	153	151.6 Å²	151.6	75%	0.754	81%	0.808	S	S	*	*				47.8	125.1	125	-64.1	-70.8	-86.2	0	0	122.5
556	L	29.7	Very low	28.9	Very low	153 Å²	153	151.9 Å²	151.9	80%	0.801	81%	0.805	S	S	*	*			trans	58.5	112.5	150.1	-94	66.5	0	0	0	119.3
557	D	29	Very low	29	Very low	163 Å²	163	156.9 Å²	156.9	87%	0.872	80%	0.799	S	S	*	*				-142	158.7	124.6	-163	8.2	0	0	0	110.4
558	M	25.6	Very low	28.9	Very low	162 Å²	162	156 Å²	156	80%	0.798	80%	0.796	S	S	*	*			trans	-153.6	120.5	179.1	-152.2	-167.9	-68.1	0	0	114.3
559	V	28.4	Very low	28.3	Very low	123 Å²	123	156.2 Å²	156.2	75%	0.745	79%	0.791	S	S	*	*			trans	86.7	130.4	164.9	-160.5	0	0	0	0	117.6
560	R	27.7	Very low	28.3	Very low	235 Å²	235	157 Å²	157	89%	0.887	80%	0.795	S	S	*	*			trans	100.4	124	174.9	-61	174.9	-169.4	-176	4.1	112.5
561	S	28	Very low	28.3	Very low	108 Å²	108	153.7 Å²	153.7	76%	0.755	79%	0.786	S	S	*	*			cis	-149.6	-173.7	2.8	-87.6	0	0	0	0	112
562	F	26.7	Very low	28.2	Very low	190 Å²	190	154.3 Å²	154.3	83%	0.833	79%	0.789	S	S	*	*			trans	-51.1	164.1	166.5	-64.5	-95.9	0	0	0	111.9
563	E	28.2	Very low	28.2	Very low	182 Å²	182	152.3 Å²	152.3	85%	0.85	78%	0.782	S	S	*	*			cis	-155.1	-162	38.5	-153.8	146.6	-125.5	0	0	114.1
564	S	28.4	Very low	27.5	Very low	106 Å²	106	155.7 Å²	155.7	74%	0.741	79%	0.794	S	S	*	*			trans	-82.3	143.2	-164.2	53.4	0	0	0	0	116.7
565	V	27.5	Very low	27.4	Very low	149 Å²	149	152.7 Å²	152.7	90%	0.903	79%	0.786	S	S	*	*			trans	-137.8	156.2	151.4	-171	0	0	0	0	108.7
566	D	26.6	Very low	28	Very low	149 Å²	149	151.3 Å²	151.3	80%	0.797	79%	0.788	S	S	*	*			trans	-81.7	-176.2	-172.3	-122.9	-60.5	0	0	0	115.1
567	R	28	Very low	27.8	Very low	182 Å²	182	147.8 Å²	147.8	69%	0.687	78%	0.776	S	S	*	*			trans	-51.4	151.9	-176.7	-59	174.1	63.3	-156.9	-1.4	115.4	D569	R567-D569 IonicContact CZ-OD2 3.81Å; R567-D569 IonicContact NE-OD2 2.76Å; R567-D569 IonicContact NH2-OD2 3.18Å; R567-D569 PolarHBondContact NH2-OD2 3.09Å
568	D	26.9	Very low	27.7	Very low	144 Å²	144	149 Å²	149	77%	0.77	78%	0.776	S	S	*	*				-152.6	157.7	113.5	-124.1	-31.3	0	0	0	113.4
569	D	27.7	Very low	27.7	Very low	113 Å²	113	148.6 Å²	148.6	60%	0.604	77%	0.772	S	S	*	*			trans	-106.4	112.9	-176.2	-76.5	-78	0	0	0	111.6	R567	R567-D569 IonicContact CZ-OD2 3.81Å; R567-D569 IonicContact NE-OD2 2.76Å; R567-D569 IonicContact NH2-OD2 3.18Å; R567-D569 PolarHBondContact NH2-OD2 3.09Å
570	H	27.8	Very low	27.6	Very low	189 Å²	189	154 Å²	154	88%	0.875	78%	0.781	S	S	*	*			trans	-106.7	136.7	174.9	-92	-79	0	0	0	113.6
571	I	26.8	Very low	27.6	Very low	145 Å²	145	154 Å²	154	74%	0.744	78%	0.781	S	S	*	*			trans	-118.4	117.1	-177.3	-63	171.9	0	0	0	110.1	V573	I571-V573 HydrophobicContact CG2-CG2 3.8Å
572	E	26.1	Very low	27.5	Very low	186 Å²	186	156.1 Å²	156.1	87%	0.869	78%	0.782	S	S	*	*			trans	-143	130.7	148.4	-91.5	179.6	172.1	0	0	106
573	V	25.8	Very low	27.4	Very low	113 Å²	113	155.2 Å²	155.2	69%	0.685	79%	0.785	S	S	*	*			cis	70.3	80.8	33.5	-167.1	0	0	0	0	113.1	I571	I571-V573 HydrophobicContact CG2-CG2 3.8Å
574	L	28.1	Very low	27.3	Very low	172 Å²	172	153.4 Å²	153.4	90%	0.901	78%	0.781	S	S	*	*				-156.3	158.3	117.4	-106.2	169.2	0	0	0	111.2
575	S	28.1	Very low	27.2	Very low	90 Å²	90	153.4 Å²	153.4	63%	0.629	78%	0.781	S	S	*	*			trans	-130.3	162.9	177.6	-168.8	0	0	0	0	108.5	S577	S575-S577 PolarHBondContact OG-N 3.45Å
576	P	36.2	Very low	27.8	Very low	124 Å²	124	151.5 Å²	151.5	81%	0.805	77%	0.772	S	S	*	*				-137.1	112.2	112.7	22.2	-3.4	0	0	0	113.9
577	S	25.7	Very low	28	Very low	78 Å²	78	150.9 Å²	150.9	55%	0.545	77%	0.773	S	S	.	*			trans	9.1	135.1	132.6	57.1	0	0	0	0	119.3	S575	S575-S577 PolarHBondContact OG-N 3.45Å
578	H	27.8	Very low	27.9	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.875	78%	0.78	S	S	*	*				-143.8	157.7	124.9	-107.7	74.7	0	0	0	110.6
579	H	25.3	Very low	28	Very low	153 Å²	153	148.4 Å²	148.4	71%	0.708	78%	0.782	S	S	*	*			trans	-89.1	147.7	-161.7	-57.5	-65.8	0	0	0	115.4
580	Y	26.2	Very low	28	Very low	238 Å²	238	148 Å²	148	93%	0.933	79%	0.794	S	S	*	*			trans	-133.1	136.4	136.1	-93.4	-82.8	0	0	0	109.9
581	R	27.3	Very low	28	Very low	235 Å²	235	150.2 Å²	150.2	89%	0.887	80%	0.795	S	S	*	*			trans	-89.7	136.1	177.6	-69.1	178.2	178.9	149.2	-0.2	110
582	I	25.6	Very low	28	Very low	152 Å²	152	155.1 Å²	155.1	78%	0.779	80%	0.804	S	S	*	*			trans	-105.3	131.3	161.8	-60.9	175.4	0	0	0	107.3
583	L	26.1	Very low	28	Very low	171 Å²	171	153.3 Å²	153.3	90%	0.895	80%	0.801	S	S	*	*			trans	-126.8	145	159.1	-78.6	175.2	0	0	0	108.1
584	N	24.5	Very low	28.2	Very low	143 Å²	143	153.4 Å²	153.4	77%	0.765	81%	0.806	S	S	*	*			trans	-153.4	152.5	-173.4	-152.6	-4.8	0	0	0	109.3
585	S	27.8	Very low	28.3	Very low	106 Å²	106	149.9 Å²	149.9	74%	0.741	80%	0.796	S	S	*	*			trans	69	163.9	178.4	86.2	0	0	0	0	117.1
586	P	40.4	Very low	28.4	Very low	110 Å²	110	152.6 Å²	152.6	71%	0.714	80%	0.799	S	S	*	*			cis	-136.8	158.2	-32.4	26.7	-5.8	0	0	0	116.5
587	V	29.7	Very low	28.3	Very low	136 Å²	136	156.7 Å²	156.7	82%	0.824	80%	0.798	S	S	*	*			trans	18.5	124.6	139.9	-174.6	0	0	0	0	120.8
588	S	26.9	Very low	28.5	Very low	118 Å²	118	158.1 Å²	158.1	83%	0.825	80%	0.803	S	S	*	*				-163	171.3	129.2	-158.6	0	0	0	0	112.8
589	L	28.8	Very low	28.6	Very low	155 Å²	155	157 Å²	157	81%	0.812	80%	0.803	S	S	*	*			trans	-106.5	156.6	-170	-64	89	0	0	0	114.8
590	A	26.6	Very low	28.8	Very low	105 Å²	105	154.8 Å²	154.8	87%	0.868	81%	0.805	S	S	*	*			trans	-141.5	160.1	152.2	0	0	0	0	0	110.8
591	R	27.9	Very low	29.9	Very low	236 Å²	236	149.7 Å²	149.7	89%	0.891	80%	0.801	S	S	*	*			trans	-118.1	148.2	-172.5	-57.3	170.6	174.4	171.2	-4.5	112.5
592	R	26.7	Very low	29.8	Very low	247 Å²	247	142.2 Å²	142.2	93%	0.932	80%	0.797	S	S	*	*				-176.8	175.9	116.4	-104.2	176.5	170.1	175.3	-3.2	113.5
593	N	27.2	Very low	30.1	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	80%	0.803	S	S	*	*			trans	-111.8	-170.3	-162.4	-59.8	-2.7	0	0	0	113.1
594	S	30	Very low	31	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	80%	0.797	S	S	*	*			trans	76.6	140.5	167.3	59.6	0	0	0	0	117.2
595	S	29.4	Very low	31.2	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	80%	0.801	S	S	*	*			cis	-168.6	150.3	-8.4	39.9	0	0	0	0	112.6
596	E	30.6	Very low	31.2	Very low	146 Å²	146	138.1 Å²	138.1	68%	0.682	80%	0.802	S	S	*	*			trans	59.5	127.8	147.7	-71.2	-162.2	108.5	0	0	120.7
597	R	33.9	Very low	30.7	Very low	210 Å²	210	138 Å²	138	79%	0.792	80%	0.803	S	S	*	*				70.2	137.2	84.1	-108.3	177.9	-175.3	167.4	-4.9	112
598	T	30	Very low	30.7	Very low	108 Å²	108	139.5 Å²	139.5	66%	0.663	80%	0.804	S	S	*	*			cis	-163.7	140.3	16.2	-52.5	0	0	0	0	112.6
599	L	29.2	Very low	31	Very low	165 Å²	165	139.1 Å²	139.1	86%	0.864	80%	0.801	S	S	*	*			trans	52.5	160	154	-65.9	171.3	0	0	0	124.7
600	S	29.7	Very low	31.7	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	80%	0.801	S	S	*	*			trans	-82.6	-164	179.8	-23.8	0	0	0	0	113.2
601	P	49.3	Very low	31.8	Very low	131 Å²	131	140.2 Å²	140.2	85%	0.851	80%	0.799	S	S	*	*			cis	-137.9	-176	4.3	43.2	-24.6	0	0	0	116.6
602	G	25.3	Very low	31.9	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	80%	0.797	S	S	*	*			trans	161.4	117.5	160.1	0	0	0	0	0	117.4
603	L	32.5	Very low	32	Very low	173 Å²	173	132 Å²	132	91%	0.906	79%	0.79	S	S	*	*			trans	-104.4	167.6	161.2	-92.3	170.3	0	0	0	108.1
604	P	44.5	Very low	32.9	Very low	118 Å²	118	130.6 Å²	130.6	77%	0.766	79%	0.789	S	S	*	*			cis	-152.5	172.4	38.1	44.1	-23.2	0	0	0	120.3
605	S	29	Very low	32.6	Very low	121 Å²	121	133.6 Å²	133.6	85%	0.846	80%	0.795	S	S	*	*			trans	48.2	127.6	141.4	-154.9	0	0	0	0	123.1
606	G	27.8	Very low	32.7	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	80%	0.8	S	S	*	*			trans	-169.3	151.3	163.6	0	0	0	0	0	109.8
607	S	29.4	Very low	33.1	Very low	107 Å²	107	135.4 Å²	135.4	75%	0.748	80%	0.801	S	S	*	*			trans	-147.2	166.9	-165.1	-165.1	0	0	0	0	115.3
608	M	29.8	Very low	32.8	Very low	169 Å²	169	131.9 Å²	131.9	83%	0.833	80%	0.804	S	S	*	*			trans	84.6	146.1	170.4	-63.5	-68.2	100.3	0	0	119.9
609	S	33	Very low	32.7	Very low	109 Å²	109	134.2 Å²	134.2	76%	0.762	81%	0.811	S	S	*	*			trans	-98.2	177.9	-175.4	-40	0	0	0	0	112.4
610	P	44	Very low	32.5	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	81%	0.81	S	S	*	*				-140.3	178.1	118	37.2	-24.5	0	0	0	114.8
611	L	29.7	Very low	32.4	Very low	156 Å²	156	132.4 Å²	132.4	82%	0.817	81%	0.806	S	S	*	*			trans	-89.5	162.6	178.9	-55.3	84.7	0	0	0	112.1
612	H	29	Very low	31.2	Very low	185 Å²	185	135.2 Å²	135.2	86%	0.856	81%	0.805	S	S	*	*				-170	163.2	116.3	-113.6	-88.2	0	0	0	112.9
613	T	28.8	Very low	31.4	Very low	127 Å²	127	135.3 Å²	135.3	78%	0.779	80%	0.799	S	S	*	*			trans	-126.9	-165.4	-179.6	57.2	0	0	0	0	110.9
614	P	46.1	Very low	31.2	Very low	119 Å²	119	135 Å²	135	77%	0.773	79%	0.792	S	S	*	*				-118.5	175.9	-103.4	37.8	-20.2	0	0	0	114.8
615	L	24.6	Very low	30.3	Very low	178 Å²	178	135.8 Å²	135.8	93%	0.932	79%	0.786	S	S	*	*			trans	-140.5	148.5	173.7	-92	169.5	0	0	0	113.8
616	H	29.8	Very low	30.3	Very low	173 Å²	173	136 Å²	136	80%	0.801	78%	0.778	S	S	*	*			trans	-131.3	150.9	171.3	-116.9	-59.5	0	0	0	107.9
617	P	39.8	Very low	30.3	Very low	108 Å²	108	139 Å²	139	70%	0.701	77%	0.77	S	S	*	*				-142.3	-165.1	103	34	-13.6	0	0	0	110.9
618	T	27.3	Very low	30.1	Very low	137 Å²	137	141.1 Å²	141.1	84%	0.84	77%	0.772	S	S	*	*			cis	-147.4	165.9	9.7	-35.1	0	0	0	0	111.5
619	L	29.3	Very low	29.9	Very low	156 Å²	156	138.2 Å²	138.2	82%	0.817	77%	0.768	S	S	*	*			trans	-101.1	161.7	-177.3	-70.1	154.7	0	0	0	114.3
620	V	25	Very low	30.4	Very low	138 Å²	138	138.5 Å²	138.5	84%	0.836	77%	0.768	S	S	*	*			trans	-141.6	146.3	138.1	-177.8	0	0	0	0	108.5
621	S	26.2	Very low	30.7	Very low	98 Å²	98	138 Å²	138	69%	0.685	76%	0.764	S	S	*	*			trans	-157.8	163.6	-178.6	-172.1	0	0	0	0	112.6
622	F	23.9	Very low	30.5	Very low	190 Å²	190	141 Å²	141	83%	0.833	77%	0.771	S	S	*	*			trans	-142.7	124	162.1	-70	-87.8	0	0	0	106.3
623	A	29.8	Very low	30.6	Very low	79 Å²	79	140.7 Å²	140.7	65%	0.653	77%	0.77	S	S	*	*				69.8	133.4	52.9	0	0	0	0	0	113
624	H	28.6	Very low	30.6	Very low	166 Å²	166	143.9 Å²	143.9	77%	0.769	78%	0.776	S	S	*	*			cis	-157.6	-173.2	-10.3	-114.8	-56	0	0	0	107.5
625	E	26.3	Very low	29.7	Very low	134 Å²	134	141.9 Å²	141.9	63%	0.626	78%	0.777	S	S	*	*			cis	-128.1	-131.8	11.3	-150.4	-128.8	51.4	0	0	112.8	K627	E625-K627 IonicContact OE1-NZ 2.69Å; E625-K627 PolarHBondContact OE1-NZ 3.1Å; E625-K627 IonicContact OE2-NZ 2.69Å; E625-K627 PolarHBondContact OE2-NZ 2.69Å
626	D	28.8	Very low	29.9	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	78%	0.775	S	S	*	*			trans	-159.3	-166.1	-145.4	-140.3	-47	0	0	0	116.3
627	K	26.2	Very low	29.7	Very low	137 Å²	137	139.1 Å²	139.1	60%	0.596	78%	0.777	S	S	*	*			trans	83.2	145.8	167.9	-52.6	-178.5	-170.8	81.3	0	117.2	E625	E625-K627 IonicContact OE1-NZ 2.69Å; E625-K627 PolarHBondContact OE1-NZ 3.1Å; E625-K627 IonicContact OE2-NZ 2.69Å; E625-K627 PolarHBondContact OE2-NZ 2.69Å
628	N	25.4	Very low	29.1	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	78%	0.782	S	S	*	*			cis	-153.3	-177.6	-9	-117.7	-8.1	0	0	0	112.2
629	S	27.2	Very low	30.4	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	78%	0.78	S	S	*	*			trans	-111.5	-156.9	-156.4	65.5	0	0	0	0	115.7
630	P	42.7	Very low	31.1	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	77%	0.774	S	S	*	*				-124.9	-124.1	-123	31.3	-4.9	0	0	0	116
631	P	50.8	Low	32.1	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	77%	0.771	S	S	*	*				-108.5	-173.5	-91.8	37.6	-24.1	0	0	0	115.2
632	K	25.8	Very low	32.4	Very low	219 Å²	219	137.2 Å²	137.2	95%	0.952	78%	0.776	S	S	*	*			trans	-155.3	175.5	158.1	-115.4	171.9	-173.2	-177.4	0	113.4
633	E	30.7	Very low	33.2	Very low	180 Å²	180	134.3 Å²	134.3	84%	0.841	78%	0.776	S	S	*	*			trans	-139.3	177.5	-147.5	-165.6	167.9	-153.4	0	0	114.5
634	E	29.1	Very low	33.1	Very low	193 Å²	193	135 Å²	135	90%	0.902	78%	0.777	S	S	*	*			trans	82.5	145.3	166.1	-56	-161.3	124.8	0	0	121.4
635	G	27	Very low	33.2	Very low	77 Å²	77	135 Å²	135	79%	0.794	78%	0.782	S	S	*	*			trans	153.5	103.1	171	0	0	0	0	0	115.9
636	L	28.9	Very low	33.1	Very low	169 Å²	169	132.2 Å²	132.2	89%	0.885	79%	0.79	S	S	*	*			trans	-95.1	153.3	178.6	-92.8	66	0	0	0	113.7
637	C	24.7	Very low	33.8	Very low	125 Å²	125	132.1 Å²	132.1	85%	0.845	80%	0.796	S	S	*	*				164	163.1	120.8	-94.5	0	0	0	0	116.4
638	S	28.1	Very low	33.8	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	81%	0.812	S	S	*	*			trans	-174	167.1	171.5	-70.6	0	0	0	0	109.7
639	P	53.7	Low	33.8	Very low	122 Å²	122	135.2 Å²	135.2	79%	0.792	81%	0.81	S	S	*	*			cis	-107.9	-95.7	-23.6	23.5	-0.3	0	0	0	110.1
640	P	44.5	Very low	34.7	Very low	109 Å²	109	135 Å²	135	71%	0.708	81%	0.806	S	S	*	*				-104	-151.2	-67.2	44.1	-28.2	0	0	0	111.3
641	P	45.7	Very low	33.9	Very low	119 Å²	119	137.8 Å²	137.8	77%	0.773	81%	0.814	S	S	*	*			cis	-128.4	-164.1	-15.4	42.9	-25	0	0	0	114.9
642	V	33.4	Very low	32.6	Very low	130 Å²	130	135.7 Å²	135.7	79%	0.788	81%	0.813	S	S	*	*			trans	-127.5	152.1	-174.5	177	0	0	0	0	111.6
643	P	40.3	Very low	32.7	Very low	129 Å²	129	130.9 Å²	130.9	84%	0.838	81%	0.807	S	S	*	*			trans	-127.5	175.7	147.3	37.4	-25.9	0	0	0	113.8
644	S	27.8	Very low	32.6	Very low	95 Å²	95	128.4 Å²	128.4	66%	0.664	81%	0.806	S	S	*	*			trans	-137.9	176	-155.7	61.8	0	0	0	0	117
645	N	28.9	Very low	32.4	Very low	164 Å²	164	126.4 Å²	126.4	88%	0.877	80%	0.802	S	S	*	*			trans	79.2	134.1	158.8	-60.3	-19.2	0	0	0	120.4
646	G	25.8	Very low	32.3	Very low	77 Å²	77	127.2 Å²	127.2	79%	0.794	80%	0.795	S	S	*	*			trans	155.4	122.2	169	0	0	0	0	0	113.8
647	P	42.6	Very low	32.1	Very low	125 Å²	125	126.4 Å²	126.4	81%	0.812	80%	0.796	S	S	*	*			trans	-112.3	158.7	-172.7	39.7	-33.1	0	0	0	115.5
648	M	26.3	Very low	32.2	Very low	185 Å²	185	129.4 Å²	129.4	91%	0.911	80%	0.795	S	S	*	*			trans	-175.1	167.2	135.4	-103.5	-168.1	88.5	0	0	114.2
649	Q	25.9	Very low	32.2	Very low	168 Å²	168	129.7 Å²	129.7	79%	0.785	80%	0.797	S	S	*	*			trans	-143.3	173.4	177.1	-96.7	-166.8	9.5	0	0	108
650	P	46.4	Very low	31.1	Very low	102 Å²	102	135.7 Å²	135.7	66%	0.662	80%	0.804	S	S	*	*			cis	-130.3	-139.2	-28.8	38.1	-18.4	0	0	0	110.4
651	L	24.5	Very low	30.1	Very low	175 Å²	175	133.4 Å²	133.4	92%	0.916	80%	0.8	S	S	*	*			trans	92.6	140.4	176.6	-56.5	162.1	0	0	0	115.1
652	G	24.5	Very low	29.3	Very low	70 Å²	70	139.3 Å²	139.3	72%	0.722	81%	0.807	S	S	*	*			cis	-177.1	153	-7.6	0	0	0	0	0	112.5
653	S	26.8	Very low	28.9	Very low	118 Å²	118	141.7 Å²	141.7	83%	0.825	81%	0.807	S	S	*	*			trans	-99.7	142	178.9	-49	0	0	0	0	112.8
654	P	28.8	Very low	28.2	Very low	128 Å²	128	140.9 Å²	140.9	83%	0.831	80%	0.802	S	S	*	*			trans	-97.4	150.2	150.2	34.6	-28	0	0	0	110.9
655	N	25.6	Very low	28.2	Very low	152 Å²	152	144 Å²	144	81%	0.813	81%	0.808	S	S	*	*			trans	-130.6	167.7	-171.7	-130.3	-33.8	0	0	0	111.1
656	C	25.1	Very low	28.5	Very low	94 Å²	94	141.7 Å²	141.7	64%	0.635	79%	0.793	S	S	*	*			trans	69.1	113.4	166.2	-63.6	0	0	0	0	120
657	V	24.8	Very low	28.8	Very low	151 Å²	151	138.7 Å²	138.7	92%	0.915	76%	0.762	S	S	*	*				-122	136.1	120.5	178.9	0	0	0	0	107.9
658	K	27.2	Very low	28.7	Very low	189 Å²	189	135.9 Å²	135.9	82%	0.822	74%	0.739	S	S	*	*			trans	-100.6	131.7	179.7	-66.5	170.3	-178.9	168.7	0	110.4
659	S	26.6	Very low	29	Very low	122 Å²	122	127.5 Å²	127.5	85%	0.853	70%	0.701	S	S	*	*			trans	-144.9	141.7	145.8	69.8	0	0	0	0	110.4
660	R	31.3	Very low	29.6	Very low	247 Å²	247	124.1 Å²	124.1	93%	0.932	69%	0.685	S	S	*	*			trans	-113.6	109.8	177	-85.9	179.9	166.6	171.1	-4	108.5
661	G	22.9	Very low	29.1	Very low	61 Å²	61	124.3 Å²	124.3	63%	0.629	68%	0.678	S	S	*	*			trans	-127.1	109.8	168.6	0	0	0	0	0	110.3
662	R	30.3	Very low	29.8	Very low	243 Å²	243	119 Å²	119	92%	0.917	65%	0.65	S	S	*	*			trans	-88.5	124.4	170.7	-58	-172.3	-158.9	-115.3	9	108.5
663	F	23.2	Very low	30.5	Very low	180 Å²	180	122.4 Å²	122.4	79%	0.789	64%	0.641	S	S	*	*			trans	-127.2	153.9	172.5	-79	-76.9	0	0	0	110.9
664	P	27	Very low	30.9	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	64%	0.643	S	S	*	*			trans	-84.5	148.8	-162.9	32.8	-36	0	0	0	113.8	M666	P664-M666 PolarHBondContact O-N 2.99Å
665	M	28.3	Very low	31.5	Very low	159 Å²	159	128.4 Å²	128.4	78%	0.783	64%	0.635	S	S	*	*			trans	-60.5	126.1	166	-74.8	-171.9	-78.9	0	0	110.9	G667	M665-G667 PolarHBondContact O-N 3.08Å
666	M	34.5	Very low	31.9	Very low	117 Å²	117	129.4 Å²	129.4	58%	0.576	63%	0.634	S	S	*	*			trans	-79.5	106.3	179.3	-157	86.7	70.4	0	0	109.8	V434 P664 Q670	V434-M666 HydrophobicContact CG1-CE 3.63Å; P664-M666 PolarHBondContact O-N 2.99Å; M666-Q670 HydrophobicContact CG-CB 4.23Å; M666-Q670 PolarHBondContact SD-OE1 2.98Å; M666-Q670 VanDerWaalsContact SD-OE1 3.4Å
667	G	31.8	Very low	32.3	Very low	14 Å²	14	134.2 Å²	134.2	14%	0.144	65%	0.647	C	S	.	*			trans	-69.9	150.2	-177.8	0	0	0	0	0	113.2	M665 G669 Q670	M665-G667 PolarHBondContact O-N 3.08Å; G667-G669 PolarHBondContact O-N 2.74Å; G667-Q670 WeakPolarHBondContact O-CB 3.49Å; G667-Q670 PolarHBondContact O-N 2.85Å
668	I	41	Very low	32.7	Very low	65 Å²	65	131.6 Å²	131.6	33%	0.333	64%	0.636	S	S	.	*	H	α-helix	trans	-47.6	-37.7	-180	-66.8	155.6	0	0	0	112.7	L207 Q670 M671	L207-I668 HydrophobicContact CD1-CD1 4.14Å; L207-I668 HydrophobicContact CD2-CD1 4.3Å; I668-Q670 PolarHBondContact O-N 2.85Å; I668-Q670 VanDerWaalsContact O-N 3.07Å; I668-M671 PolarHBondContact O-N 3.07Å
669	G	32.7	Very low	32.9	Very low	9 Å²	9	130.8 Å²	130.8	9%	0.093	64%	0.639	C	S	.	*	H	α-helix	trans	-63.2	-4.6	174.7	0	0	0	0	0	117.2	D101 G667 R673	D101-G669 WeakPolarHBondContact OD2-CA 3.36Å; G667-G669 PolarHBondContact O-N 2.74Å; G669-R673 VanDerWaalsContact O-CZ 3.29Å; G669-R673 PolarHBondContact O-NE 3.25Å; G669-R673 PolarHBondContact O-NH2 3.48Å
670	Q	37.4	Very low	33	Very low	98 Å²	98	133.4 Å²	133.4	46%	0.458	64%	0.638	S	S	.	*	H	α-helix	trans	-101.1	-31	172.8	-73	175.9	-39.1	0	0	112	M666 G667 I668 L672 R673	M666-Q670 HydrophobicContact CG-CB 4.23Å; M666-Q670 PolarHBondContact SD-OE1 2.98Å; M666-Q670 VanDerWaalsContact SD-OE1 3.4Å; G667-Q670 WeakPolarHBondContact O-CB 3.49Å; G667-Q670 PolarHBondContact O-N 2.85Å; I668-Q670 PolarHBondContact O-N 2.85Å; I668-Q670 VanDerWaalsContact O-N 3.07Å; Q670-L672 VanDerWaalsContact C-N 3.31Å; Q670-L672 PolarHBondContact O-N 2.96Å; Q670-R673 WeakPolarHBondContact O-CB 3.35Å; Q670-R673 PolarHBondContact O-N 3.25Å
671	M	36.8	Very low	33	Very low	105 Å²	105	126.9 Å²	126.9	52%	0.517	63%	0.628	S	S	.	*	H	α-helix	trans	-57.3	-45	171.8	-112.7	-159.8	-66.5	0	0	111.6	I668 R673	I668-M671 PolarHBondContact O-N 3.07Å; M671-R673 PolarHBondContact O-N 3.11Å
672	L	38.8	Very low	33.3	Very low	64 Å²	64	129.5 Å²	129.5	34%	0.335	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-7.8	178.8	-63.1	174.1	0	0	0	113.8	Y103 T222 Q670	Y103-L672 HydrophobicContact CD2-CD1 4.32Å; Y103-L672 HydrophobicContact CG-CD1 4.43Å; T222-L672 HydrophobicContact CG2-CD2 4.24Å; Q670-L672 VanDerWaalsContact C-N 3.31Å; Q670-L672 PolarHBondContact O-N 2.96Å
673	R	40.5	Very low	33.3	Very low	141 Å²	141	122.4 Å²	122.4	53%	0.532	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87	-19.8	-168.2	-148.7	174.8	-62.9	-156.6	-4.5	113.9	G669 Q670 M671 R675	G669-R673 VanDerWaalsContact O-CZ 3.29Å; G669-R673 PolarHBondContact O-NE 3.25Å; G669-R673 PolarHBondContact O-NH2 3.48Å; Q670-R673 WeakPolarHBondContact O-CB 3.35Å; Q670-R673 PolarHBondContact O-N 3.25Å; M671-R673 PolarHBondContact O-N 3.11Å; R673-R675 PolarHBondContact O-N 2.69Å
674	K	34.9	Very low	33.7	Very low	196 Å²	196	121.5 Å²	121.5	85%	0.852	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	31.3	178	-150.3	-178.8	-173.4	-178.8	0	113.3
675	R	41.2	Very low	34	Very low	177 Å²	177	127.3 Å²	127.3	67%	0.668	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.5	9.1	-172.7	-141.2	178.4	-172.3	179.1	0	116.2	R673	R673-R675 PolarHBondContact O-N 2.69Å
676	H	34.1	Very low	34.2	Very low	172 Å²	172	125.8 Å²	125.8	80%	0.796	64%	0.642	S	S	*	*	S	Bend	trans	-140.6	27.8	177.4	-74.2	99.6	0	0	0	113.3
677	Q	32.1	Very low	34.1	Very low	195 Å²	195	128.8 Å²	128.8	91%	0.911	66%	0.66	S	S	*	*	S	Bend	trans	-136.1	60.8	169.8	-81.5	-167.9	-38.9	0	0	110.8
678	S	33.6	Very low	34	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	70%	0.697	S	S	*	*	S	Bend	trans	-162	138.7	163.5	54.2	0	0	0	0	106.4
679	L	32.4	Very low	33.6	Very low	172 Å²	172	138.7 Å²	138.7	90%	0.901	72%	0.717	S	S	*	*			trans	71.7	89.6	-171.4	-51.7	169.4	0	0	0	114.3
680	Q	28.8	Very low	33.4	Very low	178 Å²	178	144.4 Å²	144.4	83%	0.832	76%	0.755	S	S	*	*			trans	-119.2	134.7	140.9	-89.8	-74.6	-39.2	0	0	105.6
681	P	31.3	Very low	33.1	Very low	109 Å²	109	147.7 Å²	147.7	71%	0.708	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72.1	153.1	177.2	31	-34.3	0	0	0	110.9	A683	P681-A683 PolarHBondContact O-N 2.69Å
682	S	27.8	Very low	33.1	Very low	116 Å²	116	148 Å²	148	81%	0.811	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.8	116.5	167.8	46.7	0	0	0	0	109.6
683	A	31.3	Very low	33	Very low	94 Å²	94	150.6 Å²	150.6	78%	0.777	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-85.5	136.1	168.9	0	0	0	0	0	110.1	P681	P681-A683 PolarHBondContact O-N 2.69Å
684	D	32.1	Very low	32.4	Very low	161 Å²	161	150.9 Å²	150.9	86%	0.861	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-63.7	157.3	-176.7	-58.8	-75.1	0	0	0	113.7
685	R	33	Very low	32.3	Very low	236 Å²	236	150 Å²	150	89%	0.891	82%	0.815	S	S	*	*			trans	-123.2	137.8	161.7	-78.4	-173.8	168.9	-164.4	-3.7	109
686	P	32.4	Very low	32.4	Very low	127 Å²	127	146.3 Å²	146.3	83%	0.825	82%	0.815	S	S	*	*			trans	-69.1	150.4	-179.6	29.6	-35.2	0	0	0	111.7
687	L	31.3	Very low	32.2	Very low	179 Å²	179	146.5 Å²	146.5	94%	0.937	82%	0.821	S	S	*	*			trans	-80	131.2	164.2	-78.7	159.1	0	0	0	109.4
688	E	30.1	Very low	32.1	Very low	197 Å²	197	141.3 Å²	141.3	92%	0.921	81%	0.811	S	S	*	*			trans	-138.9	141	162.4	-167	165.5	-135.8	0	0	107.7
689	A	32.5	Very low	32.6	Very low	91 Å²	91	142.3 Å²	142.3	75%	0.752	82%	0.815	S	S	*	*			trans	-133.8	141.9	-160.4	0	0	0	0	0	113.2
690	S	29.5	Very low	32.5	Very low	129 Å²	129	139.6 Å²	139.6	90%	0.902	81%	0.806	S	S	*	*			trans	-161.5	158.5	156.8	-87.6	0	0	0	0	111.8
691	L	30.7	Very low	32.7	Very low	167 Å²	167	137.3 Å²	137.3	87%	0.874	80%	0.799	S	S	*	*			trans	-93.7	158.1	-165	-73.6	153.4	0	0	0	113.8
692	P	35.8	Very low	32.6	Very low	112 Å²	112	139.9 Å²	139.9	73%	0.727	81%	0.806	S	S	*	*			trans	-93.6	157.2	175.8	37.3	-34.8	0	0	0	113.4
693	P	37.8	Very low	32.7	Very low	118 Å²	118	138.5 Å²	138.5	77%	0.766	80%	0.802	S	S	*	*			trans	-111.4	121.1	165.3	34.3	-24.1	0	0	0	114
694	L	28.1	Very low	32.9	Very low	147 Å²	147	143.3 Å²	143.3	77%	0.77	81%	0.806	S	S	*	*			trans	32.2	115.9	135.1	-58	173.3	0	0	0	118.9
695	Q	32.9	Very low	32.9	Very low	176 Å²	176	143.3 Å²	143.3	82%	0.822	81%	0.805	S	S	*	*				72.1	161.1	83.1	-85.2	-166.1	-5.9	0	0	115.3
696	P	43	Very low	33.1	Very low	101 Å²	101	140 Å²	140	66%	0.656	80%	0.802	S	S	*	*			cis	-131.1	170.4	-0.2	38	-21.3	0	0	0	115.8
697	L	30.2	Very low	33.1	Very low	175 Å²	175	138.2 Å²	138.2	92%	0.916	80%	0.798	S	S	*	*				174.8	154.4	120.6	-94	162.3	0	0	0	112.7
698	A	29.7	Very low	33.2	Very low	86 Å²	86	137.8 Å²	137.8	71%	0.711	80%	0.797	S	S	*	*			trans	-114.5	-175.7	-179.5	0	0	0	0	0	109.4
699	P	43.2	Very low	33.4	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	79%	0.787	S	S	*	*			cis	-123	-163	5.7	27.2	-0.1	0	0	0	111.9
700	V	31.8	Very low	33.7	Very low	116 Å²	116	134 Å²	134	70%	0.703	79%	0.791	S	S	*	*			cis	-156.6	135.8	35.9	170.5	0	0	0	0	112.6
701	N	32.1	Very low	33.9	Very low	130 Å²	130	136.6 Å²	136.6	70%	0.695	79%	0.786	S	S	*	*			trans	21.7	123.1	146	-59.5	-9.9	0	0	0	121.5
702	L	30.3	Very low	34.1	Very low	162 Å²	162	133.8 Å²	133.8	85%	0.848	78%	0.776	S	S	*	*				90	145.9	99.9	-72.3	176.2	0	0	0	114.4
703	A	29.9	Very low	34.3	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	78%	0.782	S	S	*	*			cis	-139.1	164	-1.7	0	0	0	0	0	111.5
704	F	34	Very low	34.2	Very low	196 Å²	196	141.5 Å²	141.5	86%	0.86	81%	0.813	S	S	*	*			trans	-85.5	161.1	159	-106.3	-99	0	0	0	109.8
705	D	32.3	Very low	34.5	Very low	160 Å²	160	141.3 Å²	141.3	86%	0.856	82%	0.815	S	S	*	*			trans	-136.1	154.4	151.3	-150.6	-13	0	0	0	110.1
706	M	36.9	Very low	34.6	Very low	168 Å²	168	139.4 Å²	139.4	83%	0.828	82%	0.815	S	S	*	*			trans	-134.9	128.3	-173.8	-81.5	-179.7	147.2	0	0	110.4
707	A	32.7	Very low	34.1	Very low	89 Å²	89	141.6 Å²	141.6	74%	0.736	82%	0.824	S	S	*	*			trans	-158.2	138.4	157.1	0	0	0	0	0	111.9
708	D	34.6	Very low	34.4	Very low	170 Å²	170	139.6 Å²	139.6	91%	0.909	82%	0.818	S	S	*	*			trans	55.9	156.4	152.3	-62.5	-22.5	0	0	0	120.9
709	G	34.3	Very low	34.7	Very low	70 Å²	70	142.9 Å²	142.9	72%	0.722	83%	0.825	S	S	*	*			cis	-171.1	155.2	-2.7	0	0	0	0	0	112.8
710	V	38.3	Very low	34.1	Very low	137 Å²	137	144.7 Å²	144.7	83%	0.83	83%	0.829	S	S	*	*			trans	-69.3	133.8	-176.3	-174.9	0	0	0	0	112
711	K	33.7	Very low	34.3	Very low	185 Å²	185	146.7 Å²	146.7	80%	0.804	84%	0.838	S	S	*	*				177.8	125.8	129.3	-99.7	161.2	-172	178	0	118.3
712	T	35.1	Very low	34.4	Very low	108 Å²	108	148 Å²	148	66%	0.663	85%	0.849	S	S	*	*			trans	41.2	126	134.1	58.8	0	0	0	0	123.5
713	Q	39.4	Very low	34.8	Very low	183 Å²	183	146.8 Å²	146.8	86%	0.855	85%	0.849	S	S	*	*			trans	43.7	119.9	130.2	-65.4	175.9	-50.5	0	0	120.7
714	C	36.1	Very low	35.2	Very low	209 Å²	209	152.3 Å²	152.3	100%	1.412	86%	0.861	S	S	*	*				-146.1	0	101.1	-105	0	0	0	0	109.4

Retrieved 714 of 714 residues in 164.5 ms (Link to these results)

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