A0A077ZK15_TRITR Loading...

cyclin-dependent kinase

AlphaFold DB , UniProt , Accession A0A077ZK15, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 531 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	37	Very low	40.4	Very low	231 Å²	231	152.3 Å²	152.3	100%	1.138	82%	0.818	S	S	*	*				0	110.9	0	-84.4	168.4	165.1	0	0	108.7
2	K	28.5	Very low	40.8	Very low	205 Å²	205	156.8 Å²	156.8	89%	0.891	82%	0.815	S	S	*	*			trans	-93	121.9	173.7	-74.4	178.9	176	178.4	0	107.7
3	F	40.1	Very low	42.1	Very low	202 Å²	202	149.3 Å²	149.3	89%	0.886	78%	0.784	S	S	*	*			trans	-109	120.2	167	-89.3	-85	0	0	0	109.5
4	L	37.5	Very low	43.1	Very low	167 Å²	167	146.2 Å²	146.2	87%	0.874	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-81.8	141.8	-177.8	-73.5	149.7	0	0	0	110.7
5	A	36.8	Very low	43.9	Very low	95 Å²	95	140.5 Å²	140.5	79%	0.785	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-76.7	143.2	171.7	0	0	0	0	0	111.8
6	P	39.9	Very low	44.9	Very low	132 Å²	132	140.3 Å²	140.3	86%	0.857	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-81.5	146.6	177.5	31.6	-31	0	0	0	112.6
7	S	36.8	Very low	46.1	Very low	95 Å²	95	140.4 Å²	140.4	66%	0.664	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-75	148.7	-165.3	55.9	0	0	0	0	116	S9	S7-S9 PolarHBondContact O-N 3.19Å
8	S	48.5	Very low	46.8	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	6.7	-176.3	53.9	0	0	0	0	116.1
9	S	45.2	Very low	47.7	Very low	84 Å²	84	138 Å²	138	59%	0.587	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-25.1	-173.8	53.3	0	0	0	0	114.3	S7	S7-S9 PolarHBondContact O-N 3.19Å
10	K	46.6	Very low	48.8	Very low	166 Å²	166	137 Å²	137	72%	0.722	71%	0.71	S	S	*	*	H	α-helix	trans	-73.6	-30.3	-178.8	-112.3	175.2	178.7	177.1	0	114.2	R12 S13	K10-R12 VanDerWaalsContact C-N 3.32Å; K10-R12 PolarHBondContact O-N 3.24Å; K10-S13 PolarHBondContact O-OG 3.01Å
11	K	47.8	Very low	49.8	Very low	185 Å²	185	135 Å²	135	80%	0.804	70%	0.7	S	S	*	*	H	α-helix	trans	-71.2	-23.4	-179.7	-76	-172.2	176.5	-176	0	113.8
12	R	44.8	Very low	51.3	Low	206 Å²	206	129.6 Å²	129.6	78%	0.777	67%	0.67	S	S	*	*	H	α-helix	trans	-78.7	-34	178.1	-93.2	-176.4	167.8	-172.6	-3.2	113.1	K10 Q16	K10-R12 VanDerWaalsContact C-N 3.32Å; K10-R12 PolarHBondContact O-N 3.24Å; R12-Q16 PolarHBondContact O-N 3.49Å
13	S	58.6	Low	53.3	Low	60 Å²	60	126.9 Å²	126.9	42%	0.42	66%	0.659	S	S	.	*	H	α-helix	trans	-67.8	-37.9	178.9	56.5	0	0	0	0	112.3	K10 Q16 K17	K10-S13 PolarHBondContact O-OG 3.01Å; S13-Q16 PolarHBondContact O-N 2.85Å; S13-K17 PolarHBondContact O-N 3.33Å
14	D	55.8	Low	54.6	Low	106 Å²	106	125 Å²	125	57%	0.567	65%	0.646	S	S	*	*	H	α-helix	trans	-72.5	-35.7	-176.1	-62.5	-13.2	0	0	0	111.4	K17 W18	D14-K17 PolarHBondContact O-N 3.47Å; D14-W18 WeakPolarHBondContact O-CB 3.17Å; D14-W18 PolarHBondContact O-N 2.87Å
15	A	55	Low	55.7	Low	61 Å²	61	119.9 Å²	119.9	50%	0.504	62%	0.624	S	S	.	*	H	α-helix	trans	-67.2	-37.9	174.4	0	0	0	0	0	112.8	S19	A15-S19 PolarHBondContact O-N 3Å
16	Q	60	Low	56.9	Low	137 Å²	137	118.4 Å²	118.4	64%	0.64	61%	0.612	S	S	*	*	H	α-helix	trans	-67.7	-42.5	175.5	-110.2	176	-56	0	0	111.7	R12 S13 W18 S19 E20	R12-Q16 PolarHBondContact O-N 3.49Å; S13-Q16 PolarHBondContact O-N 2.85Å; Q16-W18 PolarHBondContact O-N 3.41Å; Q16-S19 PolarHBondContact O-N 3.47Å; Q16-E20 PolarHBondContact O-N 3.5Å; Q16-E20 VanDerWaalsContact O-N 3.15Å
17	K	65.2	Low	58.1	Low	141 Å²	141	118.5 Å²	118.5	61%	0.613	60%	0.601	S	S	*	*	H	α-helix	trans	-63.5	-41.1	178.6	-159.8	177.1	-178.1	-174.5	0	111.8	S13 D14 S19 E20 D21	S13-K17 PolarHBondContact O-N 3.33Å; D14-K17 PolarHBondContact O-N 3.47Å; K17-S19 PolarHBondContact O-N 3.18Å; K17-E20 PolarHBondContact O-N 3.42Å; K17-D21 PolarHBondContact O-N 3.09Å; K17-D21 VanDerWaalsContact O-N 3.12Å
18	W	58.4	Low	59.2	Low	164 Å²	164	122.8 Å²	122.8	62%	0.621	60%	0.602	S	S	*	*	H	α-helix	trans	-64.8	-36.4	176.2	-171.5	73.2	0	0	0	113.3	D14 Q16 K22	D14-W18 WeakPolarHBondContact O-CB 3.17Å; D14-W18 PolarHBondContact O-N 2.87Å; Q16-W18 PolarHBondContact O-N 3.41Å; W18-K22 HydrophobicContact CH2-CD 4.25Å; W18-K22 HydrophobicContact CZ2-CD 4.18Å; W18-K22 HydrophobicContact CZ3-CD 4.43Å; W18-K22 PolarHBondContact O-N 3.19Å
19	S	63.5	Low	59.4	Low	72 Å²	72	125.7 Å²	125.7	50%	0.503	60%	0.596	S	S	.	*	H	α-helix	trans	-65.8	-39.1	175.2	179.5	0	0	0	0	112.5	A15 Q16 K17 K23	A15-S19 PolarHBondContact O-N 3Å; Q16-S19 PolarHBondContact O-N 3.47Å; K17-S19 PolarHBondContact O-N 3.18Å; S19-K23 PolarHBondContact O-N 3.11Å
20	E	69.7	Low	59.6	Low	118 Å²	118	123.6 Å²	123.6	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-70.1	-38.9	178.5	-73.6	-173.6	169.2	0	0	112.1	Q16 K17 K23 R24	Q16-E20 PolarHBondContact O-N 3.5Å; Q16-E20 VanDerWaalsContact O-N 3.15Å; K17-E20 PolarHBondContact O-N 3.42Å; E20-K23 PolarHBondContact O-N 3.43Å; E20-R24 WeakPolarHBondContact O-CG 3.32Å; E20-R24 PolarHBondContact O-N 3.31Å
21	D	71.1	Confident	59.9	Low	94 Å²	94	118.7 Å²	118.7	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-66.2	-38.5	178.1	-75.6	-22.8	0	0	0	112.2	K17 K23 R24 S25	K17-D21 PolarHBondContact O-N 3.09Å; K17-D21 VanDerWaalsContact O-N 3.12Å; D21-K23 VanDerWaalsContact C-N 3.35Å; D21-K23 PolarHBondContact O-N 2.79Å; D21-R24 PolarHBondContact O-N 3.38Å; D21-S25 WeakPolarHBondContact O-CB 3.15Å; D21-S25 PolarHBondContact O-N 3.09Å
22	K	67.4	Low	60.1	Low	118 Å²	118	114.7 Å²	114.7	51%	0.513	56%	0.562	S	S	.	*	H	α-helix	trans	-63.1	-39.5	172.3	-91.2	-172.5	172.4	180	0	112.4	W18 S25 A26	W18-K22 HydrophobicContact CH2-CD 4.25Å; W18-K22 HydrophobicContact CZ2-CD 4.18Å; W18-K22 HydrophobicContact CZ3-CD 4.43Å; W18-K22 PolarHBondContact O-N 3.19Å; K22-S25 PolarHBondContact O-N 3.37Å; K22-A26 PolarHBondContact O-N 2.84Å
23	K	69.9	Low	60.3	Low	149 Å²	149	112.8 Å²	112.8	65%	0.648	56%	0.559	S	S	*	*	H	α-helix	trans	-64.4	-45.6	177.6	-128.4	179.1	-178.3	-177	0	111.4	S19 E20 D21 S25 A26 E27	S19-K23 PolarHBondContact O-N 3.11Å; E20-K23 PolarHBondContact O-N 3.43Å; D21-K23 VanDerWaalsContact C-N 3.35Å; D21-K23 PolarHBondContact O-N 2.79Å; K23-S25 VanDerWaalsContact C-N 3.32Å; K23-S25 PolarHBondContact O-N 3.43Å; K23-A26 PolarHBondContact O-N 2.78Å; K23-E27 WeakPolarHBondContact O-CG 3.02Å; K23-E27 PolarHBondContact O-N 3.14Å
24	R	67.2	Low	59.8	Low	162 Å²	162	118.5 Å²	118.5	61%	0.611	58%	0.576	S	S	*	*	H	α-helix	trans	-62.8	-36.2	176	-73.3	176.1	176.4	-107.4	0.4	112.8	E20 D21 R28	E20-R24 WeakPolarHBondContact O-CG 3.32Å; E20-R24 PolarHBondContact O-N 3.31Å; D21-R24 PolarHBondContact O-N 3.38Å; R24-R28 WeakPolarHBondContact O-CG 3.26Å; R24-R28 PolarHBondContact O-N 3.25Å
25	S	62.2	Low	59.3	Low	59 Å²	59	120.1 Å²	120.1	41%	0.413	58%	0.581	S	S	.	*	H	α-helix	trans	-71.8	-36.9	177.9	-162.6	0	0	0	0	112.6	D21 K22 K23 R28 R29	D21-S25 WeakPolarHBondContact O-CB 3.15Å; D21-S25 PolarHBondContact O-N 3.09Å; K22-S25 PolarHBondContact O-N 3.37Å; K23-S25 VanDerWaalsContact C-N 3.32Å; K23-S25 PolarHBondContact O-N 3.43Å; S25-R28 PolarHBondContact O-N 3.33Å; S25-R29 PolarHBondContact O-N 2.9Å; S25-R29 VanDerWaalsContact O-N 3.14Å
26	A	61.9	Low	58.7	Low	65 Å²	65	127.8 Å²	127.8	54%	0.537	60%	0.596	S	S	.	*	H	α-helix	trans	-67.8	-38.4	174.7	0	0	0	0	0	112.6	K22 K23 R29 G30	K22-A26 PolarHBondContact O-N 2.84Å; K23-A26 PolarHBondContact O-N 2.78Å; A26-R29 PolarHBondContact O-N 3.46Å; A26-G30 PolarHBondContact O-N 3.37Å; A26-G30 VanDerWaalsContact O-N 3.07Å
27	E	64.3	Low	58	Low	134 Å²	134	130.2 Å²	130.2	63%	0.626	61%	0.605	S	S	*	*	H	α-helix	trans	-64.3	-42.7	175.1	-74.5	173	177.1	0	0	111.8	K23 R29 G30 S31	K23-E27 WeakPolarHBondContact O-CG 3.02Å; K23-E27 PolarHBondContact O-N 3.14Å; E27-R29 PolarHBondContact O-N 3.46Å; E27-G30 PolarHBondContact O-N 2.95Å; E27-S31 PolarHBondContact O-N 3.2Å; E27-S31 PolarHBondContact O-OG 3.16Å; E27-S31 VanDerWaalsContact O-OG 3.13Å
28	R	60.6	Low	57	Low	185 Å²	185	127.6 Å²	127.6	70%	0.698	60%	0.604	S	S	*	*	H	α-helix	trans	-62.6	-40.7	175.8	-74.7	-179.7	178.2	-168.2	-1.2	113	R24 S25 G30 S31 D32	R24-R28 WeakPolarHBondContact O-CG 3.26Å; R24-R28 PolarHBondContact O-N 3.25Å; S25-R28 PolarHBondContact O-N 3.33Å; R28-G30 VanDerWaalsContact C-N 3.3Å; R28-G30 PolarHBondContact O-N 2.78Å; R28-S31 WeakPolarHBondContact CA-OG 3.46Å; R28-S31 PolarHBondContact O-N 3.17Å; R28-S31 PolarHBondContact O-OG 2.94Å; R28-D32 PolarHBondContact O-N 3.48Å
29	R	52.1	Low	56.1	Low	173 Å²	173	126.6 Å²	126.6	65%	0.653	61%	0.611	S	S	*	*	H	α-helix	trans	-70	-25.9	176.2	-72.2	-178.1	176.2	-165.4	-1.9	113	S25 A26 E27	S25-R29 PolarHBondContact O-N 2.9Å; S25-R29 VanDerWaalsContact O-N 3.14Å; A26-R29 PolarHBondContact O-N 3.46Å; E27-R29 PolarHBondContact O-N 3.46Å
30	G	49.9	Very low	55	Low	40 Å²	40	129.6 Å²	129.6	41%	0.412	63%	0.627	S	S	.	*	H	α-helix	trans	-72.6	-35.1	174.8	0	0	0	0	0	113.5	A26 E27 R28	A26-G30 PolarHBondContact O-N 3.37Å; A26-G30 VanDerWaalsContact O-N 3.07Å; E27-G30 PolarHBondContact O-N 2.95Å; R28-G30 VanDerWaalsContact C-N 3.3Å; R28-G30 PolarHBondContact O-N 2.78Å
31	S	53	Low	53.3	Low	64 Å²	64	129.9 Å²	129.9	45%	0.448	64%	0.642	S	S	.	*	H	α-helix	trans	-70	-42.7	175	31.2	0	0	0	0	112.6	E27 R28 K33 K34 E35	E27-S31 PolarHBondContact O-N 3.2Å; E27-S31 PolarHBondContact O-OG 3.16Å; E27-S31 VanDerWaalsContact O-OG 3.13Å; R28-S31 WeakPolarHBondContact CA-OG 3.46Å; R28-S31 PolarHBondContact O-N 3.17Å; R28-S31 PolarHBondContact O-OG 2.94Å; S31-K33 VanDerWaalsContact C-N 3.29Å; S31-K33 PolarHBondContact O-N 3.42Å; S31-K34 PolarHBondContact O-N 2.93Å; S31-K34 VanDerWaalsContact O-N 3.07Å; S31-E35 PolarHBondContact O-N 3.5Å
32	D	51.7	Low	51.5	Low	100 Å²	100	129.2 Å²	129.2	54%	0.535	66%	0.657	S	S	.	*	H	α-helix	trans	-67.7	-27	-178.3	-69.4	-10	0	0	0	113.2	R28 R36	R28-D32 PolarHBondContact O-N 3.48Å; D32-R36 PolarHBondContact O-N 2.81Å
33	K	49.7	Very low	49.9	Very low	167 Å²	167	135.6 Å²	135.6	73%	0.726	68%	0.677	S	S	*	*	H	α-helix	trans	-77.8	-21.4	174.2	-95.6	-177.2	177.5	176.9	0	113.7	S31	S31-K33 VanDerWaalsContact C-N 3.29Å; S31-K33 PolarHBondContact O-N 3.42Å
34	K	47.2	Very low	48	Very low	179 Å²	179	139.5 Å²	139.5	78%	0.778	69%	0.688	S	S	*	*	H	α-helix	trans	-81	-30.7	172.6	-85.1	-175.7	175.1	179.1	0	111.9	S31	S31-K34 PolarHBondContact O-N 2.93Å; S31-K34 VanDerWaalsContact O-N 3.07Å
35	E	44.5	Very low	46.5	Very low	141 Å²	141	140.4 Å²	140.4	66%	0.659	70%	0.699	S	S	*	*	H	α-helix	trans	-77.8	-26.1	177.6	-126.2	173.3	-175.4	0	0	113.6	S31 S38	S31-E35 PolarHBondContact O-N 3.5Å; E35-S38 PolarHBondContact O-OG 2.98Å
36	R	42.9	Very low	45.1	Very low	221 Å²	221	145.8 Å²	145.8	83%	0.834	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-10.6	175.7	-83.5	-177.2	161.8	-171.2	-4.4	115.4	D32	D32-R36 PolarHBondContact O-N 2.81Å
37	K	45.5	Very low	44	Very low	189 Å²	189	151.2 Å²	151.2	82%	0.822	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-3.1	179.4	-78	-170.3	174.6	-175.6	0	114.7
38	S	43.9	Very low	42.6	Very low	86 Å²	86	152.9 Å²	152.9	60%	0.601	74%	0.744	S	S	*	*	S	Bend	trans	-97.2	-4.4	179.9	46	0	0	0	0	115.3	E35	E35-S38 PolarHBondContact O-OG 2.98Å
39	N	40.7	Very low	41.5	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	75%	0.748	S	S	*	*	S	Bend	trans	-118.1	26.4	-170.2	-89.8	-3.3	0	0	0	116.8
40	T	40	Very low	40.8	Very low	135 Å²	135	152 Å²	152	83%	0.828	76%	0.758	S	S	*	*			trans	-135.4	74.4	172.6	42.6	0	0	0	0	112.3
41	S	33.9	Very low	39.9	Very low	124 Å²	124	158.8 Å²	158.8	87%	0.867	77%	0.772	S	S	*	*			trans	-117.9	119.9	160.3	75.1	0	0	0	0	109.6
42	G	33.7	Very low	39.1	Very low	79 Å²	79	165.8 Å²	165.8	81%	0.814	79%	0.794	S	S	*	*			trans	125.8	84.5	162.4	0	0	0	0	0	115.6
43	R	32.9	Very low	38.2	Very low	252 Å²	252	167.9 Å²	167.9	95%	0.951	80%	0.8	S	S	*	*				-168.3	117.6	129.3	-144.5	162.2	172.3	165.3	-4.2	110.9
44	R	29.8	Very low	37.6	Very low	232 Å²	232	169.4 Å²	169.4	88%	0.875	81%	0.81	S	S	*	*			trans	-85.7	151.1	169	-85.7	174.5	162.3	163.9	-5.8	109.6
45	E	35.7	Very low	37	Very low	181 Å²	181	169.9 Å²	169.9	85%	0.846	82%	0.815	S	S	*	*			trans	170.8	103.3	135.4	-94	164.8	-163.7	0	0	108.8
46	H	33.6	Very low	36.6	Very low	171 Å²	171	173.8 Å²	173.8	79%	0.792	82%	0.823	S	S	*	*				73.7	110.9	99.5	-100.4	-86.2	0	0	0	115.4
47	L	38.6	Very low	36.4	Very low	180 Å²	180	169.9 Å²	169.9	94%	0.942	81%	0.814	S	S	*	*			trans	-161.3	115.8	143	-98.4	158.4	0	0	0	109
48	H	33.7	Very low	35.9	Very low	168 Å²	168	167.8 Å²	167.8	78%	0.778	81%	0.807	S	S	*	*			trans	-96.9	156	176.6	-123.3	32.8	0	0	0	108.6
49	I	38.2	Very low	35.4	Very low	152 Å²	152	171.9 Å²	171.9	78%	0.779	81%	0.814	S	S	*	*				172.4	128.9	129.8	-88.5	157.7	0	0	0	114.2
50	H	36.6	Very low	35.1	Very low	188 Å²	188	170.1 Å²	170.1	87%	0.87	81%	0.813	S	S	*	*			trans	77.1	120.6	152.3	-79.6	-58.5	0	0	0	125.2
51	R	32.2	Very low	35	Very low	183 Å²	183	169.2 Å²	169.2	69%	0.691	81%	0.812	S	S	*	*			trans	-106.2	153.6	176.7	172.8	-173.5	-174.7	165.8	1.4	109.6	E53	R51-E53 IonicContact CZ-OE1 3.31Å; R51-E53 IonicContact NE-OE1 3.98Å; R51-E53 IonicContact NH2-OE1 3.99Å; R51-E53 PolarHBondContact NH2-OE1 3.08Å; R51-E53 IonicContact NH2-OE2 3.09Å
52	K	36.1	Very low	35	Very low	211 Å²	211	172.2 Å²	172.2	92%	0.917	81%	0.813	S	S	*	*			trans	-160.2	132.6	143.8	-107.4	175.8	-175.2	-173.8	0	111.8
53	E	32.5	Very low	35.3	Very low	143 Å²	143	178.6 Å²	178.6	67%	0.668	82%	0.818	S	S	*	*			trans	-92.5	161.6	-178.9	-68.4	163.8	153.3	0	0	111.5	R51	R51-E53 IonicContact CZ-OE1 3.31Å; R51-E53 IonicContact NE-OE1 3.98Å; R51-E53 IonicContact NH2-OE1 3.99Å; R51-E53 PolarHBondContact NH2-OE1 3.08Å; R51-E53 IonicContact NH2-OE2 3.09Å
54	E	38	Very low	35.2	Very low	200 Å²	200	175 Å²	175	94%	0.935	81%	0.812	S	S	*	*			trans	-159.6	132.3	146.2	-110.6	168.9	-153.8	0	0	112.2
55	H	34.4	Very low	35.8	Very low	189 Å²	189	169.8 Å²	169.8	88%	0.875	81%	0.808	S	S	*	*			trans	-122.6	145.2	176.1	-113.9	-78	0	0	0	107.1
56	R	35.1	Very low	35.7	Very low	222 Å²	222	166.8 Å²	166.8	84%	0.838	80%	0.802	S	S	*	*			trans	178	137	143	-101.1	171.1	-173.1	-135.3	5.1	116.9
57	H	39.7	Very low	35.7	Very low	140 Å²	140	169.6 Å²	169.6	65%	0.648	81%	0.806	S	S	*	*			trans	75.7	101	142.4	-69.2	-58.9	0	0	0	125.8
58	E	33.8	Very low	35.6	Very low	144 Å²	144	167.2 Å²	167.2	67%	0.673	80%	0.799	S	S	*	*				34	132.9	112.1	-88.2	-170.1	162.3	0	0	125.4
59	K	34.3	Very low	35.4	Very low	172 Å²	172	170.5 Å²	170.5	75%	0.748	80%	0.804	S	S	*	*				116.4	115	126.2	-86.3	165.6	178.2	142.3	0	122
60	S	34.8	Very low	35.3	Very low	106 Å²	106	171.6 Å²	171.6	74%	0.741	81%	0.806	S	S	*	*			trans	63.1	123.1	130.1	-165.7	0	0	0	0	122.9
61	S	37.8	Very low	35.2	Very low	116 Å²	116	171 Å²	171	81%	0.811	80%	0.801	S	S	*	*				168.3	141.9	103.2	-70.2	0	0	0	0	114.4
62	Q	34.2	Very low	35.1	Very low	187 Å²	187	170 Å²	170	87%	0.874	81%	0.81	S	S	*	*			trans	-78.5	157.5	179.9	-65.5	167.8	-39	0	0	114.2
63	K	38.7	Very low	35	Very low	213 Å²	213	163.7 Å²	163.7	93%	0.926	80%	0.804	S	S	*	*				178.4	131.7	125.1	-96.7	168.2	-175.8	-176.5	0	114.4
64	H	32.3	Very low	34.9	Very low	177 Å²	177	166.3 Å²	166.3	82%	0.819	82%	0.816	S	S	*	*			trans	-78.8	170.1	165.5	-101.7	-58.9	0	0	0	110.7
65	P	41.8	Very low	34.8	Very low	122 Å²	122	162.3 Å²	162.3	79%	0.792	81%	0.81	S	S	*	*				-157.1	-149.9	62.5	42.7	-17.2	0	0	0	116.7
66	T	33.9	Very low	34.5	Very low	118 Å²	118	161 Å²	161	72%	0.724	81%	0.81	S	S	*	*			trans	-117.1	161	-136.8	48.6	0	0	0	0	116.8
67	R	32.8	Very low	34.4	Very low	230 Å²	230	159.1 Å²	159.1	87%	0.868	81%	0.81	S	S	*	*			trans	98	152.9	131.1	-111.1	179.8	169.8	-175.8	-3.6	122.4
68	T	36.5	Very low	33.9	Very low	130 Å²	130	159 Å²	159	80%	0.798	82%	0.82	S	S	*	*			trans	76.9	119.3	167.7	65.3	0	0	0	0	117.9
69	R	30.5	Very low	33.9	Very low	238 Å²	238	160 Å²	160	90%	0.898	83%	0.829	S	S	*	*			cis	105.5	141.2	38	-160.3	-177.3	-169.7	-175.1	2.3	110.3
70	E	35.8	Very low	33.6	Very low	174 Å²	174	161.2 Å²	161.2	81%	0.813	83%	0.834	S	S	*	*			trans	92.8	148.7	175.6	-56.5	-170.2	167.6	0	0	115.3
71	K	33.4	Very low	33.4	Very low	177 Å²	177	165.8 Å²	165.8	77%	0.77	84%	0.844	S	S	*	*			cis	179.2	144.3	-33	-121.1	-174.3	-179.4	-179.5	0	104
72	N	31.8	Very low	33.2	Very low	162 Å²	162	171.3 Å²	171.3	87%	0.866	85%	0.847	S	S	*	*			trans	74.5	136	160.1	-62.8	-6.7	0	0	0	120.3
73	G	33.9	Very low	32.9	Very low	78 Å²	78	173.9 Å²	173.9	80%	0.804	85%	0.849	S	S	*	*			trans	147.9	99.3	155.3	0	0	0	0	0	114.7
74	H	30.8	Very low	32.7	Very low	198 Å²	198	170.3 Å²	170.3	92%	0.917	84%	0.844	S	S	*	*			trans	-54.1	141.9	164.7	-100.4	34	0	0	0	112.8
75	S	34	Very low	33	Very low	116 Å²	116	167.4 Å²	167.4	81%	0.811	84%	0.841	S	S	*	*			trans	-173	132	131.5	51.5	0	0	0	0	111.4
76	D	29.4	Very low	32.7	Very low	161 Å²	161	171.6 Å²	171.6	86%	0.861	84%	0.841	S	S	*	*			trans	-38.7	138.5	162.8	-90.4	-47.9	0	0	0	113.2
77	E	32.3	Very low	32.7	Very low	182 Å²	182	169.3 Å²	169.3	85%	0.85	83%	0.834	S	S	*	*			trans	-153.4	127.4	140.3	-119.9	179.5	-172.3	0	0	112.4
78	T	28.5	Very low	33.2	Very low	139 Å²	139	161.8 Å²	161.8	85%	0.853	81%	0.809	S	S	*	*			trans	-78.6	114.5	-177.6	15.6	0	0	0	0	109.8
79	L	34.1	Very low	33.3	Very low	164 Å²	164	165.8 Å²	165.8	86%	0.859	81%	0.809	S	S	*	*			trans	-114.5	109.5	171.2	-93.7	159.4	0	0	0	111.5	E81	L79-E81 PolarHBondContact O-N 3.18Å
80	K	29.3	Very low	33.5	Very low	197 Å²	197	161 Å²	161	86%	0.857	80%	0.797	S	S	*	*			trans	-58	108.6	168.6	-72.4	168.7	173.8	169.4	0	110.2	R82	K80-R82 PolarHBondContact O-N 2.99Å; K80-R82 VanDerWaalsContact O-N 3.13Å
81	E	30.7	Very low	33.9	Very low	203 Å²	203	158.7 Å²	158.7	95%	0.949	79%	0.786	S	S	*	*			trans	-72.4	103.6	165.5	-87.4	-173.6	152.4	0	0	110.3	L79	L79-E81 PolarHBondContact O-N 3.18Å
82	R	31.9	Very low	34.4	Very low	232 Å²	232	152.6 Å²	152.6	88%	0.875	76%	0.76	S	S	*	*			trans	-75	121.4	167.8	-82	173.5	146.9	-160.3	-3.4	109.9	K80	K80-R82 PolarHBondContact O-N 2.99Å; K80-R82 VanDerWaalsContact O-N 3.13Å
83	R	29.8	Very low	34.7	Very low	241 Å²	241	149.3 Å²	149.3	91%	0.909	75%	0.75	S	S	*	*			trans	39.3	111.1	140.4	-65.4	-178.7	164.5	-174.9	-5.6	118.1
84	T	32.8	Very low	34.9	Very low	137 Å²	137	149.5 Å²	149.5	84%	0.84	75%	0.745	S	S	*	*			trans	-129.6	125.7	153.9	52.5	0	0	0	0	109.6
85	P	38.9	Very low	35.8	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	71%	0.714	S	S	*	*				-142.2	111.3	120.4	31.6	-14.3	0	0	0	111.9
86	R	35	Very low	36.3	Very low	211 Å²	211	145.3 Å²	145.3	80%	0.796	72%	0.715	S	S	*	*			trans	-135.1	-11.2	164	-159.4	174	-179.3	-178.6	0.2	113.1
87	A	35.7	Very low	37.5	Very low	69 Å²	69	138.6 Å²	138.6	57%	0.57	68%	0.679	S	S	*	*	S	Bend	trans	-80.4	-22.8	-172	0	0	0	0	0	114.8	R89	A87-R89 PolarHBondContact O-N 3.24Å
88	E	42.8	Very low	38.6	Very low	73 Å²	73	137.3 Å²	137.3	34%	0.341	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-24.3	-175	-71.5	170.7	167.3	0	0	113.7	W339	E88-W339 HydrophobicContact CG-CH2 4.37Å; E88-W339 HydrophobicContact CG-CZ3 4.47Å; E88-W339 WeakPolarHBondContact OE1-CZ3 3.47Å
89	R	37.7	Very low	40.2	Very low	213 Å²	213	132.5 Å²	132.5	80%	0.804	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-20.3	-172.4	-71.2	-176.1	178.6	179.3	-2.1	115	A87	A87-R89 PolarHBondContact O-N 3.24Å
90	Q	35.6	Very low	41.4	Very low	137 Å²	137	126.6 Å²	126.6	64%	0.64	62%	0.616	S	S	*	*	S	Bend	trans	-87.4	-12.5	-170.3	-74.2	-176.2	-25.8	0	0	114.5
91	H	43.1	Very low	42.6	Very low	127 Å²	127	121 Å²	121	59%	0.588	61%	0.607	S	S	*	*	S	Bend	trans	-102.4	-10.5	-176.2	-75.2	-63.8	0	0	0	115
92	Q	44.5	Very low	44	Very low	48 Å²	48	114.3 Å²	114.3	22%	0.224	59%	0.585	C	S	.	*	S	Bend	trans	-90.8	-16.9	179.8	-68.7	-164.7	-52.3	0	0	114.1	A94 D299 K301 T337	Q92-A94 PolarHBondContact O-N 3.25Å; Q92-D299 PolarHBondContact NE2-OD1 2.73Å; Q92-D299 PolarHBondContact NE2-OD2 3.15Å; Q92-K301 VanDerWaalsContact CD-NZ 3.31Å; Q92-T337 PolarHBondContact NE2-OG1 3.38Å
93	S	38.1	Very low	45.3	Very low	93 Å²	93	104.3 Å²	104.3	65%	0.65	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	5.5	-171	64.5	0	0	0	0	115.4
94	A	38.7	Very low	46.5	Very low	83 Å²	83	94 Å²	94	69%	0.686	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	15.8	-170.5	0	0	0	0	0	114.3	Q92 E96	Q92-A94 PolarHBondContact O-N 3.25Å; A94-E96 PolarHBondContact O-N 3.25Å
95	V	49.2	Very low	47.7	Very low	46 Å²	46	92.1 Å²	92.1	28%	0.279	50%	0.495	S	S	.	.			trans	-90	87.7	176.4	-171.3	0	0	0	0	108.1	D97 T332 V334	V95-D97 PolarHBondContact O-N 3.45Å; V95-T332 HydrophobicContact CG1-CG2 4.05Å; V95-V334 HydrophobicContact CG2-CG1 4.34Å; V95-V334 VanDerWaalsContact CG2-O 3.3Å; V95-V334 WeakPolarHBondContact CG2-O 3.36Å
96	E	44.5	Very low	48.7	Very low	179 Å²	179	91 Å²	91	84%	0.836	48%	0.48	S	S	*	.			trans	-67.9	113.1	160.5	-70.1	-179.9	175.4	0	0	106.8	A94 D98	A94-E96 PolarHBondContact O-N 3.25Å; E96-D98 PolarHBondContact O-N 2.67Å
97	D	54.3	Low	49.5	Very low	20 Å²	20	81.3 Å²	81.3	11%	0.107	44%	0.444	C	S	.	.			trans	-92.7	88.3	-161.7	-146.1	-8.6	0	0	0	109.8	V95 D99 E100 R220 R298 R322 T332	V95-D97 PolarHBondContact O-N 3.45Å; D97-D99 PolarHBondContact O-N 2.93Å; D97-E100 HydrophobicContact CB-CG 4.15Å; D97-E100 WeakPolarHBondContact O-CG 3.23Å; D97-E100 PolarHBondContact O-N 2.81Å; D97-R220 IonicContact OD2-NH1 2.71Å; D97-R298 IonicContact OD2-NH2 3.71Å; D97-R322 IonicContact OD1-CZ 2.82Å; D97-R322 IonicContact OD1-NH1 3.95Å; D97-R322 PolarHBondContact OD1-NH1 2.83Å; D97-R322 IonicContact OD1-NH2 2.63Å; D97-R322 IonicContact OD2-CZ 3.25Å; D97-R322 IonicContact OD2-NH1 3.19Å; D97-R322 PolarHBondContact OD2-NH1 3.19Å; D97-R322 IonicContact OD2-NH2 3.18Å; D97-T332 WeakPolarHBondContact OD1-CB 3.08Å; D97-T332 PolarHBondContact OD1-OG1 3.44Å
98	D	55	Low	50.4	Low	156 Å²	156	82 Å²	82	83%	0.834	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-20.1	-171.7	-82	-32.3	0	0	0	115.9	E96 E100	E96-D98 PolarHBondContact O-N 2.67Å; D98-E100 VanDerWaalsContact C-N 3.29Å; D98-E100 PolarHBondContact O-N 2.94Å
99	D	63.8	Low	51	Low	38 Å²	38	83.7 Å²	83.7	20%	0.203	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	11.4	-179.8	-21.1	-67.5	0	0	0	114.6	D97 A101 R322 Y331 T332	D97-D99 PolarHBondContact O-N 2.93Å; D99-A101 PolarHBondContact O-N 3.4Å; D99-R322 VanDerWaalsContact CB-CZ 3.46Å; D99-R322 PolarHBondContact O-NH2 2.75Å; D99-R322 IonicContact OD2-CZ 2.88Å; D99-R322 VanDerWaalsContact OD2-CZ 3.29Å; D99-R322 IonicContact OD2-NE 2.85Å; D99-R322 IonicContact OD2-NH1 3.85Å; D99-R322 PolarHBondContact OD2-NH1 2.77Å; D99-R322 IonicContact OD2-NH2 3.8Å; D99-Y331 VanDerWaalsContact OD2-CA 3.25Å; D99-Y331 WeakPolarHBondContact OD2-CA 3.46Å; D99-T332 PolarHBondContact OD2-N 3.45Å; D99-T332 PolarHBondContact OD2-OG1 3.14Å; D99-T332 VanDerWaalsContact OD2-OG1 3.06Å
100	E	58	Low	51.4	Low	39 Å²	39	76.8 Å²	76.8	18%	0.182	42%	0.42	C	S	.	.	H	α-helix	trans	-59.7	-42.5	-174.3	-63.4	-123.5	118	0	0	114	D97 D98 A102 V104 I216 T217 R220	D97-E100 HydrophobicContact CB-CG 4.15Å; D97-E100 WeakPolarHBondContact O-CG 3.23Å; D97-E100 PolarHBondContact O-N 2.81Å; D98-E100 VanDerWaalsContact C-N 3.29Å; D98-E100 PolarHBondContact O-N 2.94Å; E100-A102 PolarHBondContact O-N 3.36Å; E100-V104 WeakPolarHBondContact O-CG2 3.21Å; E100-V104 PolarHBondContact O-N 3.35Å; E100-I216 HydrophobicContact CB-CG2 4.45Å; E100-I216 WeakPolarHBondContact OE2-CG2 3.21Å; E100-T217 WeakPolarHBondContact OE1-CG2 3.28Å; E100-R220 VanDerWaalsContact CD-NH2 3.29Å; E100-R220 IonicContact OE1-CZ 2.74Å; E100-R220 VanDerWaalsContact OE1-CZ 3.25Å; E100-R220 IonicContact OE1-NH1 2.73Å; E100-R220 PolarHBondContact OE1-NH1 3.4Å; E100-R220 IonicContact OE1-NH2 3.62Å; E100-R220 PolarHBondContact OE1-NH2 3.47Å
101	A	54.6	Low	51.8	Low	81 Å²	81	75 Å²	75	67%	0.669	41%	0.41	S	S	*	.	H	α-helix	trans	-66.8	-34.1	-166.1	0	0	0	0	0	114.2	D99 E105	D99-A101 PolarHBondContact O-N 3.4Å; A101-E105 PolarHBondContact O-N 3.49Å
102	A	59.7	Low	51.7	Low	61 Å²	61	76.4 Å²	76.4	50%	0.504	42%	0.417	S	S	.	.	H	α-helix	trans	-75	-40.7	-175.3	0	0	0	0	0	112.3	E100 V104	E100-A102 PolarHBondContact O-N 3.36Å; A102-V104 VanDerWaalsContact C-N 3.32Å
103	D	59	Low	51.6	Low	23 Å²	23	77.5 Å²	77.5	12%	0.123	43%	0.434	C	S	.	.	H	α-helix	trans	-72.4	-29.5	-178.9	-63.1	-22.7	0	0	0	111.3	E106 T107 R322	D103-E106 PolarHBondContact O-N 2.94Å; D103-T107 WeakPolarHBondContact O-CB 3.44Å; D103-T107 PolarHBondContact O-N 3.06Å; D103-T107 PolarHBondContact O-OG1 3.2Å; D103-R322 IonicContact OD2-CZ 3.95Å; D103-R322 IonicContact OD2-NE 3.77Å; D103-R322 PolarHBondContact OD2-NE 3.49Å; D103-R322 IonicContact OD2-NH2 2.7Å
104	V	56.5	Low	51.3	Low	23 Å²	23	75.7 Å²	75.7	14%	0.139	43%	0.43	C	S	.	.	H	α-helix	trans	-68.5	-44.1	176.7	174.6	0	0	0	0	111.7	E100 A102 E106 T107 L108 I216	E100-V104 WeakPolarHBondContact O-CG2 3.21Å; E100-V104 PolarHBondContact O-N 3.35Å; A102-V104 VanDerWaalsContact C-N 3.32Å; V104-E106 PolarHBondContact O-N 3.15Å; V104-T107 PolarHBondContact O-N 2.86Å; V104-T107 VanDerWaalsContact O-N 3.14Å; V104-L108 HydrophobicContact CG1-CD1 3.84Å; V104-L108 HydrophobicContact CG1-CG 4.15Å; V104-L108 WeakPolarHBondContact O-CB 3.32Å; V104-L108 WeakPolarHBondContact O-CG 3.31Å; V104-L108 PolarHBondContact O-N 3.36Å; V104-I216 HydrophobicContact CG1-CG1 4.3Å; V104-I216 HydrophobicContact CG2-CB 4.05Å; V104-I216 HydrophobicContact CG2-CD1 4.09Å; V104-I216 HydrophobicContact CG2-CG1 3.83Å; V104-I216 HydrophobicContact CG2-CG2 3.18Å
105	E	57	Low	51.1	Low	98 Å²	98	78.5 Å²	78.5	46%	0.458	43%	0.429	S	S	.	.	H	α-helix	trans	-61.9	-34.5	178.5	-161.5	-169.8	150.8	0	0	111.2	A101 K109	A101-E105 PolarHBondContact O-N 3.49Å; E105-K109 WeakPolarHBondContact O-CB 3.46Å; E105-K109 WeakPolarHBondContact O-CD 3.18Å; E105-K109 WeakPolarHBondContact O-CG 3.49Å; E105-K109 PolarHBondContact O-N 3.19Å; E105-K109 VanDerWaalsContact O-N 3.16Å; E105-K109 WeakPolarHBondContact OE1-CE 3.39Å; E105-K109 IonicContact OE1-NZ 3.87Å; E105-K109 PolarHBondContact OE1-NZ 3.07Å
106	E	59.6	Low	50.3	Low	93 Å²	93	82.2 Å²	82.2	44%	0.435	45%	0.452	S	S	.	.	H	α-helix	trans	-74	-37.2	175.3	-167.8	155.7	-153.9	0	0	112.1	D103 V104 K109 F110	D103-E106 PolarHBondContact O-N 2.94Å; V104-E106 PolarHBondContact O-N 3.15Å; E106-K109 PolarHBondContact O-N 3.48Å; E106-F110 PolarHBondContact O-N 3.49Å; E106-F110 VanDerWaalsContact O-N 3.08Å
107	T	51.1	Low	49.6	Very low	8 Å²	8	79.7 Å²	79.7	5%	0.049	44%	0.438	C	S	.	.	H	α-helix	trans	-66.8	-44.7	174.9	-59.5	0	0	0	0	111.9	D103 V104 K109 F110 F111 L219 N223	D103-T107 WeakPolarHBondContact O-CB 3.44Å; D103-T107 PolarHBondContact O-N 3.06Å; D103-T107 PolarHBondContact O-OG1 3.2Å; V104-T107 PolarHBondContact O-N 2.86Å; V104-T107 VanDerWaalsContact O-N 3.14Å; T107-K109 VanDerWaalsContact C-N 3.34Å; T107-K109 PolarHBondContact O-N 3Å; T107-F110 WeakPolarHBondContact O-CB 3.41Å; T107-F110 PolarHBondContact O-N 3.22Å; T107-F110 VanDerWaalsContact O-N 3.09Å; T107-F111 HydrophobicContact CG2-CD2 3.94Å; T107-F111 HydrophobicContact CG2-CE2 3.69Å; T107-F111 VanDerWaalsContact O-CD2 3.26Å; T107-F111 WeakPolarHBondContact O-CD2 3.29Å; T107-F111 PolarHBondContact O-N 3.32Å; T107-F111 VanDerWaalsContact O-N 3.08Å; T107-L219 HydrophobicContact CG2-CD2 3.85Å; T107-L219 HydrophobicContact CG2-CG 3.92Å; T107-N223 HydrophobicContact CG2-CB 4.02Å; T107-N223 WeakPolarHBondContact CG2-ND2 3.23Å; T107-N223 PolarHBondContact OG1-ND2 2.97Å
108	L	55.1	Low	48.6	Very low	83 Å²	83	83.9 Å²	83.9	44%	0.435	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-41.2	176	-72.8	172.9	0	0	0	111.3	V104 F110 F111 E112 L219	V104-L108 HydrophobicContact CG1-CD1 3.84Å; V104-L108 HydrophobicContact CG1-CG 4.15Å; V104-L108 WeakPolarHBondContact O-CB 3.32Å; V104-L108 WeakPolarHBondContact O-CG 3.31Å; V104-L108 PolarHBondContact O-N 3.36Å; L108-F110 PolarHBondContact O-N 3.03Å; L108-F111 PolarHBondContact O-N 3.46Å; L108-E112 WeakPolarHBondContact O-CB 3.5Å; L108-E112 WeakPolarHBondContact O-CG 3.35Å; L108-E112 PolarHBondContact O-N 2.92Å; L108-L219 HydrophobicContact CD2-CD2 4.45Å
109	K	55.8	Low	47.2	Very low	109 Å²	109	81.8 Å²	81.8	47%	0.474	45%	0.453	S	S	.	.	H	α-helix	trans	-60	-34.2	172.6	-77.1	168.8	-171.1	158.6	0	112.8	E105 E106 T107 A113	E105-K109 WeakPolarHBondContact O-CB 3.46Å; E105-K109 WeakPolarHBondContact O-CD 3.18Å; E105-K109 WeakPolarHBondContact O-CG 3.49Å; E105-K109 PolarHBondContact O-N 3.19Å; E105-K109 VanDerWaalsContact O-N 3.16Å; E105-K109 WeakPolarHBondContact OE1-CE 3.39Å; E105-K109 IonicContact OE1-NZ 3.87Å; E105-K109 PolarHBondContact OE1-NZ 3.07Å; E106-K109 PolarHBondContact O-N 3.48Å; T107-K109 VanDerWaalsContact C-N 3.34Å; T107-K109 PolarHBondContact O-N 3Å; K109-A113 WeakPolarHBondContact O-CB 3.1Å; K109-A113 PolarHBondContact O-N 3.14Å
110	F	46.3	Very low	45.6	Very low	67 Å²	67	87.2 Å²	87.2	29%	0.294	48%	0.481	S	S	.	.	H	α-helix	trans	-67.3	-43.7	175.4	-176	-97.1	0	0	0	111.7	E106 T107 L108 A113 E115	E106-F110 PolarHBondContact O-N 3.49Å; E106-F110 VanDerWaalsContact O-N 3.08Å; T107-F110 WeakPolarHBondContact O-CB 3.41Å; T107-F110 PolarHBondContact O-N 3.22Å; T107-F110 VanDerWaalsContact O-N 3.09Å; L108-F110 PolarHBondContact O-N 3.03Å; F110-A113 PolarHBondContact O-N 3.24Å; F110-E115 HydrophobicContact CE2-CB 4.4Å; F110-E115 WeakPolarHBondContact CE2-OE2 3.38Å; F110-E115 HydrophobicContact CZ-CB 4.28Å
111	F	43.2	Very low	44.2	Very low	99 Å²	99	89.8 Å²	89.8	43%	0.434	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-38.4	173.9	-77	-75.6	0	0	0	112.7	T107 L108 A113 G114 L219	T107-F111 HydrophobicContact CG2-CD2 3.94Å; T107-F111 HydrophobicContact CG2-CE2 3.69Å; T107-F111 VanDerWaalsContact O-CD2 3.26Å; T107-F111 WeakPolarHBondContact O-CD2 3.29Å; T107-F111 PolarHBondContact O-N 3.32Å; T107-F111 VanDerWaalsContact O-N 3.08Å; L108-F111 PolarHBondContact O-N 3.46Å; F111-A113 VanDerWaalsContact C-N 3.32Å; F111-G114 PolarHBondContact O-N 3.29Å; F111-L219 HydrophobicContact CD2-CD1 4.3Å; F111-L219 HydrophobicContact CD2-CD2 4.45Å; F111-L219 HydrophobicContact CE2-CD1 3.45Å; F111-L219 VanDerWaalsContact CE2-CD1 3.45Å; F111-L219 HydrophobicContact CE2-CD2 4.18Å; F111-L219 HydrophobicContact CE2-CG 3.89Å; F111-L219 HydrophobicContact CZ-CD1 3.69Å
112	E	42.3	Very low	42.8	Very low	158 Å²	158	91.5 Å²	91.5	74%	0.738	51%	0.511	S	S	*	.	H	α-helix	trans	-68.8	-28.6	175.6	-73.4	177.2	170.1	0	0	112.8	L108 G114	L108-E112 WeakPolarHBondContact O-CB 3.5Å; L108-E112 WeakPolarHBondContact O-CG 3.35Å; L108-E112 PolarHBondContact O-N 2.92Å; E112-G114 PolarHBondContact O-N 3.26Å
113	A	40.8	Very low	41.3	Very low	71 Å²	71	97.2 Å²	97.2	59%	0.587	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-1.2	178.8	0	0	0	0	0	114	K109 F110 F111 E115	K109-A113 WeakPolarHBondContact O-CB 3.1Å; K109-A113 PolarHBondContact O-N 3.14Å; F110-A113 PolarHBondContact O-N 3.24Å; F111-A113 VanDerWaalsContact C-N 3.32Å; A113-E115 VanDerWaalsContact C-N 3.25Å; A113-E115 PolarHBondContact O-N 3.39Å
114	G	31.9	Very low	39.9	Very low	55 Å²	55	101.6 Å²	101.6	57%	0.567	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.6	20.8	168.7	0	0	0	0	0	114.9	F111 E112 T116	F111-G114 PolarHBondContact O-N 3.29Å; E112-G114 PolarHBondContact O-N 3.26Å; G114-T116 PolarHBondContact O-N 2.7Å
115	E	35.3	Very low	38.6	Very low	141 Å²	141	105.4 Å²	105.4	66%	0.659	59%	0.587	S	S	*	*			trans	-71.3	97.5	171.8	-72.7	-166.9	168.5	0	0	109.4	F110 A113	F110-E115 HydrophobicContact CE2-CB 4.4Å; F110-E115 WeakPolarHBondContact CE2-OE2 3.38Å; F110-E115 HydrophobicContact CZ-CB 4.28Å; A113-E115 VanDerWaalsContact C-N 3.25Å; A113-E115 PolarHBondContact O-N 3.39Å
116	T	33.1	Very low	37.2	Very low	125 Å²	125	106.7 Å²	106.7	77%	0.767	60%	0.604	S	S	*	*			trans	-54.9	140.4	-174.5	44.7	0	0	0	0	114.4	G114 I118	G114-T116 PolarHBondContact O-N 2.7Å; T116-I118 PolarHBondContact O-N 2.95Å
117	F	30	Very low	35.7	Very low	125 Å²	125	111.6 Å²	111.6	55%	0.548	62%	0.624	S	S	.	*			trans	-14.4	115.7	151.9	-161.4	-86.5	0	0	0	113.8	T119 P163	F117-T119 PolarHBondContact O-N 3.25Å; F117-P163 HydrophobicContact CD1-CB 3.96Å; F117-P163 HydrophobicContact CD1-CG 4.47Å; F117-P163 HydrophobicContact CE1-CB 3.24Å; F117-P163 HydrophobicContact CE1-CG 3.46Å; F117-P163 VanDerWaalsContact CE1-CG 3.46Å; F117-P163 HydrophobicContact CE2-CB 3.88Å; F117-P163 HydrophobicContact CZ-CB 3.18Å; F117-P163 HydrophobicContact CZ-CG 3.58Å
118	I	33.3	Very low	34.6	Very low	109 Å²	109	120 Å²	120	56%	0.559	66%	0.66	S	S	*	*			trans	-63	109.2	179.5	-61.6	173.8	0	0	0	108.9	T116 L120	T116-I118 PolarHBondContact O-N 2.95Å; I118-L120 HydrophobicContact CG2-CG 4.43Å; I118-L120 PolarHBondContact O-N 3.23Å; I118-L120 VanDerWaalsContact O-N 3.15Å
119	T	25.6	Very low	33.4	Very low	112 Å²	112	122.3 Å²	122.3	69%	0.687	67%	0.673	S	S	*	*			trans	-63.5	104.5	154.3	43.1	0	0	0	0	107.9	F117 S121	F117-T119 PolarHBondContact O-N 3.25Å; T119-S121 VanDerWaalsContact C-N 3.26Å; T119-S121 PolarHBondContact O-N 2.82Å
120	L	30.2	Very low	32.1	Very low	151 Å²	151	122.6 Å²	122.6	79%	0.791	68%	0.684	S	S	*	*			trans	-68.4	90.5	164.5	-85.4	160.8	0	0	0	107.9	I118 S122	I118-L120 HydrophobicContact CG2-CG 4.43Å; I118-L120 PolarHBondContact O-N 3.23Å; I118-L120 VanDerWaalsContact O-N 3.15Å; L120-S122 PolarHBondContact O-N 3.09Å
121	S	28.1	Very low	31.3	Very low	93 Å²	93	125.3 Å²	125.3	65%	0.65	71%	0.711	S	S	*	*			trans	-62.9	119.3	166.8	-51.5	0	0	0	0	108.7	T119 E123	T119-S121 VanDerWaalsContact C-N 3.26Å; T119-S121 PolarHBondContact O-N 2.82Å; S121-E123 VanDerWaalsContact C-N 3.35Å; S121-E123 PolarHBondContact O-N 3.37Å
122	S	25.4	Very low	30.7	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	73%	0.728	S	S	*	*			trans	-63.6	91.4	165.4	52.8	0	0	0	0	109.7	L120	L120-S122 PolarHBondContact O-N 3.09Å
123	E	28.3	Very low	30	Very low	181 Å²	181	123.7 Å²	123.7	85%	0.846	73%	0.73	S	S	*	*			trans	-109.2	89.9	162.3	-75.4	-169.5	169.1	0	0	108.9	S121 S125	S121-E123 VanDerWaalsContact C-N 3.35Å; S121-E123 PolarHBondContact O-N 3.37Å; E123-S125 PolarHBondContact O-N 3.4Å
124	S	29.4	Very low	29.5	Very low	114 Å²	114	129.4 Å²	129.4	80%	0.797	74%	0.738	S	S	*	*			trans	-64.3	112.5	160	51.4	0	0	0	0	108.9
125	S	29.1	Very low	29.4	Very low	104 Å²	104	135 Å²	135	73%	0.727	74%	0.743	S	S	*	*			trans	-69.5	133.8	164.5	58.9	0	0	0	0	109.9	E123 F127	E123-S125 PolarHBondContact O-N 3.4Å; S125-F127 PolarHBondContact O-N 2.78Å
126	P	26.6	Very low	28.9	Very low	125 Å²	125	134.6 Å²	134.6	81%	0.812	75%	0.75	S	S	*	*			trans	-82.4	112.7	179.2	31.9	-28.8	0	0	0	109.3
127	F	29.8	Very low	28.9	Very low	195 Å²	195	136.2 Å²	136.2	86%	0.855	75%	0.753	S	S	*	*			trans	-92.7	109.5	163.5	-142.2	-90.9	0	0	0	108.4	S125	S125-F127 PolarHBondContact O-N 2.78Å
128	K	26.3	Very low	28.8	Very low	184 Å²	184	134.7 Å²	134.7	80%	0.8	76%	0.758	S	S	*	*			trans	-71.5	128.6	164.8	-83.3	175.2	170.6	176.6	0	108.2
129	D	31.2	Very low	28.9	Very low	132 Å²	132	138.6 Å²	138.6	71%	0.706	77%	0.774	S	S	*	*			trans	-179.5	99	138.6	-91.9	-13.2	0	0	0	108.5
130	T	28.2	Very low	29.1	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	78%	0.783	S	S	*	*				83	107.6	101.7	56.3	0	0	0	0	114.8
131	S	28.3	Very low	29.4	Very low	124 Å²	124	140.7 Å²	140.7	87%	0.867	78%	0.784	S	S	*	*			trans	58.7	118.9	143.2	56.6	0	0	0	0	119.7
132	G	31.1	Very low	29.6	Very low	76 Å²	76	141.2 Å²	141.2	78%	0.784	79%	0.788	S	S	*	*			trans	167.9	79.3	165.1	0	0	0	0	0	112.5
133	D	27.5	Very low	30	Very low	147 Å²	147	143 Å²	143	79%	0.786	79%	0.788	S	S	*	*			trans	-50.7	141.1	174.2	-57.2	-50	0	0	0	113.4
134	Y	29.9	Very low	30.3	Very low	190 Å²	190	138.8 Å²	138.8	75%	0.745	78%	0.779	S	S	*	*				176.8	115.9	109	-114.3	-111.3	0	0	0	114.5
135	Y	30.7	Very low	30.4	Very low	173 Å²	173	137.5 Å²	137.5	68%	0.678	77%	0.77	S	S	*	*			trans	64.3	114.3	138	-69.2	-108.8	0	0	0	123.7
136	V	25.1	Very low	30.5	Very low	132 Å²	132	139.6 Å²	139.6	80%	0.8	77%	0.773	S	S	*	*			trans	-92.7	134.8	150.3	173	0	0	0	0	108.1
137	L	32.7	Very low	30.8	Very low	159 Å²	159	138.6 Å²	138.6	83%	0.832	78%	0.775	S	S	*	*			trans	-129.5	113.9	157.3	-82	172.5	0	0	0	109.3
138	S	28.6	Very low	31	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	77%	0.774	S	S	*	*			trans	-70.9	148.6	157.7	49.2	0	0	0	0	110.3
139	E	34.5	Very low	31.4	Very low	192 Å²	192	133.1 Å²	133.1	90%	0.897	78%	0.778	S	S	*	*				-176.4	143.6	118.1	-101	174.2	-167.5	0	0	113
140	H	29.9	Very low	31.4	Very low	190 Å²	190	136 Å²	136	88%	0.88	79%	0.787	S	S	*	*			trans	-68.3	143.6	175.4	-87.5	-86.4	0	0	0	112.3
141	S	37	Very low	31.8	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	79%	0.789	S	S	*	*			trans	-161.6	136	135.3	34.9	0	0	0	0	111.3
142	S	31.2	Very low	32	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	78%	0.781	S	S	*	*			trans	-64	140.6	174.8	44.1	0	0	0	0	112.6
143	D	34.4	Very low	32.3	Very low	155 Å²	155	136.1 Å²	136.1	83%	0.829	78%	0.78	S	S	*	*				178.1	146.7	106.2	-110.7	-24.9	0	0	0	113.7
144	S	34.4	Very low	32.8	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	78%	0.78	S	S	*	*			trans	68.6	106.1	143	166.4	0	0	0	0	121
145	S	32	Very low	33.5	Very low	87 Å²	87	132.9 Å²	132.9	61%	0.608	78%	0.778	S	S	*	*			trans	59.2	109.7	130.6	73.4	0	0	0	0	119.9
146	N	32.2	Very low	34.6	Very low	148 Å²	148	129.9 Å²	129.9	79%	0.791	78%	0.778	S	S	*	*				160.7	129.3	106.8	-82.5	-47.8	0	0	0	112.1
147	A	32.1	Very low	36.1	Very low	104 Å²	104	132.2 Å²	132.2	86%	0.86	78%	0.78	S	S	*	*			trans	43	102.5	146.8	0	0	0	0	0	118.6
148	A	34.7	Very low	37.5	Very low	101 Å²	101	127.4 Å²	127.4	84%	0.835	76%	0.755	S	S	*	*			trans	-144.6	132.6	158	0	0	0	0	0	111
149	D	33.1	Very low	39.2	Very low	163 Å²	163	127.5 Å²	127.5	87%	0.872	75%	0.753	S	S	*	*			trans	-41.9	126.3	-177.7	-75.2	-51.9	0	0	0	115.2	S151	D149-S151 PolarHBondContact O-N 2.93Å; D149-S151 VanDerWaalsContact O-N 3.16Å
150	E	32.7	Very low	40.7	Very low	193 Å²	193	123.9 Å²	123.9	90%	0.902	74%	0.744	S	S	*	*			trans	-70.5	101	162.9	-70.7	-167.1	159.4	0	0	110.1
151	S	35	Very low	42.1	Very low	108 Å²	108	116.2 Å²	116.2	76%	0.755	71%	0.707	S	S	*	*			trans	-131.4	70	152.1	54	0	0	0	0	108.6	D149 S153	D149-S151 PolarHBondContact O-N 2.93Å; D149-S151 VanDerWaalsContact O-N 3.16Å; S151-S153 PolarHBondContact O-N 3.14Å; S151-S153 VanDerWaalsContact O-N 3.09Å
152	S	33.5	Very low	43.2	Very low	99 Å²	99	113.5 Å²	113.5	69%	0.692	69%	0.688	S	S	*	*			trans	-66.6	101.1	172	43.3	0	0	0	0	109.8	E154	S152-E154 VanDerWaalsContact C-N 3.26Å; S152-E154 PolarHBondContact O-N 2.99Å
153	S	36.8	Very low	44.7	Very low	111 Å²	111	110.6 Å²	110.6	78%	0.776	67%	0.666	S	S	*	*			trans	-68.2	91.1	155.9	55.9	0	0	0	0	107.6	S151 S155	S151-S153 PolarHBondContact O-N 3.14Å; S151-S153 VanDerWaalsContact O-N 3.09Å; S153-S155 PolarHBondContact O-N 3.25Å
154	E	38	Very low	45.5	Very low	167 Å²	167	107.7 Å²	107.7	78%	0.78	66%	0.664	S	S	*	*			trans	-56.3	101.3	169.7	-78.6	-176.3	155.8	0	0	108.8	S152 V156	S152-E154 VanDerWaalsContact C-N 3.26Å; S152-E154 PolarHBondContact O-N 2.99Å; E154-V156 VanDerWaalsContact C-N 3.27Å; E154-V156 PolarHBondContact O-N 3.36Å
155	S	45.3	Very low	46.8	Very low	101 Å²	101	109.2 Å²	109.2	71%	0.706	67%	0.669	S	S	*	*			trans	-72.7	89.2	167.7	47.7	0	0	0	0	107.2	S153 Q157	S153-S155 PolarHBondContact O-N 3.25Å; S155-Q157 VanDerWaalsContact C-N 3.35Å; S155-Q157 PolarHBondContact O-N 2.77Å
156	V	53.5	Low	48.3	Very low	111 Å²	111	110.1 Å²	110.1	67%	0.673	67%	0.665	S	S	*	*			trans	-59.9	99.6	173.4	-179.1	0	0	0	0	107.7	E154 L158	E154-V156 VanDerWaalsContact C-N 3.27Å; E154-V156 PolarHBondContact O-N 3.36Å; V156-L158 PolarHBondContact O-N 3.07Å
157	Q	56.9	Low	50.1	Low	181 Å²	181	105.1 Å²	105.1	85%	0.846	65%	0.648	S	S	*	*			trans	-66.8	114.9	176.2	-75.6	-178.7	-8.2	0	0	108.6	S155	S155-Q157 VanDerWaalsContact C-N 3.35Å; S155-Q157 PolarHBondContact O-N 2.77Å
158	L	62.4	Low	52.2	Low	57 Å²	57	104 Å²	104	30%	0.298	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-72.4	146.3	175.5	-68.3	170.9	0	0	0	110.2	V156 E173 K194 R195	V156-L158 PolarHBondContact O-N 3.07Å; L158-E173 HydrophobicContact CD1-CB 4.21Å; L158-E173 HydrophobicContact CD1-CG 3.96Å; L158-K194 HydrophobicContact CD1-CB 4.14Å; L158-R195 HydrophobicContact CB-CB 4.44Å; L158-R195 HydrophobicContact CB-CG 4.28Å; L158-R195 HydrophobicContact CD1-CB 4.32Å
159	P	63.5	Low	54.6	Low	96 Å²	96	99.6 Å²	99.6	62%	0.623	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-59.2	158	178.7	23.1	-32.2	0	0	0	112.5	Y161	P159-Y161 PolarHBondContact O-N 3.18Å
160	V	66.9	Low	57.2	Low	115 Å²	115	93.6 Å²	93.6	70%	0.697	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-63.3	119.3	177.6	-179.1	0	0	0	0	109.5
161	Y	59	Low	59.8	Low	29 Å²	29	85 Å²	85	11%	0.114	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-79.2	124.4	176.9	173.3	-118.9	0	0	0	111.6	P159 P163 M166 G167 R169 E239	P159-Y161 PolarHBondContact O-N 3.18Å; Y161-P163 HydrophobicContact CD1-CG 3.95Å; Y161-P163 HydrophobicContact CE1-CB 3.93Å; Y161-P163 HydrophobicContact CE1-CG 3.45Å; Y161-P163 VanDerWaalsContact CE1-CG 3.45Å; Y161-M166 HydrophobicContact CD2-CB 4.04Å; Y161-M166 HydrophobicContact CD2-SD 4.15Å; Y161-M166 HydrophobicContact CE2-CB 3.99Å; Y161-G167 VanDerWaalsContact CE2-O 3.23Å; Y161-G167 WeakPolarHBondContact CE2-O 3.43Å; Y161-G167 PolarHBondContact OH-O 3.45Å; Y161-R169 HydrophobicContact CD1-CG 3.96Å; Y161-R169 HydrophobicContact CD2-CG 3.53Å; Y161-R169 VanDerWaalsContact CE1-CD 3.49Å; Y161-R169 HydrophobicContact CE1-CG 3.69Å; Y161-R169 HydrophobicContact CE2-CG 3.3Å; Y161-R169 HydrophobicContact CG-CG 3.84Å; Y161-E239 WeakPolarHBondContact CE1-OE2 3.45Å
162	C	60	Low	62.4	Low	61 Å²	61	84.9 Å²	84.9	41%	0.412	52%	0.518	S	S	.	.			trans	-117.5	94.6	175.5	-67.6	0	0	0	0	109.1	A164 V165 M166	C162-A164 PolarHBondContact O-N 3.27Å; C162-A164 VanDerWaalsContact O-N 3.12Å; C162-V165 HydrophobicContact CB-CB 4.44Å; C162-V165 PolarHBondContact O-N 3.36Å; C162-M166 HydrophobicContact CB-CG 4.48Å; C162-M166 HydrophobicContact CB-SD 4.33Å; C162-M166 PolarHBondContact N-SD 3.29Å; C162-M166 VanDerWaalsContact N-SD 3.4Å; C162-M166 WeakPolarHBondContact O-CB 3.44Å; C162-M166 PolarHBondContact O-N 2.97Å
163	P	61.5	Low	65	Low	41 Å²	41	82.3 Å²	82.3	27%	0.266	50%	0.495	S	S	.	.	H	α-helix	trans	-55	-36.3	-172.8	-17.1	17.8	0	0	0	114.3	F117 Y161 V165 G167	F117-P163 HydrophobicContact CD1-CB 3.96Å; F117-P163 HydrophobicContact CD1-CG 4.47Å; F117-P163 HydrophobicContact CE1-CB 3.24Å; F117-P163 HydrophobicContact CE1-CG 3.46Å; F117-P163 VanDerWaalsContact CE1-CG 3.46Å; F117-P163 HydrophobicContact CE2-CB 3.88Å; F117-P163 HydrophobicContact CZ-CB 3.18Å; F117-P163 HydrophobicContact CZ-CG 3.58Å; Y161-P163 HydrophobicContact CD1-CG 3.95Å; Y161-P163 HydrophobicContact CE1-CB 3.93Å; Y161-P163 HydrophobicContact CE1-CG 3.45Å; Y161-P163 VanDerWaalsContact CE1-CG 3.45Å; P163-V165 PolarHBondContact O-N 3.45Å; P163-G167 PolarHBondContact O-N 3Å
164	A	52.3	Low	67.6	Low	95 Å²	95	77.4 Å²	77.4	79%	0.785	46%	0.46	S	S	*	.	H	α-helix	trans	-63.5	-20.7	179.6	0	0	0	0	0	113.9	C162	C162-A164 PolarHBondContact O-N 3.27Å; C162-A164 VanDerWaalsContact O-N 3.12Å
165	V	62.4	Low	70.2	Confident	126 Å²	126	74.4 Å²	74.4	76%	0.764	45%	0.445	S	S	*	.	H	α-helix	trans	-113.8	-33.5	-177.2	-175	0	0	0	0	111.5	C162 P163	C162-V165 HydrophobicContact CB-CB 4.44Å; C162-V165 PolarHBondContact O-N 3.36Å; P163-V165 PolarHBondContact O-N 3.45Å
166	M	61.7	Low	72.4	Confident	106 Å²	106	72.5 Å²	72.5	52%	0.522	43%	0.431	S	S	.	.	H	α-helix	trans	-100.6	-5.9	-166.2	-61.6	179	72.9	0	0	114.3	Y161 C162	Y161-M166 HydrophobicContact CD2-CB 4.04Å; Y161-M166 HydrophobicContact CD2-SD 4.15Å; Y161-M166 HydrophobicContact CE2-CB 3.99Å; C162-M166 HydrophobicContact CB-CG 4.48Å; C162-M166 HydrophobicContact CB-SD 4.33Å; C162-M166 PolarHBondContact N-SD 3.29Å; C162-M166 VanDerWaalsContact N-SD 3.4Å; C162-M166 WeakPolarHBondContact O-CB 3.44Å; C162-M166 PolarHBondContact O-N 2.97Å
167	G	70.4	Confident	74.2	Confident	42 Å²	42	70.6 Å²	70.6	43%	0.433	42%	0.417	S	S	.	.			trans	67.6	-160.4	-176.3	0	0	0	0	0	112.3	Y161 P163	Y161-G167 VanDerWaalsContact CE2-O 3.23Å; Y161-G167 WeakPolarHBondContact CE2-O 3.43Å; Y161-G167 PolarHBondContact OH-O 3.45Å; P163-G167 PolarHBondContact O-N 3Å
168	C	75.9	Confident	75.8	Confident	82 Å²	82	63.3 Å²	63.3	55%	0.554	38%	0.384	S	S	*	.	S	Bend	trans	-72.6	138.9	-179.7	-62.5	0	0	0	0	111.7	V242	C168-V242 HydrophobicContact CB-CG2 4.14Å
169	R	86	Confident	77.2	Confident	7 Å²	7	66.4 Å²	66.4	3%	0.026	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-69.5	158.7	175.7	-63.5	168.1	71.7	-173.3	1.6	112.4	Y161 E173 E193 E239 V241 V242	Y161-R169 HydrophobicContact CD1-CG 3.96Å; Y161-R169 HydrophobicContact CD2-CG 3.53Å; Y161-R169 VanDerWaalsContact CE1-CD 3.49Å; Y161-R169 HydrophobicContact CE1-CG 3.69Å; Y161-R169 HydrophobicContact CE2-CG 3.3Å; Y161-R169 HydrophobicContact CG-CG 3.84Å; R169-E173 IonicContact CZ-OE2 3.89Å; R169-E173 IonicContact NE-OE1 3.53Å; R169-E173 IonicContact NE-OE2 3.14Å; R169-E173 PolarHBondContact NE-OE2 3.27Å; R169-E173 IonicContact NH2-OE2 3Å; R169-E173 PolarHBondContact NH2-OE2 3.17Å; R169-E193 IonicContact CZ-OE1 3.61Å; R169-E193 VanDerWaalsContact CZ-OE1 3.28Å; R169-E193 IonicContact NH1-OE1 3.72Å; R169-E193 PolarHBondContact NH1-OE1 3.04Å; R169-E193 IonicContact NH2-OE1 2.71Å; R169-E193 PolarHBondContact NH2-OE1 2.85Å; R169-E239 WeakPolarHBondContact CD-OE1 3.3Å; R169-E239 WeakPolarHBondContact CD-OE2 3.01Å; R169-E239 IonicContact CZ-OE1 2.86Å; R169-E239 IonicContact NE-OE1 3.71Å; R169-E239 IonicContact NH1-OE1 2.94Å; R169-E239 PolarHBondContact NH1-OE1 3.27Å; R169-V241 HydrophobicContact CB-CG1 4.04Å; R169-V241 WeakPolarHBondContact O-CA 3.44Å; R169-V241 WeakPolarHBondContact O-CB 3.38Å; R169-V242 PolarHBondContact O-N 3.46Å
170	S	86.5	Confident	78.3	Confident	37 Å²	37	64.9 Å²	64.9	26%	0.259	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-75.4	139.6	169.8	-177.8	0	0	0	0	111.1	D172 E173 V242	S170-D172 PolarHBondContact O-N 3.29Å; S170-D172 VanDerWaalsContact O-N 3.13Å; S170-D172 WeakPolarHBondContact OG-CB 3.23Å; S170-D172 VanDerWaalsContact OG-CG 3.32Å; S170-D172 PolarHBondContact OG-N 3.22Å; S170-D172 VanDerWaalsContact OG-N 3.08Å; S170-D172 PolarHBondContact OG-OD2 3.36Å; S170-E173 WeakPolarHBondContact O-CB 3.41Å; S170-E173 PolarHBondContact O-N 3.41Å; S170-E173 VanDerWaalsContact O-N 3.14Å; S170-V242 VanDerWaalsContact CA-O 3.3Å; S170-V242 WeakPolarHBondContact CA-O 3.12Å
171	V	88.3	Confident	79	Confident	14 Å²	14	63.6 Å²	63.6	9%	0.085	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-59.1	-20.5	168	74.7	0	0	0	0	112.3	E173 F174 L202 V241 V242 Y250	V171-E173 PolarHBondContact O-N 3.13Å; V171-F174 WeakPolarHBondContact O-CB 3.29Å; V171-F174 PolarHBondContact O-N 3.15Å; V171-L202 HydrophobicContact CG2-CD1 4.29Å; V171-V241 HydrophobicContact CB-CG2 4.12Å; V171-V241 HydrophobicContact CG2-CG2 4.16Å; V171-V242 PolarHBondContact N-O 2.95Å; V171-Y250 HydrophobicContact CB-CD2 4.15Å; V171-Y250 HydrophobicContact CB-CE2 4.34Å; V171-Y250 HydrophobicContact CG1-CE2 4.39Å; V171-Y250 HydrophobicContact CG2-CD2 3.69Å; V171-Y250 HydrophobicContact CG2-CE2 3.86Å; V171-Y250 HydrophobicContact CG2-CG 4.13Å
172	D	88.6	Confident	80	Confident	105 Å²	105	67.2 Å²	67.2	56%	0.561	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-65.6	-16.3	177.8	-59.3	-39.1	0	0	0	112.9	S170 F174 K194	S170-D172 PolarHBondContact O-N 3.29Å; S170-D172 VanDerWaalsContact O-N 3.13Å; S170-D172 WeakPolarHBondContact OG-CB 3.23Å; S170-D172 VanDerWaalsContact OG-CG 3.32Å; S170-D172 PolarHBondContact OG-N 3.22Å; S170-D172 VanDerWaalsContact OG-N 3.08Å; S170-D172 PolarHBondContact OG-OD2 3.36Å; D172-F174 PolarHBondContact O-N 3Å; D172-K194 VanDerWaalsContact O-CE 3.3Å; D172-K194 WeakPolarHBondContact O-CE 3.31Å; D172-K194 PolarHBondContact O-NZ 3.42Å
173	E	88.9	Confident	80.5	Confident	44 Å²	44	65.8 Å²	65.8	21%	0.206	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-74.7	-1.7	171	-64.1	-175.5	-131.8	0	0	113.3	L158 R169 S170 V171 K194	L158-E173 HydrophobicContact CD1-CB 4.21Å; L158-E173 HydrophobicContact CD1-CG 3.96Å; R169-E173 IonicContact CZ-OE2 3.89Å; R169-E173 IonicContact NE-OE1 3.53Å; R169-E173 IonicContact NE-OE2 3.14Å; R169-E173 PolarHBondContact NE-OE2 3.27Å; R169-E173 IonicContact NH2-OE2 3Å; R169-E173 PolarHBondContact NH2-OE2 3.17Å; S170-E173 WeakPolarHBondContact O-CB 3.41Å; S170-E173 PolarHBondContact O-N 3.41Å; S170-E173 VanDerWaalsContact O-N 3.14Å; V171-E173 PolarHBondContact O-N 3.13Å; E173-K194 VanDerWaalsContact O-CB 3.26Å; E173-K194 WeakPolarHBondContact O-CB 3.44Å; E173-K194 VanDerWaalsContact O-CG 3.28Å; E173-K194 WeakPolarHBondContact O-CG 3.2Å; E173-K194 PolarHBondContact O-N 3.13Å
174	F	92.3	Very high	80.7	Confident	9 Å²	9	66.5 Å²	66.5	4%	0.039	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.3	178.5	-59.6	-96.6	0	0	0	110.2	V171 D172 C176 A191 L192 E193 V200 L202 V241 V252	V171-F174 WeakPolarHBondContact O-CB 3.29Å; V171-F174 PolarHBondContact O-N 3.15Å; D172-F174 PolarHBondContact O-N 3Å; F174-C176 PolarHBondContact O-N 2.88Å; F174-A191 HydrophobicContact CB-CB 4.24Å; F174-L192 CarbonylContact C-O 3.59Å; F174-L192 WeakPolarHBondContact CA-O 3.43Å; F174-E193 HydrophobicContact CD1-CB 3.97Å; F174-E193 HydrophobicContact CD1-CG 4.29Å; F174-E193 HydrophobicContact CE1-CB 3.85Å; F174-E193 HydrophobicContact CE1-CG 3.86Å; F174-E193 HydrophobicContact CZ-CG 4.36Å; F174-V200 HydrophobicContact CD1-CG2 3.69Å; F174-V200 HydrophobicContact CE1-CG2 3.91Å; F174-L202 HydrophobicContact CB-CD1 3.93Å; F174-L202 HydrophobicContact CD1-CD2 4.3Å; F174-L202 HydrophobicContact CG-CD1 4.35Å; F174-L202 HydrophobicContact CG-CD2 4.42Å; F174-V241 HydrophobicContact CE2-CB 4.42Å; F174-V241 HydrophobicContact CE2-CG1 3.77Å; F174-V241 HydrophobicContact CE2-CG2 4.37Å; F174-V241 HydrophobicContact CZ-CG1 4.22Å; F174-V252 HydrophobicContact CE1-CG1 3.9Å; F174-V252 HydrophobicContact CE1-CG2 4.23Å; F174-V252 HydrophobicContact CE2-CG2 4.35Å; F174-V252 HydrophobicContact CZ-CG1 4.18Å; F174-V252 HydrophobicContact CZ-CG2 3.86Å
175	H	92.4	Very high	81.4	Confident	103 Å²	103	64.1 Å²	64.1	48%	0.477	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	102.6	172.6	-178.9	64.5	0	0	0	109.6	L177 A191 L192	H175-L177 PolarHBondContact O-N 2.67Å; H175-A191 CarbonylContact O-C 3.57Å; H175-A191 VanDerWaalsContact O-CA 3.27Å; H175-A191 WeakPolarHBondContact O-CA 3.3Å; H175-L192 HydrophobicContact CB-CB 4.35Å; H175-L192 PolarHBondContact N-O 3.26Å; H175-L192 PolarHBondContact O-N 3.44Å
176	C	91.5	Very high	82	Confident	61 Å²	61	58.2 Å²	58.2	41%	0.412	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	120	176.8	-69	0	0	0	0	110.6	F174	F174-C176 PolarHBondContact O-N 2.88Å
177	L	90.6	Very high	83.2	Confident	71 Å²	71	53.9 Å²	53.9	37%	0.372	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-62.8	-177.7	-61.8	174.3	0	0	0	111.1	H175 R190 L192	H175-L177 PolarHBondContact O-N 2.67Å; L177-R190 HydrophobicContact CB-CB 4.46Å; L177-R190 WeakPolarHBondContact CB-O 3.34Å; L177-R190 HydrophobicContact CD1-CG 4.18Å; L177-R190 PolarHBondContact N-O 2.72Å; L177-L192 HydrophobicContact CD1-CB 4.38Å; L177-L192 HydrophobicContact CD2-CB 4.45Å; L177-L192 HydrophobicContact CG-CB 4.46Å
178	N	91.3	Very high	84.2	Confident	29 Å²	29	52.9 Å²	52.9	16%	0.155	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157.8	-177.7	62.3	-73.4	0	0	0	111.6	Y189 R190 S480	N178-Y189 WeakPolarHBondContact O-CA 3.38Å; N178-R190 PolarHBondContact N-O 3.4Å; N178-R190 PolarHBondContact O-N 2.94Å; N178-R190 WeakPolarHBondContact OD1-CD 3.01Å; N178-S480 PolarHBondContact ND2-O 2.86Å
179	R	90.6	Very high	85	Confident	121 Å²	121	51.7 Å²	51.7	46%	0.457	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	130.2	171.8	-168.3	-176.7	-167.4	-173.5	12	109.2	E182 V187 Y189	R179-E182 IonicContact CZ-OE2 3.48Å; R179-E182 VanDerWaalsContact CZ-OE2 3.25Å; R179-E182 IonicContact NH1-OE2 2.68Å; R179-E182 PolarHBondContact NH1-OE2 3.4Å; R179-E182 IonicContact NH2-OE1 3.45Å; R179-E182 PolarHBondContact NH2-OE1 3.1Å; R179-E182 IonicContact NH2-OE2 3.46Å; R179-E182 PolarHBondContact NH2-OE2 3.23Å; R179-V187 HydrophobicContact CG-CG1 3.82Å; R179-V187 VanDerWaalsContact NH2-CG2 3.35Å; R179-Y189 HydrophobicContact CB-CD1 4.23Å; R179-Y189 HydrophobicContact CB-CE1 4.28Å; R179-Y189 HydrophobicContact CG-CD1 4.42Å; R179-Y189 HydrophobicContact CG-CE1 4.24Å
180	I	86.7	Confident	85.4	Confident	64 Å²	64	53.5 Å²	53.5	33%	0.328	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-59.5	177.2	-58.7	166.8	0	0	0	109	V188 R190 Y255	I180-V188 HydrophobicContact CD1-CG1 4.2Å; I180-V188 PolarHBondContact N-O 2.66Å; I180-R190 HydrophobicContact CD1-CB 3.72Å; I180-R190 HydrophobicContact CD1-CG 4.44Å; I180-R190 HydrophobicContact CG1-CB 3.83Å; I180-Y255 HydrophobicContact CD1-CD2 3.95Å; I180-Y255 HydrophobicContact CD1-CE2 3.66Å
181	E	81.7	Confident	85.8	Confident	88 Å²	88	51.8 Å²	51.8	41%	0.411	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	153.1	-169.6	-171.9	167.8	-162	0	0	112.1	V188	E181-V188 HydrophobicContact CB-CB 4.43Å; E181-V188 PolarHBondContact N-O 3.19Å; E181-V188 PolarHBondContact O-N 3.37Å
182	E	81.2	Confident	86.1	Confident	106 Å²	106	53.9 Å²	53.9	50%	0.495	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	111.2	168.2	178.8	166.4	-151	0	0	108.6	R179 V187	R179-E182 IonicContact CZ-OE2 3.48Å; R179-E182 VanDerWaalsContact CZ-OE2 3.25Å; R179-E182 IonicContact NH1-OE2 2.68Å; R179-E182 PolarHBondContact NH1-OE2 3.4Å; R179-E182 IonicContact NH2-OE1 3.45Å; R179-E182 PolarHBondContact NH2-OE1 3.1Å; R179-E182 IonicContact NH2-OE2 3.46Å; R179-E182 PolarHBondContact NH2-OE2 3.23Å; E182-V187 HydrophobicContact CG-CG2 4.29Å
183	G	69.8	Low	86.3	Confident	31 Å²	31	49.4 Å²	49.4	32%	0.32	25%	0.246	S	C	.	.			trans	-108.4	-178.6	178.2	0	0	0	0	0	112.7	Y185 G186 K206	G183-Y185 VanDerWaalsContact C-N 3.34Å; G183-Y185 PolarHBondContact O-N 3.23Å; G183-G186 PolarHBondContact N-O 3.35Å; G183-K206 PolarHBondContact O-NZ 3.12Å
184	T	65.4	Low	86.5	Confident	56 Å²	56	53.1 Å²	53.1	34%	0.344	26%	0.262	S	S	.	.	S	Bend	trans	-59	-46.7	175.4	-52.1	0	0	0	0	110.6	G186 K206	T184-G186 PolarHBondContact O-N 3.01Å; T184-K206 PolarHBondContact O-NZ 3.2Å
185	Y	66.3	Low	86.2	Confident	45 Å²	45	56.9 Å²	56.9	18%	0.176	28%	0.276	C	S	.	.	S	Bend	trans	-81.2	-13.3	-174.3	-58	-70.9	0	0	0	115.4	G183 K206 L320	G183-Y185 VanDerWaalsContact C-N 3.34Å; G183-Y185 PolarHBondContact O-N 3.23Å; Y185-K206 PolarHBondContact O-N 3.41Å; Y185-L320 WeakPolarHBondContact OH-CD2 3.49Å; Y185-L320 WeakPolarHBondContact OH-CG 3.23Å
186	G	76.7	Confident	86.1	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-180	-167.5	0	0	0	0	0	115.8	G183 T184 R204	G183-G186 PolarHBondContact N-O 3.35Å; T184-G186 PolarHBondContact O-N 3.01Å; G186-R204 WeakPolarHBondContact CA-O 3.47Å
187	V	87	Confident	86.1	Confident	15 Å²	15	55 Å²	55	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129	170.7	-176	0	0	0	0	108.1	R179 E182 Y189 R204	R179-V187 HydrophobicContact CG-CG1 3.82Å; R179-V187 VanDerWaalsContact NH2-CG2 3.35Å; E182-V187 HydrophobicContact CG-CG2 4.29Å; V187-Y189 HydrophobicContact CB-CE2 3.77Å; V187-Y189 HydrophobicContact CG1-CD2 4.21Å; V187-Y189 HydrophobicContact CG1-CE1 4.11Å; V187-Y189 HydrophobicContact CG1-CE2 3.53Å; V187-Y189 VanDerWaalsContact CG1-CZ 3.47Å; V187-R204 PolarHBondContact N-O 2.75Å; V187-R204 PolarHBondContact O-N 2.98Å
188	V	91	Very high	86.2	Confident	22 Å²	22	55.6 Å²	55.6	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.6	179.2	-170.3	0	0	0	0	109.5	I180 E181 A201 L202 K203	I180-V188 HydrophobicContact CD1-CG1 4.2Å; I180-V188 PolarHBondContact N-O 2.66Å; E181-V188 HydrophobicContact CB-CB 4.43Å; E181-V188 PolarHBondContact N-O 3.19Å; E181-V188 PolarHBondContact O-N 3.37Å; V188-A201 HydrophobicContact CG1-CB 4.21Å; V188-L202 CarbonylContact C-O 3.6Å; V188-L202 WeakPolarHBondContact CA-O 3.24Å; V188-K203 HydrophobicContact CG2-CB 4.24Å; V188-K203 HydrophobicContact CG2-CG 4.08Å
189	Y	92.7	Very high	86.3	Confident	56 Å²	56	56.1 Å²	56.1	22%	0.22	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.9	177.4	-59.1	-91.6	0	0	0	110.2	N178 R179 V187 A201 L202 R204 Y250	N178-Y189 WeakPolarHBondContact O-CA 3.38Å; R179-Y189 HydrophobicContact CB-CD1 4.23Å; R179-Y189 HydrophobicContact CB-CE1 4.28Å; R179-Y189 HydrophobicContact CG-CD1 4.42Å; R179-Y189 HydrophobicContact CG-CE1 4.24Å; V187-Y189 HydrophobicContact CB-CE2 3.77Å; V187-Y189 HydrophobicContact CG1-CD2 4.21Å; V187-Y189 HydrophobicContact CG1-CE1 4.11Å; V187-Y189 HydrophobicContact CG1-CE2 3.53Å; V187-Y189 VanDerWaalsContact CG1-CZ 3.47Å; Y189-A201 CarbonylContact O-C 3.56Å; Y189-A201 WeakPolarHBondContact O-CA 3.12Å; Y189-L202 PolarHBondContact N-O 3.11Å; Y189-L202 PolarHBondContact O-N 2.78Å; Y189-R204 HydrophobicContact CE2-CB 4.23Å; Y189-Y250 HydrophobicContact CD2-CE1 4.31Å; Y189-Y250 HydrophobicContact CE2-CE1 4.33Å
190	R	93.9	Very high	86.5	Confident	46 Å²	46	50.4 Å²	50.4	17%	0.174	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.7	163.2	-165.6	176.8	165.4	-120.9	1	107.5	L177 N178 I180 V199 Y255	L177-R190 HydrophobicContact CB-CB 4.46Å; L177-R190 WeakPolarHBondContact CB-O 3.34Å; L177-R190 HydrophobicContact CD1-CG 4.18Å; L177-R190 PolarHBondContact N-O 2.72Å; N178-R190 PolarHBondContact N-O 3.4Å; N178-R190 PolarHBondContact O-N 2.94Å; N178-R190 WeakPolarHBondContact OD1-CD 3.01Å; I180-R190 HydrophobicContact CD1-CB 3.72Å; I180-R190 HydrophobicContact CD1-CG 4.44Å; I180-R190 HydrophobicContact CG1-CB 3.83Å; R190-V199 HydrophobicContact CG-CG1 3.7Å; R190-Y255 HydrophobicContact CB-CE2 4.48Å; R190-Y255 HydrophobicContact CG-CD2 4.11Å; R190-Y255 HydrophobicContact CG-CE2 3.86Å
191	A	94.7	Very high	86.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	154.7	178.5	0	0	0	0	0	111.4	F174 H175 V199 V200 L202	F174-A191 HydrophobicContact CB-CB 4.24Å; H175-A191 CarbonylContact O-C 3.57Å; H175-A191 VanDerWaalsContact O-CA 3.27Å; H175-A191 WeakPolarHBondContact O-CA 3.3Å; A191-V199 CarbonylContact O-C 3.55Å; A191-V199 WeakPolarHBondContact O-CA 3.38Å; A191-V200 HydrophobicContact CB-CG2 4.16Å; A191-V200 PolarHBondContact N-O 3.01Å; A191-V200 PolarHBondContact O-N 2.82Å; A191-L202 HydrophobicContact CB-CD1 3.46Å; A191-L202 VanDerWaalsContact CB-CD1 3.46Å; A191-L202 HydrophobicContact CB-CG 3.79Å
192	L	94.9	Very high	87.3	Confident	59 Å²	59	43.5 Å²	43.5	31%	0.309	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.2	171.8	-172.8	75.2	0	0	0	108.4	F174 H175 L177 K194 G197 V199	F174-L192 CarbonylContact C-O 3.59Å; F174-L192 WeakPolarHBondContact CA-O 3.43Å; H175-L192 HydrophobicContact CB-CB 4.35Å; H175-L192 PolarHBondContact N-O 3.26Å; H175-L192 PolarHBondContact O-N 3.44Å; L177-L192 HydrophobicContact CD1-CB 4.38Å; L177-L192 HydrophobicContact CD2-CB 4.45Å; L177-L192 HydrophobicContact CG-CB 4.46Å; L192-K194 PolarHBondContact O-N 2.93Å; L192-G197 WeakPolarHBondContact CD1-O 3.38Å; L192-V199 HydrophobicContact CD1-CG2 4.03Å
193	E	93.8	Very high	87.7	Confident	10 Å²	10	39.1 Å²	39.1	5%	0.047	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	119.6	171.3	-178.5	-178.4	-173.5	0	0	109.2	R169 F174 R195 T196 G197 E198	R169-E193 IonicContact CZ-OE1 3.61Å; R169-E193 VanDerWaalsContact CZ-OE1 3.28Å; R169-E193 IonicContact NH1-OE1 3.72Å; R169-E193 PolarHBondContact NH1-OE1 3.04Å; R169-E193 IonicContact NH2-OE1 2.71Å; R169-E193 PolarHBondContact NH2-OE1 2.85Å; F174-E193 HydrophobicContact CD1-CB 3.97Å; F174-E193 HydrophobicContact CD1-CG 4.29Å; F174-E193 HydrophobicContact CE1-CB 3.85Å; F174-E193 HydrophobicContact CE1-CG 3.86Å; F174-E193 HydrophobicContact CZ-CG 4.36Å; E193-R195 HydrophobicContact CG-CB 4.35Å; E193-R195 PolarHBondContact O-N 3.02Å; E193-R195 IonicContact OE1-NE 2.74Å; E193-T196 WeakPolarHBondContact CB-OG1 3.37Å; E193-T196 WeakPolarHBondContact CG-OG1 3.42Å; E193-T196 WeakPolarHBondContact OE2-CG2 3.42Å; E193-T196 PolarHBondContact OE2-OG1 2.98Å; E193-G197 VanDerWaalsContact O-CA 3.31Å; E193-G197 WeakPolarHBondContact O-CA 3.38Å; E193-G197 PolarHBondContact O-N 3.37Å; E193-E198 PolarHBondContact N-O 3.5Å
194	K	91.8	Very high	88.5	Confident	122 Å²	122	42 Å²	42	53%	0.53	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.4	-175.2	-66.9	176.1	-179.5	174.4	0	113	L158 D172 E173 L192	L158-K194 HydrophobicContact CD1-CB 4.14Å; D172-K194 VanDerWaalsContact O-CE 3.3Å; D172-K194 WeakPolarHBondContact O-CE 3.31Å; D172-K194 PolarHBondContact O-NZ 3.42Å; E173-K194 VanDerWaalsContact O-CB 3.26Å; E173-K194 WeakPolarHBondContact O-CB 3.44Å; E173-K194 VanDerWaalsContact O-CG 3.28Å; E173-K194 WeakPolarHBondContact O-CG 3.2Å; E173-K194 PolarHBondContact O-N 3.13Å; L192-K194 PolarHBondContact O-N 2.93Å
195	R	87.3	Confident	89.2	Confident	89 Å²	89	39.5 Å²	39.5	34%	0.336	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-40.7	-175.9	-169.9	173	68.8	134.1	-5.2	113.1	L158 E193	L158-R195 HydrophobicContact CB-CB 4.44Å; L158-R195 HydrophobicContact CB-CG 4.28Å; L158-R195 HydrophobicContact CD1-CB 4.32Å; E193-R195 HydrophobicContact CG-CB 4.35Å; E193-R195 PolarHBondContact O-N 3.02Å; E193-R195 IonicContact OE1-NE 2.74Å
196	T	89.9	Confident	89.4	Confident	75 Å²	75	41.4 Å²	41.4	46%	0.46	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-18.7	-173.5	58.9	0	0	0	0	112.6	E193 E198	E193-T196 WeakPolarHBondContact CB-OG1 3.37Å; E193-T196 WeakPolarHBondContact CG-OG1 3.42Å; E193-T196 WeakPolarHBondContact OE2-CG2 3.42Å; E193-T196 PolarHBondContact OE2-OG1 2.98Å; T196-E198 PolarHBondContact O-N 3.11Å; T196-E198 WeakPolarHBondContact OG1-CB 3.38Å; T196-E198 PolarHBondContact OG1-N 2.7Å
197	G	90.2	Very high	88.9	Confident	48 Å²	48	43.6 Å²	43.6	50%	0.495	22%	0.215	S	C	.	.			trans	71.6	11.6	-169.2	0	0	0	0	0	113.2	L192 E193	L192-G197 WeakPolarHBondContact CD1-O 3.38Å; E193-G197 VanDerWaalsContact O-CA 3.31Å; E193-G197 WeakPolarHBondContact O-CA 3.38Å; E193-G197 PolarHBondContact O-N 3.37Å
198	E	93.2	Very high	87.8	Confident	84 Å²	84	48.7 Å²	48.7	39%	0.393	24%	0.238	S	C	.	.			trans	-84.9	142.5	-177.4	-166.2	176.2	179	0	0	112	E193 T196 R238	E193-E198 PolarHBondContact N-O 3.5Å; T196-E198 PolarHBondContact O-N 3.11Å; T196-E198 WeakPolarHBondContact OG1-CB 3.38Å; T196-E198 PolarHBondContact OG1-N 2.7Å; E198-R238 VanDerWaalsContact CD-NH2 3.26Å; E198-R238 IonicContact OE1-CZ 3.87Å; E198-R238 IonicContact OE1-NH1 2.95Å; E198-R238 PolarHBondContact OE1-NH1 3.4Å; E198-R238 IonicContact OE1-NH2 3.9Å; E198-R238 PolarHBondContact OE1-NH2 2.81Å; E198-R238 IonicContact OE2-CZ 2.7Å; E198-R238 IonicContact OE2-NH1 3.93Å; E198-R238 PolarHBondContact OE2-NH1 3Å; E198-R238 IonicContact OE2-NH2 3.29Å; E198-R238 PolarHBondContact OE2-NH2 3.33Å
199	V	93.4	Very high	86.1	Confident	41 Å²	41	58 Å²	58	25%	0.248	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.6	174.3	-179.3	0	0	0	0	109.8	R190 A191 L192 Y255	R190-V199 HydrophobicContact CG-CG1 3.7Å; A191-V199 CarbonylContact O-C 3.55Å; A191-V199 WeakPolarHBondContact O-CA 3.38Å; L192-V199 HydrophobicContact CD1-CG2 4.03Å; V199-Y255 HydrophobicContact CG1-CD1 3.75Å; V199-Y255 HydrophobicContact CG1-CD2 4.49Å; V199-Y255 HydrophobicContact CG1-CE1 4.26Å; V199-Y255 HydrophobicContact CG1-CG 3.86Å; V199-Y255 WeakPolarHBondContact O-CB 3.41Å
200	V	94.1	Very high	84.3	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	161.9	-179	-60.9	0	0	0	0	111.3	F174 A191 L202 V252	F174-V200 HydrophobicContact CD1-CG2 3.69Å; F174-V200 HydrophobicContact CE1-CG2 3.91Å; A191-V200 HydrophobicContact CB-CG2 4.16Å; A191-V200 PolarHBondContact N-O 3.01Å; A191-V200 PolarHBondContact O-N 2.82Å; V200-L202 HydrophobicContact CG2-CD2 4.32Å; V200-L202 HydrophobicContact CG2-CG 4.46Å; V200-V252 HydrophobicContact CB-CG1 4.05Å; V200-V252 HydrophobicContact CG1-CG1 4.18Å; V200-V252 HydrophobicContact CG2-CG1 4.11Å
201	A	93.9	Very high	82.5	Confident	8 Å²	8	65.6 Å²	65.6	7%	0.066	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.6	169.8	0	0	0	0	0	109.8	V188 Y189 M253 Y255	V188-A201 HydrophobicContact CG1-CB 4.21Å; Y189-A201 CarbonylContact O-C 3.56Å; Y189-A201 WeakPolarHBondContact O-CA 3.12Å; A201-M253 HydrophobicContact CB-CB 4.35Å; A201-M253 HydrophobicContact CB-CE 4.15Å; A201-M253 PolarHBondContact N-O 2.91Å; A201-M253 PolarHBondContact O-N 2.78Å; A201-Y255 HydrophobicContact CB-CD2 4.49Å
202	L	92	Very high	80.8	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	108	175.7	-64	-179.5	0	0	0	109.7	V171 F174 V188 Y189 A191 V200 Y250 L251 V252	V171-L202 HydrophobicContact CG2-CD1 4.29Å; F174-L202 HydrophobicContact CB-CD1 3.93Å; F174-L202 HydrophobicContact CD1-CD2 4.3Å; F174-L202 HydrophobicContact CG-CD1 4.35Å; F174-L202 HydrophobicContact CG-CD2 4.42Å; V188-L202 CarbonylContact C-O 3.6Å; V188-L202 WeakPolarHBondContact CA-O 3.24Å; Y189-L202 PolarHBondContact N-O 3.11Å; Y189-L202 PolarHBondContact O-N 2.78Å; A191-L202 HydrophobicContact CB-CD1 3.46Å; A191-L202 VanDerWaalsContact CB-CD1 3.46Å; A191-L202 HydrophobicContact CB-CG 3.79Å; V200-L202 HydrophobicContact CG2-CD2 4.32Å; V200-L202 HydrophobicContact CG2-CG 4.46Å; L202-Y250 HydrophobicContact CB-CD1 4.07Å; L202-L251 WeakPolarHBondContact CA-O 3.23Å; L202-V252 HydrophobicContact CD2-CB 4.23Å; L202-V252 HydrophobicContact CD2-CG1 4.29Å; L202-V252 HydrophobicContact CD2-CG2 3.66Å
203	K	89.3	Confident	79.3	Confident	14 Å²	14	72.6 Å²	72.6	6%	0.061	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	108	171.9	-174.6	179.1	-165.3	-168.3	0	108.8	V188 L205 E221 Y250 L251 M253 D317	V188-K203 HydrophobicContact CG2-CB 4.24Å; V188-K203 HydrophobicContact CG2-CG 4.08Å; K203-L205 PolarHBondContact O-N 3.24Å; K203-E221 IonicContact NZ-OE1 3.95Å; K203-E221 PolarHBondContact NZ-OE1 3.47Å; K203-E221 IonicContact NZ-OE2 3.69Å; K203-E221 PolarHBondContact NZ-OE2 3.34Å; K203-Y250 WeakPolarHBondContact O-CA 3.41Å; K203-L251 HydrophobicContact CB-CB 4.34Å; K203-L251 PolarHBondContact N-O 3.49Å; K203-L251 PolarHBondContact O-N 3.26Å; K203-M253 HydrophobicContact CB-CE 3.55Å; K203-M253 HydrophobicContact CB-SD 4.43Å; K203-M253 HydrophobicContact CD-CE 4.43Å; K203-D317 IonicContact NZ-OD1 2.95Å; K203-D317 PolarHBondContact NZ-OD1 3.23Å
204	R	87.5	Confident	77.9	Confident	91 Å²	91	75.8 Å²	75.8	34%	0.343	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	120.5	172.6	-171.5	179	174.6	-168.1	-3	109	G186 V187 Y189 D247 Y250	G186-R204 WeakPolarHBondContact CA-O 3.47Å; V187-R204 PolarHBondContact N-O 2.75Å; V187-R204 PolarHBondContact O-N 2.98Å; Y189-R204 HydrophobicContact CE2-CB 4.23Å; R204-D247 PolarHBondContact NE-O 3.49Å; R204-D247 PolarHBondContact NH2-O 3.2Å; R204-Y250 HydrophobicContact CB-CD1 3.68Å; R204-Y250 HydrophobicContact CB-CE1 3.47Å; R204-Y250 VanDerWaalsContact CB-CE1 3.47Å; R204-Y250 HydrophobicContact CG-CD1 4.14Å; R204-Y250 HydrophobicContact CG-CE1 3.7Å; R204-Y250 HydrophobicContact CG-CE2 4.48Å
205	L	79.4	Confident	76.6	Confident	3 Å²	3	70 Å²	70	2%	0.016	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.8	175.2	-59.7	173.7	0	0	0	108.5	K203 M207 F214 A218 I249 L251	K203-L205 PolarHBondContact O-N 3.24Å; L205-M207 PolarHBondContact O-N 2.92Å; L205-F214 HydrophobicContact CD1-CZ 4.11Å; L205-A218 HydrophobicContact CB-CB 4.15Å; L205-A218 HydrophobicContact CD1-CB 3.85Å; L205-A218 HydrophobicContact CD2-CB 4.02Å; L205-A218 HydrophobicContact CG-CB 4.2Å; L205-I249 HydrophobicContact CD1-CG2 3.84Å; L205-I249 PolarHBondContact N-O 3.4Å; L205-L251 HydrophobicContact CD1-CD2 4.14Å; L205-L251 HydrophobicContact CD1-CG 4.01Å; L205-L251 HydrophobicContact CD2-CD1 3.73Å; L205-L251 HydrophobicContact CD2-CG 3.91Å; L205-L251 HydrophobicContact CG-CG 4.15Å
206	K	71.9	Confident	75.7	Confident	86 Å²	86	68 Å²	68	37%	0.374	35%	0.347	S	S	.	.			trans	-72.6	110.7	172.4	-74.3	176.7	-171.5	169	0	108	G183 T184 Y185 E208	G183-K206 PolarHBondContact O-NZ 3.12Å; T184-K206 PolarHBondContact O-NZ 3.2Å; Y185-K206 PolarHBondContact O-N 3.41Å; K206-E208 VanDerWaalsContact C-N 3.34Å; K206-E208 PolarHBondContact O-N 2.5Å; K206-E208 VanDerWaalsContact O-N 3.09Å
207	M	66.1	Low	74.6	Confident	46 Å²	46	66.1 Å²	66.1	23%	0.227	34%	0.335	C	S	.	.			trans	-73	96.9	162	-53.3	-60.8	-81.3	0	0	106.4	L205 F214 P215 M246 I249	L205-M207 PolarHBondContact O-N 2.92Å; M207-F214 HydrophobicContact CE-CD2 3.93Å; M207-F214 HydrophobicContact CE-CG 4.42Å; M207-F214 HydrophobicContact SD-CD2 4.36Å; M207-F214 HydrophobicContact SD-CE2 4.47Å; M207-P215 HydrophobicContact CE-CG 4.29Å; M207-P215 WeakPolarHBondContact SD-CD 3.37Å; M207-P215 HydrophobicContact SD-CG 3.52Å; M207-P215 VanDerWaalsContact SD-CG 3.52Å; M207-M246 WeakPolarHBondContact CG-O 3.36Å; M207-I249 HydrophobicContact CE-CD1 4.17Å; M207-I249 HydrophobicContact SD-CD1 4.2Å
208	E	62.8	Low	73.5	Confident	123 Å²	123	64 Å²	64	58%	0.575	31%	0.313	S	S	*	.			trans	-61.9	152	162.2	-65.4	-168	175.1	0	0	107.9	K206 E210	K206-E208 VanDerWaalsContact C-N 3.34Å; K206-E208 PolarHBondContact O-N 2.5Å; K206-E208 VanDerWaalsContact O-N 3.09Å; E208-E210 HydrophobicContact CB-CG 4.44Å; E208-E210 PolarHBondContact O-N 3.31Å
209	K	55.7	Low	72.4	Confident	216 Å²	216	61.8 Å²	61.8	94%	0.939	30%	0.304	S	S	*	.			trans	-73.2	52.8	176.8	-67.3	-177.3	179.2	179.8	0	110.2	K211	K209-K211 PolarHBondContact O-N 3.18Å
210	E	54.9	Low	71.4	Confident	58 Å²	58	60.3 Å²	60.3	27%	0.271	29%	0.293	S	S	.	.			trans	-63.7	128.4	168.1	-74.3	-172.5	-177.6	0	0	107.5	E208 D212	E208-E210 HydrophobicContact CB-CG 4.44Å; E208-E210 PolarHBondContact O-N 3.31Å; E210-D212 PolarHBondContact O-N 2.73Å
211	K	56.5	Low	70.2	Confident	204 Å²	204	60.6 Å²	60.6	89%	0.887	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-14	179.3	-67.8	179.8	178.8	176.6	0	112.2	K209	K209-K211 PolarHBondContact O-N 3.18Å
212	D	57.7	Low	69.2	Low	158 Å²	158	60.6 Å²	60.6	85%	0.845	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	14.7	-165.4	-62.5	-32.5	0	0	0	114.1	E210	E210-D212 PolarHBondContact O-N 2.73Å
213	G	63.6	Low	68.4	Low	48 Å²	48	60.6 Å²	60.6	50%	0.495	29%	0.294	S	S	.	.	S	Bend	trans	113.3	-135.1	168.8	0	0	0	0	0	114.5
214	F	64	Low	67.8	Low	77 Å²	77	60.1 Å²	60.1	34%	0.338	29%	0.292	S	S	.	.	S	Bend	trans	-70.5	131.9	-175.9	-172.7	-85.9	0	0	0	110.3	L205 M207 I216 A218 L219 I249	L205-F214 HydrophobicContact CD1-CZ 4.11Å; M207-F214 HydrophobicContact CE-CD2 3.93Å; M207-F214 HydrophobicContact CE-CG 4.42Å; M207-F214 HydrophobicContact SD-CD2 4.36Å; M207-F214 HydrophobicContact SD-CE2 4.47Å; F214-I216 PolarHBondContact O-N 3.12Å; F214-A218 HydrophobicContact CD1-CB 4.46Å; F214-A218 HydrophobicContact CE1-CB 3.61Å; F214-A218 HydrophobicContact CZ-CB 4.01Å; F214-L219 HydrophobicContact CD1-CB 4.15Å; F214-L219 HydrophobicContact CE1-CB 4.1Å; F214-I249 HydrophobicContact CD2-CD1 3.77Å; F214-I249 HydrophobicContact CE2-CD1 3.4Å; F214-I249 HydrophobicContact CE2-CG1 4.49Å; F214-I249 HydrophobicContact CE2-CG2 4.08Å; F214-I249 HydrophobicContact CZ-CG2 4.41Å
215	P	65.1	Low	67.1	Low	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.279	C	S	.	.			trans	-58.5	123.8	-173.5	23.7	-34.1	0	0	0	110.7	M207 T217 A218 L219	M207-P215 HydrophobicContact CE-CG 4.29Å; M207-P215 WeakPolarHBondContact SD-CD 3.37Å; M207-P215 HydrophobicContact SD-CG 3.52Å; M207-P215 VanDerWaalsContact SD-CG 3.52Å; P215-T217 PolarHBondContact O-N 2.98Å; P215-A218 HydrophobicContact CB-CB 4.45Å; P215-A218 HydrophobicContact CG-CB 3.83Å; P215-A218 WeakPolarHBondContact O-CB 3.46Å; P215-A218 PolarHBondContact O-N 2.91Å; P215-L219 PolarHBondContact O-N 3.07Å
216	I	68	Low	66.9	Low	48 Å²	48	60.3 Å²	60.3	25%	0.246	30%	0.299	C	S	.	.	H	α-helix	trans	-52.8	-40.2	-178.4	-79.7	163.2	0	0	0	111.7	E100 V104 F214 A218 L219 R220	E100-I216 HydrophobicContact CB-CG2 4.45Å; E100-I216 WeakPolarHBondContact OE2-CG2 3.21Å; V104-I216 HydrophobicContact CG1-CG1 4.3Å; V104-I216 HydrophobicContact CG2-CB 4.05Å; V104-I216 HydrophobicContact CG2-CD1 4.09Å; V104-I216 HydrophobicContact CG2-CG1 3.83Å; V104-I216 HydrophobicContact CG2-CG2 3.18Å; F214-I216 PolarHBondContact O-N 3.12Å; I216-A218 VanDerWaalsContact C-N 3.34Å; I216-A218 PolarHBondContact O-N 3.39Å; I216-L219 PolarHBondContact O-N 2.92Å; I216-R220 PolarHBondContact O-N 3.32Å
217	T	66.5	Low	67.1	Low	35 Å²	35	58.5 Å²	58.5	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-39.4	-179.5	54.2	0	0	0	0	112.6	E100 P215 R220 E221	E100-T217 WeakPolarHBondContact OE1-CG2 3.28Å; P215-T217 PolarHBondContact O-N 2.98Å; T217-R220 WeakPolarHBondContact O-CB 3.22Å; T217-R220 PolarHBondContact O-N 3.13Å; T217-E221 PolarHBondContact O-N 3.34Å
218	A	67.7	Low	67.6	Low	4 Å²	4	56.4 Å²	56.4	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-70.3	-38.9	177.7	0	0	0	0	0	111.7	L205 F214 P215 I216 R220 E221 V222	L205-A218 HydrophobicContact CB-CB 4.15Å; L205-A218 HydrophobicContact CD1-CB 3.85Å; L205-A218 HydrophobicContact CD2-CB 4.02Å; L205-A218 HydrophobicContact CG-CB 4.2Å; F214-A218 HydrophobicContact CD1-CB 4.46Å; F214-A218 HydrophobicContact CE1-CB 3.61Å; F214-A218 HydrophobicContact CZ-CB 4.01Å; P215-A218 HydrophobicContact CB-CB 4.45Å; P215-A218 HydrophobicContact CG-CB 3.83Å; P215-A218 WeakPolarHBondContact O-CB 3.46Å; P215-A218 PolarHBondContact O-N 2.91Å; I216-A218 VanDerWaalsContact C-N 3.34Å; I216-A218 PolarHBondContact O-N 3.39Å; A218-R220 VanDerWaalsContact C-N 3.3Å; A218-R220 PolarHBondContact O-N 3.41Å; A218-E221 PolarHBondContact O-N 2.86Å; A218-V222 WeakPolarHBondContact O-CG2 3.4Å; A218-V222 PolarHBondContact O-N 2.84Å
219	L	70.5	Confident	68.2	Low	38 Å²	38	58.8 Å²	58.8	20%	0.199	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-38.1	176.6	-168.5	66.9	0	0	0	110.8	T107 L108 F111 F214 P215 I216 V222 N223	T107-L219 HydrophobicContact CG2-CD2 3.85Å; T107-L219 HydrophobicContact CG2-CG 3.92Å; L108-L219 HydrophobicContact CD2-CD2 4.45Å; F111-L219 HydrophobicContact CD2-CD1 4.3Å; F111-L219 HydrophobicContact CD2-CD2 4.45Å; F111-L219 HydrophobicContact CE2-CD1 3.45Å; F111-L219 VanDerWaalsContact CE2-CD1 3.45Å; F111-L219 HydrophobicContact CE2-CD2 4.18Å; F111-L219 HydrophobicContact CE2-CG 3.89Å; F111-L219 HydrophobicContact CZ-CD1 3.69Å; F214-L219 HydrophobicContact CD1-CB 4.15Å; F214-L219 HydrophobicContact CE1-CB 4.1Å; P215-L219 PolarHBondContact O-N 3.07Å; I216-L219 PolarHBondContact O-N 2.92Å; L219-V222 PolarHBondContact O-N 2.95Å; L219-N223 VanDerWaalsContact O-CB 3.31Å; L219-N223 WeakPolarHBondContact O-CB 3.49Å; L219-N223 PolarHBondContact O-N 3.46Å
220	R	71.3	Confident	69.6	Low	9 Å²	9	52.7 Å²	52.7	3%	0.034	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-49.9	173.7	-172.9	-176.2	-60.3	134.7	11.6	111.1	D97 E100 I216 T217 A218 V222 N223 M224	D97-R220 IonicContact OD2-NH1 2.71Å; E100-R220 VanDerWaalsContact CD-NH2 3.29Å; E100-R220 IonicContact OE1-CZ 2.74Å; E100-R220 VanDerWaalsContact OE1-CZ 3.25Å; E100-R220 IonicContact OE1-NH1 2.73Å; E100-R220 PolarHBondContact OE1-NH1 3.4Å; E100-R220 IonicContact OE1-NH2 3.62Å; E100-R220 PolarHBondContact OE1-NH2 3.47Å; I216-R220 PolarHBondContact O-N 3.32Å; T217-R220 WeakPolarHBondContact O-CB 3.22Å; T217-R220 PolarHBondContact O-N 3.13Å; A218-R220 VanDerWaalsContact C-N 3.3Å; A218-R220 PolarHBondContact O-N 3.41Å; R220-V222 VanDerWaalsContact C-N 3.33Å; R220-V222 PolarHBondContact O-N 3.16Å; R220-N223 PolarHBondContact O-N 3.03Å; R220-N223 VanDerWaalsContact O-N 3.16Å; R220-M224 HydrophobicContact CG-CG 4.25Å; R220-M224 VanDerWaalsContact O-CG 3.28Å; R220-M224 WeakPolarHBondContact O-CG 3.41Å; R220-M224 PolarHBondContact O-N 3.44Å
221	E	70.7	Confident	71.4	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-45.9	179.2	-177.9	170.1	-172.5	0	0	111.4	K203 T217 A218 M224 L225 L251 F318	K203-E221 IonicContact NZ-OE1 3.95Å; K203-E221 PolarHBondContact NZ-OE1 3.47Å; K203-E221 IonicContact NZ-OE2 3.69Å; K203-E221 PolarHBondContact NZ-OE2 3.34Å; T217-E221 PolarHBondContact O-N 3.34Å; A218-E221 PolarHBondContact O-N 2.86Å; E221-M224 PolarHBondContact O-N 3.41Å; E221-L225 HydrophobicContact CG-CD1 3.66Å; E221-L225 WeakPolarHBondContact O-CB 3.33Å; E221-L225 WeakPolarHBondContact O-CD1 3.3Å; E221-L225 WeakPolarHBondContact O-CG 3.23Å; E221-L225 PolarHBondContact O-N 3.17Å; E221-L251 HydrophobicContact CG-CD1 4.23Å; E221-F318 HydrophobicContact CG-CB 4.42Å
222	V	72.1	Confident	73.2	Confident	8 Å²	8	45.4 Å²	45.4	5%	0.048	25%	0.246	C	C	.	.	H	α-helix	trans	-57.5	-50.5	174.1	169.2	0	0	0	0	111.2	A218 L219 R220 M224 L225 L226 I240 L251	A218-V222 WeakPolarHBondContact O-CG2 3.4Å; A218-V222 PolarHBondContact O-N 2.84Å; L219-V222 PolarHBondContact O-N 2.95Å; R220-V222 VanDerWaalsContact C-N 3.33Å; R220-V222 PolarHBondContact O-N 3.16Å; V222-M224 PolarHBondContact O-N 2.8Å; V222-L225 PolarHBondContact O-N 3.29Å; V222-L226 HydrophobicContact CG1-CD1 3.72Å; V222-L226 HydrophobicContact CG1-CG 4.32Å; V222-L226 WeakPolarHBondContact O-CB 3.35Å; V222-L226 VanDerWaalsContact O-CG 3.27Å; V222-L226 WeakPolarHBondContact O-CG 3.28Å; V222-L226 PolarHBondContact O-N 3.44Å; V222-I240 HydrophobicContact CB-CD1 4.38Å; V222-I240 HydrophobicContact CG1-CD1 3.75Å; V222-I240 HydrophobicContact CG2-CD1 3.66Å; V222-I240 HydrophobicContact CG2-CG1 4.36Å; V222-L251 HydrophobicContact CG2-CD2 3.49Å; V222-L251 VanDerWaalsContact CG2-CD2 3.49Å
223	N	75	Confident	75	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-42.7	-177.5	-169.6	23.3	0	0	0	111.5	T107 L219 R220 L225 L226 K227	T107-N223 HydrophobicContact CG2-CB 4.02Å; T107-N223 WeakPolarHBondContact CG2-ND2 3.23Å; T107-N223 PolarHBondContact OG1-ND2 2.97Å; L219-N223 VanDerWaalsContact O-CB 3.31Å; L219-N223 WeakPolarHBondContact O-CB 3.49Å; L219-N223 PolarHBondContact O-N 3.46Å; R220-N223 PolarHBondContact O-N 3.03Å; R220-N223 VanDerWaalsContact O-N 3.16Å; N223-L225 PolarHBondContact O-N 3.43Å; N223-L226 PolarHBondContact O-N 2.86Å; N223-K227 VanDerWaalsContact O-CB 3.28Å; N223-K227 WeakPolarHBondContact O-CB 3.41Å; N223-K227 VanDerWaalsContact O-CG 3.31Å; N223-K227 WeakPolarHBondContact O-CG 3.13Å; N223-K227 PolarHBondContact O-N 2.95Å; N223-K227 WeakPolarHBondContact OD1-CE 3.41Å
224	M	77.2	Confident	76.5	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-43.3	177.1	-67.4	-52.3	93.3	0	0	111.6	R220 E221 V222 K227 S228 I295 A321 E323	R220-M224 HydrophobicContact CG-CG 4.25Å; R220-M224 VanDerWaalsContact O-CG 3.28Å; R220-M224 WeakPolarHBondContact O-CG 3.41Å; R220-M224 PolarHBondContact O-N 3.44Å; E221-M224 PolarHBondContact O-N 3.41Å; V222-M224 PolarHBondContact O-N 2.8Å; M224-K227 HydrophobicContact CE-CD 4.35Å; M224-K227 PolarHBondContact O-N 3.43Å; M224-S228 WeakPolarHBondContact O-CB 3.21Å; M224-S228 PolarHBondContact O-N 3.38Å; M224-S228 PolarHBondContact O-OG 3.06Å; M224-I295 HydrophobicContact SD-CG1 4.47Å; M224-A321 HydrophobicContact CB-CB 4.31Å; M224-A321 HydrophobicContact CG-CB 3.94Å; M224-E323 HydrophobicContact CE-CG 3.99Å; M224-E323 WeakPolarHBondContact CE-OE1 3.28Å; M224-E323 HydrophobicContact SD-CG 4.07Å
225	L	72.6	Confident	77.8	Confident	14 Å²	14	33 Å²	33	7%	0.073	17%	0.173	C	C	.	.	H	α-helix	trans	-70.4	-34.6	179.9	-73.1	162.4	0	0	0	112.4	E221 V222 N223 S228 V237 F318	E221-L225 HydrophobicContact CG-CD1 3.66Å; E221-L225 WeakPolarHBondContact O-CB 3.33Å; E221-L225 WeakPolarHBondContact O-CD1 3.3Å; E221-L225 WeakPolarHBondContact O-CG 3.23Å; E221-L225 PolarHBondContact O-N 3.17Å; V222-L225 PolarHBondContact O-N 3.29Å; N223-L225 PolarHBondContact O-N 3.43Å; L225-S228 PolarHBondContact O-OG 3.39Å; L225-V237 HydrophobicContact CB-CB 4.43Å; L225-V237 HydrophobicContact CB-CG2 3.68Å; L225-V237 HydrophobicContact CD1-CG2 3.29Å; L225-V237 HydrophobicContact CD2-CG2 4.12Å; L225-V237 HydrophobicContact CG-CG2 3.86Å; L225-F318 HydrophobicContact CD2-CB 4.39Å; L225-F318 HydrophobicContact CD2-CD2 3.41Å; L225-F318 VanDerWaalsContact CD2-CD2 3.41Å; L225-F318 HydrophobicContact CD2-CE2 3.75Å; L225-F318 HydrophobicContact CD2-CG 3.88Å; L225-F318 HydrophobicContact CD2-CZ 4.47Å; L225-F318 HydrophobicContact CG-CB 4.27Å; L225-F318 HydrophobicContact CG-CD2 4.2Å; L225-F318 HydrophobicContact CG-CG 4.25Å
226	L	75.3	Confident	78.8	Confident	83 Å²	83	35.7 Å²	35.7	44%	0.435	19%	0.187	S	C	.	.	H	α-helix	trans	-69	-44.4	172.5	-69.9	173.6	0	0	0	111.3	V222 N223 S228 R229	V222-L226 HydrophobicContact CG1-CD1 3.72Å; V222-L226 HydrophobicContact CG1-CG 4.32Å; V222-L226 WeakPolarHBondContact O-CB 3.35Å; V222-L226 VanDerWaalsContact O-CG 3.27Å; V222-L226 WeakPolarHBondContact O-CG 3.28Å; V222-L226 PolarHBondContact O-N 3.44Å; N223-L226 PolarHBondContact O-N 2.86Å; L226-S228 VanDerWaalsContact C-N 3.35Å; L226-R229 PolarHBondContact O-N 3.1Å
227	K	76.3	Confident	79.5	Confident	49 Å²	49	34.6 Å²	34.6	21%	0.213	18%	0.182	C	C	.	.	H	α-helix	trans	-67.6	-33.5	178.1	-77.8	-176.2	175	-175.3	0	112.9	N223 M224 R229 I295 E323	N223-K227 VanDerWaalsContact O-CB 3.28Å; N223-K227 WeakPolarHBondContact O-CB 3.41Å; N223-K227 VanDerWaalsContact O-CG 3.31Å; N223-K227 WeakPolarHBondContact O-CG 3.13Å; N223-K227 PolarHBondContact O-N 2.95Å; N223-K227 WeakPolarHBondContact OD1-CE 3.41Å; M224-K227 HydrophobicContact CE-CD 4.35Å; M224-K227 PolarHBondContact O-N 3.43Å; K227-R229 PolarHBondContact O-N 3.1Å; K227-R229 VanDerWaalsContact O-N 3.11Å; K227-I295 HydrophobicContact CB-CD1 4.18Å; K227-E323 WeakPolarHBondContact CD-OE1 3.33Å; K227-E323 WeakPolarHBondContact CE-OE1 3.19Å; K227-E323 IonicContact NZ-OE1 2.66Å; K227-E323 PolarHBondContact NZ-OE1 3.48Å; K227-E323 IonicContact NZ-OE2 3.41Å; K227-E323 PolarHBondContact NZ-OE2 2.77Å
228	S	75.4	Confident	80.4	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.014	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.4	177.3	68.4	0	0	0	0	111.5	M224 L225 L226 H289	M224-S228 WeakPolarHBondContact O-CB 3.21Å; M224-S228 PolarHBondContact O-N 3.38Å; M224-S228 PolarHBondContact O-OG 3.06Å; L225-S228 PolarHBondContact O-OG 3.39Å; L226-S228 VanDerWaalsContact C-N 3.35Å; S228-H289 PolarHBondContact O-CD2 3.29Å; S228-H289 PolarHBondContact O-NE2 3Å
229	R	76.9	Confident	81.1	Confident	173 Å²	173	38.2 Å²	38.2	65%	0.653	19%	0.192	S	C	*	.			trans	58.1	169	-172.8	-57.7	175.8	174	169	-1	111.7	L226 K227 H231	L226-R229 PolarHBondContact O-N 3.1Å; K227-R229 PolarHBondContact O-N 3.1Å; K227-R229 VanDerWaalsContact O-N 3.11Å; R229-H231 PolarHBondContact O-N 3.1Å
230	S	84.2	Confident	81.8	Confident	88 Å²	88	38.8 Å²	38.8	62%	0.615	20%	0.195	S	C	*	.			trans	-69.9	128.2	178.4	-174.7	0	0	0	0	110.9
231	H	92.7	Very high	82.6	Confident	24 Å²	24	38.3 Å²	38.3	11%	0.111	19%	0.193	C	C	.	.			trans	-141.3	139.5	173.4	-177.9	-88.9	0	0	0	109.5	R229 N233 I234 S285 H289	R229-H231 PolarHBondContact O-N 3.1Å; H231-N233 PolarHBondContact CE1-OD1 3.08Å; H231-N233 PolarHBondContact ND1-N 2.92Å; H231-N233 PolarHBondContact O-N 3.02Å; H231-N233 VanDerWaalsContact O-N 3.1Å; H231-I234 HydrophobicContact CB-CB 4.25Å; H231-I234 HydrophobicContact CB-CD1 3.86Å; H231-I234 HydrophobicContact CB-CG1 4.1Å; H231-I234 PolarHBondContact O-N 3.34Å; H231-I234 VanDerWaalsContact O-N 3.09Å; H231-S285 PolarHBondContact CE1-OG 3.16Å; H231-S285 PolarHBondContact NE2-OG 3.49Å; H231-H289 AromaticContact CD2-CG 3.5Å; H231-H289 AromaticContact CD2-ND1 3.59Å; H231-H289 AromaticContact CG-CD2 3.96Å; H231-H289 AromaticContact CG-CG 3.8Å
232	P	94.6	Very high	83.4	Confident	85 Å²	85	40.1 Å²	40.1	55%	0.552	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-33.2	-176	19.9	-34	0	0	0	113.9	K314	P232-K314 WeakPolarHBondContact O-CE 3.26Å; P232-K314 WeakPolarHBondContact O-CG 3.47Å; P232-K314 PolarHBondContact O-NZ 3.35Å
233	N	96.2	Very high	84	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.048	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	19.3	-178.2	-50.8	113.1	0	0	0	114.9	H231 Q282 L313 K314 I315	H231-N233 PolarHBondContact CE1-OD1 3.08Å; H231-N233 PolarHBondContact ND1-N 2.92Å; H231-N233 PolarHBondContact O-N 3.02Å; H231-N233 VanDerWaalsContact O-N 3.1Å; N233-Q282 VanDerWaalsContact CB-O 3.27Å; N233-Q282 WeakPolarHBondContact CB-O 3.46Å; N233-Q282 VanDerWaalsContact CG-O 3.28Å; N233-Q282 WeakPolarHBondContact ND2-CB 3.44Å; N233-Q282 WeakPolarHBondContact ND2-CG 3.32Å; N233-Q282 PolarHBondContact ND2-OE1 3.39Å; N233-Q282 PolarHBondContact OD1-O 2.93Å; N233-L313 VanDerWaalsContact CA-O 3.26Å; N233-L313 WeakPolarHBondContact CA-O 3.49Å; N233-L313 WeakPolarHBondContact CB-O 3.34Å; N233-L313 PolarHBondContact ND2-O 3.36Å; N233-K314 WeakPolarHBondContact O-CA 3.35Å; N233-I315 WeakPolarHBondContact O-CG1 3.29Å; N233-I315 PolarHBondContact O-N 3.05Å
234	I	93.9	Very high	84.3	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.015	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-123.9	141	172	-62.5	173.9	0	0	0	107.7	H231 N236 L290 F318	H231-I234 HydrophobicContact CB-CB 4.25Å; H231-I234 HydrophobicContact CB-CD1 3.86Å; H231-I234 HydrophobicContact CB-CG1 4.1Å; H231-I234 PolarHBondContact O-N 3.34Å; H231-I234 VanDerWaalsContact O-N 3.09Å; I234-N236 PolarHBondContact O-N 3Å; I234-L290 HydrophobicContact CD1-CD1 4.48Å; I234-L290 HydrophobicContact CD1-CD2 3.6Å; I234-L290 HydrophobicContact CD1-CG 3.75Å; I234-F318 HydrophobicContact CG2-CE2 3.86Å; I234-F318 HydrophobicContact CG2-CZ 3.65Å
235	V	91.3	Very high	84.4	Confident	11 Å²	11	48.4 Å²	48.4	7%	0.067	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-65.1	121	174.2	173	0	0	0	0	109.3	M253 E254 L306 K314 I315	V235-M253 HydrophobicContact CG1-CB 4.1Å; V235-M253 HydrophobicContact CG1-CG 4.5Å; V235-M253 HydrophobicContact CG1-SD 4.29Å; V235-E254 HydrophobicContact CG1-CG 4.19Å; V235-L306 HydrophobicContact CG2-CD1 3.7Å; V235-K314 HydrophobicContact CG2-CB 3.93Å; V235-I315 WeakPolarHBondContact CG2-O 3.18Å; V235-I315 PolarHBondContact N-O 3.37Å
236	N	86.2	Confident	84.3	Confident	55 Å²	55	54.2 Å²	54.2	29%	0.294	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-83.9	128.7	-179.5	-169.1	33.3	0	0	0	111.7	I234 M253 E254	I234-N236 PolarHBondContact O-N 3Å; N236-M253 WeakPolarHBondContact O-CA 3.32Å; N236-E254 WeakPolarHBondContact CB-OE1 3.49Å; N236-E254 PolarHBondContact N-OE1 3.17Å; N236-E254 PolarHBondContact O-N 2.89Å
237	V	83.8	Confident	84.2	Confident	25 Å²	25	54.9 Å²	54.9	15%	0.152	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.1	166.7	-179.1	0	0	0	0	108.3	L225 L251 M253	L225-V237 HydrophobicContact CB-CB 4.43Å; L225-V237 HydrophobicContact CB-CG2 3.68Å; L225-V237 HydrophobicContact CD1-CG2 3.29Å; L225-V237 HydrophobicContact CD2-CG2 4.12Å; L225-V237 HydrophobicContact CG-CG2 3.86Å; V237-L251 HydrophobicContact CG1-CD2 4.42Å; V237-M253 HydrophobicContact CG2-CG 4.16Å
238	R	83.7	Confident	84.4	Confident	90 Å²	90	56.4 Å²	56.4	34%	0.34	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-50.4	179.1	-61.5	-178.2	-179.6	-158.2	-6.4	111.3	E198 V252	E198-R238 VanDerWaalsContact CD-NH2 3.26Å; E198-R238 IonicContact OE1-CZ 3.87Å; E198-R238 IonicContact OE1-NH1 2.95Å; E198-R238 PolarHBondContact OE1-NH1 3.4Å; E198-R238 IonicContact OE1-NH2 3.9Å; E198-R238 PolarHBondContact OE1-NH2 2.81Å; E198-R238 IonicContact OE2-CZ 2.7Å; E198-R238 IonicContact OE2-NH1 3.93Å; E198-R238 PolarHBondContact OE2-NH1 3Å; E198-R238 IonicContact OE2-NH2 3.29Å; E198-R238 PolarHBondContact OE2-NH2 3.33Å; R238-V252 HydrophobicContact CB-CB 4.49Å; R238-V252 HydrophobicContact CB-CG1 4.36Å; R238-V252 PolarHBondContact N-O 2.89Å
239	E	83.9	Confident	84.8	Confident	26 Å²	26	56.6 Å²	56.6	12%	0.121	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	169.2	-175.2	60	-178.6	149.1	0	0	111.7	Y161 R169 V241 V252	Y161-E239 WeakPolarHBondContact CE1-OE2 3.45Å; R169-E239 WeakPolarHBondContact CD-OE1 3.3Å; R169-E239 WeakPolarHBondContact CD-OE2 3.01Å; R169-E239 IonicContact CZ-OE1 2.86Å; R169-E239 IonicContact NE-OE1 3.71Å; R169-E239 IonicContact NH1-OE1 2.94Å; R169-E239 PolarHBondContact NH1-OE1 3.27Å; E239-V241 HydrophobicContact CG-CG1 4.01Å; E239-V252 HydrophobicContact CG-CB 3.85Å; E239-V252 HydrophobicContact CG-CG1 4.48Å; E239-V252 HydrophobicContact CG-CG2 3.78Å; E239-V252 PolarHBondContact O-N 3.34Å
240	I	85	Confident	85.4	Confident	49 Å²	49	49.5 Å²	49.5	25%	0.251	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.5	169.7	-53.3	178.6	0	0	0	107.5	V222 I249 Y250 L251	V222-I240 HydrophobicContact CB-CD1 4.38Å; V222-I240 HydrophobicContact CG1-CD1 3.75Å; V222-I240 HydrophobicContact CG2-CD1 3.66Å; V222-I240 HydrophobicContact CG2-CG1 4.36Å; I240-I249 HydrophobicContact CG2-CG2 3.66Å; I240-Y250 WeakPolarHBondContact CA-O 3.44Å; I240-L251 HydrophobicContact CD1-CD2 4.42Å; I240-L251 HydrophobicContact CG1-CD2 3.88Å
241	V	88	Confident	85.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.8	176.8	-58	0	0	0	0	110.4	R169 V171 F174 E239 Y250 V252	R169-V241 HydrophobicContact CB-CG1 4.04Å; R169-V241 WeakPolarHBondContact O-CA 3.44Å; R169-V241 WeakPolarHBondContact O-CB 3.38Å; V171-V241 HydrophobicContact CB-CG2 4.12Å; V171-V241 HydrophobicContact CG2-CG2 4.16Å; F174-V241 HydrophobicContact CE2-CB 4.42Å; F174-V241 HydrophobicContact CE2-CG1 3.77Å; F174-V241 HydrophobicContact CE2-CG2 4.37Å; F174-V241 HydrophobicContact CZ-CG1 4.22Å; E239-V241 HydrophobicContact CG-CG1 4.01Å; V241-Y250 PolarHBondContact N-O 2.97Å; V241-Y250 PolarHBondContact O-N 2.82Å; V241-V252 HydrophobicContact CB-CG2 4.23Å; V241-V252 HydrophobicContact CG1-CG2 3.51Å; V241-V252 HydrophobicContact CG2-CG2 3.7Å
242	V	86.5	Confident	85.4	Confident	44 Å²	44	44.2 Å²	44.2	27%	0.267	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.5	-173.1	-175.1	0	0	0	0	108.3	C168 R169 S170 V171 K248 I249	C168-V242 HydrophobicContact CB-CG2 4.14Å; R169-V242 PolarHBondContact O-N 3.46Å; S170-V242 VanDerWaalsContact CA-O 3.3Å; S170-V242 WeakPolarHBondContact CA-O 3.12Å; V171-V242 PolarHBondContact N-O 2.95Å; V242-K248 CarbonylContact C-O 3.6Å; V242-I249 HydrophobicContact CG1-CG1 4.25Å; V242-I249 HydrophobicContact CG2-CG1 4.36Å
243	G	85.6	Confident	85.2	Confident	12 Å²	12	41.1 Å²	41.1	12%	0.124	22%	0.215	C	C	.	.			trans	-87.6	-166.1	174.5	0	0	0	0	0	112.6	N245 K248	G243-N245 PolarHBondContact O-N 3.34Å; G243-K248 PolarHBondContact N-O 3.01Å
244	S	81.2	Confident	84.9	Confident	81 Å²	81	42.5 Å²	42.5	57%	0.566	22%	0.221	S	C	*	.	S	Bend	trans	-55.3	-21.7	179.4	63.2	0	0	0	0	115.3	K248	S244-K248 PolarHBondContact OG-NZ 3.44Å; S244-K248 VanDerWaalsContact OG-NZ 3.09Å
245	N	78.3	Confident	84.9	Confident	94 Å²	94	43.9 Å²	43.9	50%	0.503	23%	0.226	S	C	.	.	S	Bend	trans	-140.4	157.1	-173.7	-56.9	43.9	0	0	0	109.2	G243 D247 K248	G243-N245 PolarHBondContact O-N 3.34Å; N245-D247 PolarHBondContact O-N 3.36Å; N245-K248 WeakPolarHBondContact O-CB 3.05Å; N245-K248 PolarHBondContact O-N 3.02Å
246	M	70.5	Confident	84.9	Confident	136 Å²	136	44.1 Å²	44.1	67%	0.67	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.8	178.9	-61.5	-63.3	-104.4	0	0	113.9	M207 K248 I249	M207-M246 WeakPolarHBondContact CG-O 3.36Å; M246-K248 PolarHBondContact O-N 3.19Å; M246-I249 VanDerWaalsContact O-CD1 3.3Å; M246-I249 WeakPolarHBondContact O-CD1 3.43Å; M246-I249 WeakPolarHBondContact O-CG1 3.47Å
247	D	73.6	Confident	85.1	Confident	96 Å²	96	43.6 Å²	43.6	51%	0.513	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.4	175.8	-60.8	-30.7	0	0	0	114.5	R204 N245	R204-D247 PolarHBondContact NE-O 3.49Å; R204-D247 PolarHBondContact NH2-O 3.2Å; N245-D247 PolarHBondContact O-N 3.36Å
248	K	81.3	Confident	85.5	Confident	81 Å²	81	43 Å²	43	35%	0.352	22%	0.219	S	C	.	.			trans	-118.4	57	-173.9	-71.2	-174.7	-176.7	172.6	0	110.3	V242 G243 S244 N245 M246 Y250	V242-K248 CarbonylContact C-O 3.6Å; G243-K248 PolarHBondContact N-O 3.01Å; S244-K248 PolarHBondContact OG-NZ 3.44Å; S244-K248 VanDerWaalsContact OG-NZ 3.09Å; N245-K248 WeakPolarHBondContact O-CB 3.05Å; N245-K248 PolarHBondContact O-N 3.02Å; M246-K248 PolarHBondContact O-N 3.19Å; K248-Y250 HydrophobicContact CB-CE2 3.9Å; K248-Y250 WeakPolarHBondContact O-CD2 3.35Å; K248-Y250 WeakPolarHBondContact O-CE2 3.25Å
249	I	84.1	Confident	85.9	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.5	176.5	-56.6	175.7	0	0	0	108.4	L205 M207 F214 I240 V242 M246	L205-I249 HydrophobicContact CD1-CG2 3.84Å; L205-I249 PolarHBondContact N-O 3.4Å; M207-I249 HydrophobicContact CE-CD1 4.17Å; M207-I249 HydrophobicContact SD-CD1 4.2Å; F214-I249 HydrophobicContact CD2-CD1 3.77Å; F214-I249 HydrophobicContact CE2-CD1 3.4Å; F214-I249 HydrophobicContact CE2-CG1 4.49Å; F214-I249 HydrophobicContact CE2-CG2 4.08Å; F214-I249 HydrophobicContact CZ-CG2 4.41Å; I240-I249 HydrophobicContact CG2-CG2 3.66Å; V242-I249 HydrophobicContact CG1-CG1 4.25Å; V242-I249 HydrophobicContact CG2-CG1 4.36Å; M246-I249 VanDerWaalsContact O-CD1 3.3Å; M246-I249 WeakPolarHBondContact O-CD1 3.43Å; M246-I249 WeakPolarHBondContact O-CG1 3.47Å
250	Y	87.9	Confident	86.3	Confident	25 Å²	25	39.6 Å²	39.6	10%	0.098	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138.6	-174.5	-61	-103.5	0	0	0	110.4	V171 Y189 L202 K203 R204 I240 V241 K248	V171-Y250 HydrophobicContact CB-CD2 4.15Å; V171-Y250 HydrophobicContact CB-CE2 4.34Å; V171-Y250 HydrophobicContact CG1-CE2 4.39Å; V171-Y250 HydrophobicContact CG2-CD2 3.69Å; V171-Y250 HydrophobicContact CG2-CE2 3.86Å; V171-Y250 HydrophobicContact CG2-CG 4.13Å; Y189-Y250 HydrophobicContact CD2-CE1 4.31Å; Y189-Y250 HydrophobicContact CE2-CE1 4.33Å; L202-Y250 HydrophobicContact CB-CD1 4.07Å; K203-Y250 WeakPolarHBondContact O-CA 3.41Å; R204-Y250 HydrophobicContact CB-CD1 3.68Å; R204-Y250 HydrophobicContact CB-CE1 3.47Å; R204-Y250 VanDerWaalsContact CB-CE1 3.47Å; R204-Y250 HydrophobicContact CG-CD1 4.14Å; R204-Y250 HydrophobicContact CG-CE1 3.7Å; R204-Y250 HydrophobicContact CG-CE2 4.48Å; I240-Y250 WeakPolarHBondContact CA-O 3.44Å; V241-Y250 PolarHBondContact N-O 2.97Å; V241-Y250 PolarHBondContact O-N 2.82Å; K248-Y250 HydrophobicContact CB-CE2 3.9Å; K248-Y250 WeakPolarHBondContact O-CD2 3.35Å; K248-Y250 WeakPolarHBondContact O-CE2 3.25Å
251	L	87.6	Confident	86.6	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122.8	164.2	-60	175.3	0	0	0	108.8	L202 K203 L205 E221 V222 V237 I240 M253	L202-L251 WeakPolarHBondContact CA-O 3.23Å; K203-L251 HydrophobicContact CB-CB 4.34Å; K203-L251 PolarHBondContact N-O 3.49Å; K203-L251 PolarHBondContact O-N 3.26Å; L205-L251 HydrophobicContact CD1-CD2 4.14Å; L205-L251 HydrophobicContact CD1-CG 4.01Å; L205-L251 HydrophobicContact CD2-CD1 3.73Å; L205-L251 HydrophobicContact CD2-CG 3.91Å; L205-L251 HydrophobicContact CG-CG 4.15Å; E221-L251 HydrophobicContact CG-CD1 4.23Å; V222-L251 HydrophobicContact CG2-CD2 3.49Å; V222-L251 VanDerWaalsContact CG2-CD2 3.49Å; V237-L251 HydrophobicContact CG1-CD2 4.42Å; I240-L251 HydrophobicContact CD1-CD2 4.42Å; I240-L251 HydrophobicContact CG1-CD2 3.88Å; L251-M253 HydrophobicContact CB-CG 4.33Å
252	V	89.7	Confident	86.7	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.1	171.2	-172.6	0	0	0	0	107.9	F174 V200 L202 R238 E239 V241	F174-V252 HydrophobicContact CE1-CG1 3.9Å; F174-V252 HydrophobicContact CE1-CG2 4.23Å; F174-V252 HydrophobicContact CE2-CG2 4.35Å; F174-V252 HydrophobicContact CZ-CG1 4.18Å; F174-V252 HydrophobicContact CZ-CG2 3.86Å; V200-V252 HydrophobicContact CB-CG1 4.05Å; V200-V252 HydrophobicContact CG1-CG1 4.18Å; V200-V252 HydrophobicContact CG2-CG1 4.11Å; L202-V252 HydrophobicContact CD2-CB 4.23Å; L202-V252 HydrophobicContact CD2-CG1 4.29Å; L202-V252 HydrophobicContact CD2-CG2 3.66Å; R238-V252 HydrophobicContact CB-CB 4.49Å; R238-V252 HydrophobicContact CB-CG1 4.36Å; R238-V252 PolarHBondContact N-O 2.89Å; E239-V252 HydrophobicContact CG-CB 3.85Å; E239-V252 HydrophobicContact CG-CG1 4.48Å; E239-V252 HydrophobicContact CG-CG2 3.78Å; E239-V252 PolarHBondContact O-N 3.34Å; V241-V252 HydrophobicContact CB-CG2 4.23Å; V241-V252 HydrophobicContact CG1-CG2 3.51Å; V241-V252 HydrophobicContact CG2-CG2 3.7Å
253	M	90	Very high	86.9	Confident	20 Å²	20	38.1 Å²	38.1	10%	0.099	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	159.8	-178.1	-57.1	175.4	-60	0	0	110.1	A201 K203 V235 N236 V237 L251 Y255	A201-M253 HydrophobicContact CB-CB 4.35Å; A201-M253 HydrophobicContact CB-CE 4.15Å; A201-M253 PolarHBondContact N-O 2.91Å; A201-M253 PolarHBondContact O-N 2.78Å; K203-M253 HydrophobicContact CB-CE 3.55Å; K203-M253 HydrophobicContact CB-SD 4.43Å; K203-M253 HydrophobicContact CD-CE 4.43Å; V235-M253 HydrophobicContact CG1-CB 4.1Å; V235-M253 HydrophobicContact CG1-CG 4.5Å; V235-M253 HydrophobicContact CG1-SD 4.29Å; N236-M253 WeakPolarHBondContact O-CA 3.32Å; V237-M253 HydrophobicContact CG2-CG 4.16Å; L251-M253 HydrophobicContact CB-CG 4.33Å; M253-Y255 PolarHBondContact O-N 3.22Å
254	E	91.3	Very high	87.2	Confident	37 Å²	37	37.9 Å²	37.9	17%	0.173	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	139.7	165.3	66.4	-178	134.3	0	0	110.9	V235 N236 V256 K314	V235-E254 HydrophobicContact CG1-CG 4.19Å; N236-E254 WeakPolarHBondContact CB-OE1 3.49Å; N236-E254 PolarHBondContact N-OE1 3.17Å; N236-E254 PolarHBondContact O-N 2.89Å; E254-V256 HydrophobicContact CG-CG2 4.36Å; E254-K314 VanDerWaalsContact CD-CE 3.45Å; E254-K314 WeakPolarHBondContact OE1-CE 3.42Å; E254-K314 IonicContact OE1-NZ 3.21Å; E254-K314 PolarHBondContact OE1-NZ 2.98Å; E254-K314 WeakPolarHBondContact OE2-CE 3.37Å; E254-K314 IonicContact OE2-NZ 3.28Å; E254-K314 PolarHBondContact OE2-NZ 3.46Å
255	Y	92.5	Very high	87.6	Confident	33 Å²	33	38.9 Å²	38.9	13%	0.129	20%	0.195	C	C	.	.			trans	-85.9	126.5	174.1	175.5	-106.7	0	0	0	109.6	I180 R190 V199 A201 M253 E257 S480	I180-Y255 HydrophobicContact CD1-CD2 3.95Å; I180-Y255 HydrophobicContact CD1-CE2 3.66Å; R190-Y255 HydrophobicContact CB-CE2 4.48Å; R190-Y255 HydrophobicContact CG-CD2 4.11Å; R190-Y255 HydrophobicContact CG-CE2 3.86Å; V199-Y255 HydrophobicContact CG1-CD1 3.75Å; V199-Y255 HydrophobicContact CG1-CD2 4.49Å; V199-Y255 HydrophobicContact CG1-CE1 4.26Å; V199-Y255 HydrophobicContact CG1-CG 3.86Å; V199-Y255 WeakPolarHBondContact O-CB 3.41Å; A201-Y255 HydrophobicContact CB-CD2 4.49Å; M253-Y255 PolarHBondContact O-N 3.22Å; Y255-E257 HydrophobicContact CD1-CG 4.27Å; Y255-E257 HydrophobicContact CE1-CB 4.39Å; Y255-E257 HydrophobicContact CE1-CG 3.75Å; Y255-S480 WeakPolarHBondContact OH-CB 3.37Å; Y255-S480 PolarHBondContact OH-OG 2.68Å
256	V	92.8	Very high	88	Confident	15 Å²	15	37.6 Å²	37.6	9%	0.091	19%	0.193	C	C	.	.			trans	-117.6	136.5	172.4	-171.5	0	0	0	0	107.9	E254 L306 K314	E254-V256 HydrophobicContact CG-CG2 4.36Å; V256-L306 HydrophobicContact CB-CB 3.72Å; V256-L306 HydrophobicContact CB-CD1 3.89Å; V256-L306 HydrophobicContact CB-CG 4.43Å; V256-L306 HydrophobicContact CG1-CB 3.53Å; V256-L306 HydrophobicContact CG2-CB 4.21Å; V256-L306 HydrophobicContact CG2-CD1 4.06Å; V256-K314 HydrophobicContact CG2-CD 3.68Å
257	E	90.2	Very high	88.7	Confident	45 Å²	45	32.2 Å²	32.2	21%	0.21	17%	0.167	C	C	.	.	S	Bend	trans	-80	-28.3	-158.1	-57.2	100.6	131.8	0	0	113.8	Y255 S308 H309 A478	Y255-E257 HydrophobicContact CD1-CG 4.27Å; Y255-E257 HydrophobicContact CE1-CB 4.39Å; Y255-E257 HydrophobicContact CE1-CG 3.75Å; E257-S308 WeakPolarHBondContact OE2-CA 3.27Å; E257-S308 WeakPolarHBondContact OE2-CB 3.49Å; E257-H309 WeakPolarHBondContact CB-CE1 3.5Å; E257-H309 WeakPolarHBondContact CG-CE1 3.45Å; E257-H309 WeakPolarHBondContact CG-ND1 3.25Å; E257-H309 IonicContact OE1-CE1 2.81Å; E257-H309 IonicContact OE1-CG 2.77Å; E257-H309 IonicContact OE1-ND1 2.82Å; E257-H309 PolarHBondContact OE1-ND1 2.78Å; E257-H309 PolarHBondContact OE2-N 3.22Å; E257-H309 IonicContact OE2-ND1 3.54Å; E257-A478 HydrophobicContact CB-CB 3.99Å; E257-A478 WeakPolarHBondContact O-CB 3.31Å
258	H	91.1	Very high	89	Confident	13 Å²	13	37.8 Å²	37.8	6%	0.06	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.6	-177	-55.8	-82.7	0	0	0	111.8	L306 L307 H309 W476 A478	H258-L306 CarbonylContact O-C 3.52Å; H258-L306 VanDerWaalsContact O-CA 3.22Å; H258-L306 WeakPolarHBondContact O-CA 3.39Å; H258-L307 HydrophobicContact CB-CB 4.49Å; H258-L307 WeakPolarHBondContact CB-O 3.43Å; H258-L307 PolarHBondContact CD2-O 2.79Å; H258-L307 PolarHBondContact N-O 3.28Å; H258-L307 PolarHBondContact O-N 2.93Å; H258-H309 AromaticContact NE2-CD2 3.55Å; H258-H309 AromaticContact NE2-CE1 3.8Å; H258-H309 AromaticContact NE2-NE2 3.14Å; H258-H309 PolarHBondContact NE2-NE2 3.08Å; H258-H309 VanDerWaalsContact NE2-NE2 3.14Å; H258-W476 PolarHBondContact CE1-O 3.06Å; H258-W476 PolarHBondContact NE2-O 2.99Å; H258-A478 WeakPolarHBondContact CE1-CA 3.4Å; H258-A478 PolarHBondContact CE1-N 3.14Å
259	D	91.9	Very high	88.9	Confident	42 Å²	42	41.1 Å²	41.1	23%	0.225	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	136.2	155	70	97.5	0	0	0	109.5	K261 S262 L263 L306	D259-K261 VanDerWaalsContact C-N 3.26Å; D259-K261 PolarHBondContact O-N 3.41Å; D259-S262 VanDerWaalsContact CG-OG 3.28Å; D259-S262 PolarHBondContact O-N 2.8Å; D259-S262 WeakPolarHBondContact OD1-CA 3.4Å; D259-S262 WeakPolarHBondContact OD1-CB 3.5Å; D259-S262 PolarHBondContact OD1-N 2.7Å; D259-S262 PolarHBondContact OD1-OG 2.84Å; D259-S262 WeakPolarHBondContact OD2-CB 3.46Å; D259-S262 PolarHBondContact OD2-OG 2.89Å; D259-L263 WeakPolarHBondContact O-CB 3.45Å; D259-L263 PolarHBondContact O-N 3.4Å; D259-L306 HydrophobicContact CB-CD2 4.04Å
260	L	92.8	Very high	88.9	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-33.6	-170.7	-170.9	60.1	0	0	0	111.3	L263 M264 F271 T302 L305 L307 L313 L368	L260-L263 HydrophobicContact CD1-CD2 4.43Å; L260-L263 PolarHBondContact O-N 3.33Å; L260-M264 HydrophobicContact CD1-CG 4.49Å; L260-M264 HydrophobicContact CD1-SD 4.46Å; L260-M264 HydrophobicContact CG-CG 4.48Å; L260-M264 HydrophobicContact CG-SD 3.95Å; L260-M264 WeakPolarHBondContact O-CB 3.36Å; L260-M264 WeakPolarHBondContact O-CG 3.23Å; L260-M264 PolarHBondContact O-N 3.28Å; L260-F271 HydrophobicContact CD1-CE2 3.88Å; L260-F271 HydrophobicContact CD1-CZ 3.92Å; L260-T302 WeakPolarHBondContact CB-O 3.49Å; L260-L305 HydrophobicContact CB-CB 4.08Å; L260-L305 VanDerWaalsContact CB-O 3.24Å; L260-L305 WeakPolarHBondContact CB-O 3.5Å; L260-L305 HydrophobicContact CD2-CB 3.88Å; L260-L305 HydrophobicContact CD2-CD1 3.97Å; L260-L305 PolarHBondContact N-O 3.01Å; L260-L307 HydrophobicContact CD1-CD2 4.42Å; L260-L313 HydrophobicContact CD2-CD1 4.24Å; L260-L368 HydrophobicContact CD1-CD2 4.22Å; L260-L368 HydrophobicContact CD2-CD2 3.85Å; L260-L368 HydrophobicContact CG-CD2 4.16Å
261	K	91.9	Very high	88.9	Confident	32 Å²	32	43.3 Å²	43.3	14%	0.139	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-54.8	174.8	178.9	56.1	-179.3	153.9	0	112.1	D259 L263 M264 D265 T302	D259-K261 VanDerWaalsContact C-N 3.26Å; D259-K261 PolarHBondContact O-N 3.41Å; K261-L263 VanDerWaalsContact C-N 3.27Å; K261-L263 PolarHBondContact O-N 2.92Å; K261-M264 PolarHBondContact O-N 3.36Å; K261-D265 WeakPolarHBondContact CE-OD2 3.4Å; K261-D265 IonicContact NZ-OD1 3.26Å; K261-D265 PolarHBondContact NZ-OD1 2.76Å; K261-D265 IonicContact NZ-OD2 2.88Å; K261-D265 PolarHBondContact O-N 3.23Å; K261-T302 PolarHBondContact N-O 3.01Å; K261-T302 VanDerWaalsContact N-O 3.08Å
262	S	90.1	Very high	88.9	Confident	29 Å²	29	48.8 Å²	48.8	20%	0.203	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-39.2	177.5	-84.4	0	0	0	0	113.1	D259 S266 K479	D259-S262 VanDerWaalsContact CG-OG 3.28Å; D259-S262 PolarHBondContact O-N 2.8Å; D259-S262 WeakPolarHBondContact OD1-CA 3.4Å; D259-S262 WeakPolarHBondContact OD1-CB 3.5Å; D259-S262 PolarHBondContact OD1-N 2.7Å; D259-S262 PolarHBondContact OD1-OG 2.84Å; D259-S262 WeakPolarHBondContact OD2-CB 3.46Å; D259-S262 PolarHBondContact OD2-OG 2.89Å; S262-S266 WeakPolarHBondContact O-CB 3.45Å; S262-S266 PolarHBondContact O-N 3.2Å; S262-S266 PolarHBondContact O-OG 2.9Å; S262-K479 WeakPolarHBondContact O-CE 3.4Å; S262-K479 PolarHBondContact O-NZ 3.44Å; S262-K479 PolarHBondContact OG-NZ 3.27Å
263	L	90.7	Very high	88.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-54.8	177.3	176.9	58.8	0	0	0	109.5	D259 L260 K261 D265 S266 M267 F271 L307 W476	D259-L263 WeakPolarHBondContact O-CB 3.45Å; D259-L263 PolarHBondContact O-N 3.4Å; L260-L263 HydrophobicContact CD1-CD2 4.43Å; L260-L263 PolarHBondContact O-N 3.33Å; K261-L263 VanDerWaalsContact C-N 3.27Å; K261-L263 PolarHBondContact O-N 2.92Å; L263-D265 VanDerWaalsContact C-N 3.28Å; L263-D265 PolarHBondContact O-N 3.01Å; L263-S266 CarbonylContact O-C 3.48Å; L263-S266 WeakPolarHBondContact O-CA 3.3Å; L263-S266 PolarHBondContact O-N 3.27Å; L263-S266 PolarHBondContact O-OG 2.8Å; L263-M267 HydrophobicContact CD1-CG 4.04Å; L263-M267 HydrophobicContact CD1-SD 4.4Å; L263-M267 HydrophobicContact CG-CE 4.44Å; L263-M267 HydrophobicContact CG-CG 4.25Å; L263-M267 HydrophobicContact CG-SD 4.22Å; L263-M267 WeakPolarHBondContact O-CG 3.34Å; L263-M267 PolarHBondContact O-N 2.95Å; L263-F271 HydrophobicContact CD2-CZ 3.96Å; L263-L307 HydrophobicContact CD2-CD2 3.55Å; L263-W476 HydrophobicContact CD1-CB 3.78Å; L263-W476 HydrophobicContact CD1-CD2 3.57Å; L263-W476 HydrophobicContact CD1-CE3 4.05Å; L263-W476 HydrophobicContact CD1-CG 3.43Å; L263-W476 VanDerWaalsContact CD1-CG 3.43Å; L263-W476 HydrophobicContact CD2-CD2 4.39Å; L263-W476 HydrophobicContact CD2-CE3 4.06Å; L263-W476 HydrophobicContact CD2-CZ3 4.26Å
264	M	91.3	Very high	89	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.034	26%	0.258	C	S	.	.	H	α-helix	trans	-55.3	-39.6	177.7	-71.1	171.1	68.3	0	0	113.4	L260 K261 S266 M267 F271 T302 E367 L368 L371	L260-M264 HydrophobicContact CD1-CG 4.49Å; L260-M264 HydrophobicContact CD1-SD 4.46Å; L260-M264 HydrophobicContact CG-CG 4.48Å; L260-M264 HydrophobicContact CG-SD 3.95Å; L260-M264 WeakPolarHBondContact O-CB 3.36Å; L260-M264 WeakPolarHBondContact O-CG 3.23Å; L260-M264 PolarHBondContact O-N 3.28Å; K261-M264 PolarHBondContact O-N 3.36Å; M264-S266 PolarHBondContact O-N 3.41Å; M264-M267 HydrophobicContact CB-CE 4.24Å; M264-M267 HydrophobicContact CG-CE 3.8Å; M264-M267 PolarHBondContact O-N 3.07Å; M264-F271 HydrophobicContact CG-CE2 4.02Å; M264-T302 HydrophobicContact SD-CG2 3.96Å; M264-E367 HydrophobicContact CE-CB 4.43Å; M264-E367 HydrophobicContact CE-CG 3.7Å; M264-E367 VanDerWaalsContact CE-O 3.32Å; M264-E367 WeakPolarHBondContact CE-O 3.16Å; M264-L368 HydrophobicContact CE-CD2 4.2Å; M264-L368 HydrophobicContact SD-CD2 3.68Å; M264-L371 HydrophobicContact CB-CD2 4.09Å; M264-L371 HydrophobicContact CE-CD2 3.85Å; M264-L371 HydrophobicContact CG-CD2 4.05Å
265	D	89.5	Confident	89.1	Confident	101 Å²	101	49 Å²	49	54%	0.54	25%	0.253	S	S	.	.	H	α-helix	trans	-68.6	-22.3	176.9	-70.6	-12.4	0	0	0	113	K261 L263	K261-D265 WeakPolarHBondContact CE-OD2 3.4Å; K261-D265 IonicContact NZ-OD1 3.26Å; K261-D265 PolarHBondContact NZ-OD1 2.76Å; K261-D265 IonicContact NZ-OD2 2.88Å; K261-D265 PolarHBondContact O-N 3.23Å; L263-D265 VanDerWaalsContact C-N 3.28Å; L263-D265 PolarHBondContact O-N 3.01Å
266	S	86.7	Confident	89.1	Confident	67 Å²	67	47.5 Å²	47.5	47%	0.469	25%	0.247	S	C	.	.	H	α-helix	trans	-96.5	-18.9	-179.5	74.5	0	0	0	0	114.1	S262 L263 M264	S262-S266 WeakPolarHBondContact O-CB 3.45Å; S262-S266 PolarHBondContact O-N 3.2Å; S262-S266 PolarHBondContact O-OG 2.9Å; L263-S266 CarbonylContact O-C 3.48Å; L263-S266 WeakPolarHBondContact O-CA 3.3Å; L263-S266 PolarHBondContact O-N 3.27Å; L263-S266 PolarHBondContact O-OG 2.8Å; M264-S266 PolarHBondContact O-N 3.41Å
267	M	85.2	Confident	89.2	Confident	24 Å²	24	46.9 Å²	46.9	12%	0.118	24%	0.243	C	C	.	.			trans	-72.1	135.8	-177.5	-73	-166.8	-65	0	0	111.4	L263 M264 Q269 F271 L371 W476	L263-M267 HydrophobicContact CD1-CG 4.04Å; L263-M267 HydrophobicContact CD1-SD 4.4Å; L263-M267 HydrophobicContact CG-CE 4.44Å; L263-M267 HydrophobicContact CG-CG 4.25Å; L263-M267 HydrophobicContact CG-SD 4.22Å; L263-M267 WeakPolarHBondContact O-CG 3.34Å; L263-M267 PolarHBondContact O-N 2.95Å; M264-M267 HydrophobicContact CB-CE 4.24Å; M264-M267 HydrophobicContact CG-CE 3.8Å; M264-M267 PolarHBondContact O-N 3.07Å; M267-Q269 WeakPolarHBondContact CB-O 3.37Å; M267-F271 HydrophobicContact CE-CD1 4.31Å; M267-F271 HydrophobicContact CE-CD2 3.67Å; M267-F271 HydrophobicContact CE-CE1 3.95Å; M267-F271 HydrophobicContact CE-CE2 3.26Å; M267-F271 HydrophobicContact CE-CG 4.18Å; M267-F271 HydrophobicContact CE-CZ 3.41Å; M267-F271 VanDerWaalsContact CE-CZ 3.41Å; M267-F271 HydrophobicContact SD-CD1 4.26Å; M267-F271 HydrophobicContact SD-CE1 3.83Å; M267-F271 HydrophobicContact SD-CE2 4.24Å; M267-F271 HydrophobicContact SD-CZ 3.82Å; M267-L371 HydrophobicContact CE-CD2 4Å; M267-W476 HydrophobicContact SD-CH2 4.49Å; M267-W476 HydrophobicContact SD-CZ2 3.72Å
268	K	80.2	Confident	89.4	Confident	213 Å²	213	45.2 Å²	45.2	93%	0.926	24%	0.236	S	C	*	.	S	Bend	trans	-78.2	-27.7	175.2	-66.6	-177.6	-179	176.7	0	112.8
269	Q	80	Confident	89.6	Confident	150 Å²	150	44.6 Å²	44.6	70%	0.701	23%	0.233	S	C	*	.	S	Bend	trans	-128.2	145.7	-179.3	-69.5	-175.1	-10	0	0	109.1	M267	M267-Q269 WeakPolarHBondContact CB-O 3.37Å
270	P	83.1	Confident	89.9	Confident	67 Å²	67	42.6 Å²	42.6	44%	0.435	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-62.8	159.5	172.5	29.1	-35.2	0	0	0	110.9	L371	P270-L371 HydrophobicContact CB-CD1 4.06Å; P270-L371 HydrophobicContact CB-CD2 4.41Å; P270-L371 HydrophobicContact CB-CG 3.94Å
271	F	87.4	Confident	90	Very high	11 Å²	11	48.5 Å²	48.5	5%	0.048	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-55.5	142.9	167.5	-69.1	-67.9	0	0	0	110.6	L260 L263 M264 M267 E275 V276 L279 L307 L368 W476	L260-F271 HydrophobicContact CD1-CE2 3.88Å; L260-F271 HydrophobicContact CD1-CZ 3.92Å; L263-F271 HydrophobicContact CD2-CZ 3.96Å; M264-F271 HydrophobicContact CG-CE2 4.02Å; M267-F271 HydrophobicContact CE-CD1 4.31Å; M267-F271 HydrophobicContact CE-CD2 3.67Å; M267-F271 HydrophobicContact CE-CE1 3.95Å; M267-F271 HydrophobicContact CE-CE2 3.26Å; M267-F271 HydrophobicContact CE-CG 4.18Å; M267-F271 HydrophobicContact CE-CZ 3.41Å; M267-F271 VanDerWaalsContact CE-CZ 3.41Å; M267-F271 HydrophobicContact SD-CD1 4.26Å; M267-F271 HydrophobicContact SD-CE1 3.83Å; M267-F271 HydrophobicContact SD-CE2 4.24Å; M267-F271 HydrophobicContact SD-CZ 3.82Å; F271-E275 VanDerWaalsContact CA-OE2 3.31Å; F271-E275 WeakPolarHBondContact CA-OE2 3.12Å; F271-E275 HydrophobicContact CB-CB 4.21Å; F271-E275 HydrophobicContact CD1-CB 4.29Å; F271-V276 HydrophobicContact CB-CG2 3.56Å; F271-L279 HydrophobicContact CD1-CD1 4.39Å; F271-L279 HydrophobicContact CD2-CD1 4.15Å; F271-L279 HydrophobicContact CE1-CD1 4.27Å; F271-L279 HydrophobicContact CE2-CD1 4.01Å; F271-L279 HydrophobicContact CG-CD1 4.33Å; F271-L279 HydrophobicContact CZ-CD1 4.08Å; F271-L307 HydrophobicContact CZ-CD2 4.46Å; F271-L368 HydrophobicContact CD2-CD2 3.88Å; F271-L368 HydrophobicContact CE2-CD2 3.79Å; F271-W476 HydrophobicContact CD1-CH2 4.39Å; F271-W476 AromaticContact CE1-CH2 3.69Å; F271-W476 HydrophobicContact CE1-CH2 3.69Å; F271-W476 HydrophobicContact CE1-CZ2 4.2Å; F271-W476 HydrophobicContact CE1-CZ3 4.4Å
272	L	89.3	Confident	90.3	Very high	114 Å²	114	47.8 Å²	47.8	60%	0.597	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-64.6	151.6	169.5	-61	175.8	0	0	0	109.5	G274 E275 V276	L272-G274 PolarHBondContact O-N 3.33Å; L272-G274 VanDerWaalsContact O-N 3.16Å; L272-E275 HydrophobicContact CB-CG 4.11Å; L272-E275 PolarHBondContact N-OE2 2.92Å; L272-E275 WeakPolarHBondContact O-CA 3.4Å; L272-E275 WeakPolarHBondContact O-CB 3.29Å; L272-E275 PolarHBondContact O-N 3.42Å; L272-V276 PolarHBondContact O-N 3.33Å
273	V	89.5	Confident	90.6	Very high	46 Å²	46	46.5 Å²	46.5	28%	0.279	23%	0.234	S	C	.	.	H	α-helix	trans	-56.6	-37.6	-178.7	175.9	0	0	0	0	111.8	V276 K277 W460 P465	V273-V276 PolarHBondContact O-N 2.9Å; V273-K277 WeakPolarHBondContact O-CG 3.27Å; V273-K277 PolarHBondContact O-N 3.23Å; V273-W460 HydrophobicContact CG1-CZ2 4.04Å; V273-P465 HydrophobicContact CB-CG 3.76Å; V273-P465 HydrophobicContact CG1-CG 3.81Å
274	G	91.5	Very high	91	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-67.2	-33.6	175.9	0	0	0	0	0	113.8	L272 T278 R466 P467 V468	L272-G274 PolarHBondContact O-N 3.33Å; L272-G274 VanDerWaalsContact O-N 3.16Å; G274-T278 PolarHBondContact O-N 3.45Å; G274-T278 PolarHBondContact O-OG1 3.37Å; G274-R466 WeakPolarHBondContact CA-O 3.04Å; G274-P467 WeakPolarHBondContact O-CA 3.45Å; G274-V468 PolarHBondContact O-N 2.88Å
275	E	92.9	Very high	91.3	Very high	15 Å²	15	48 Å²	48	7%	0.07	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-44.7	173.2	-63.5	170.7	151.4	0	0	110.2	F271 L272 K277 T278 L279 V468 F473 P474	F271-E275 VanDerWaalsContact CA-OE2 3.31Å; F271-E275 WeakPolarHBondContact CA-OE2 3.12Å; F271-E275 HydrophobicContact CB-CB 4.21Å; F271-E275 HydrophobicContact CD1-CB 4.29Å; L272-E275 HydrophobicContact CB-CG 4.11Å; L272-E275 PolarHBondContact N-OE2 2.92Å; L272-E275 WeakPolarHBondContact O-CA 3.4Å; L272-E275 WeakPolarHBondContact O-CB 3.29Å; L272-E275 PolarHBondContact O-N 3.42Å; E275-K277 VanDerWaalsContact C-N 3.28Å; E275-K277 PolarHBondContact O-N 3.43Å; E275-T278 WeakPolarHBondContact O-CB 3.18Å; E275-T278 PolarHBondContact O-N 2.89Å; E275-T278 VanDerWaalsContact O-N 3.07Å; E275-L279 WeakPolarHBondContact O-CG 3.19Å; E275-L279 PolarHBondContact O-N 3.17Å; E275-V468 HydrophobicContact CG-CB 4.36Å; E275-V468 HydrophobicContact CG-CG2 4.25Å; E275-F473 HydrophobicContact CB-CE1 3.88Å; E275-F473 HydrophobicContact CB-CE2 4.43Å; E275-F473 HydrophobicContact CB-CZ 3.73Å; E275-F473 HydrophobicContact CG-CE1 4.26Å; E275-F473 HydrophobicContact CG-CE2 4.43Å; E275-F473 HydrophobicContact CG-CZ 4.15Å; E275-P474 WeakPolarHBondContact OE1-CD 3.35Å
276	V	93	Very high	91.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-41	175.5	179.3	0	0	0	0	110.9	F271 L272 V273 T278 L279 M280 F365 L368 L369 W460	F271-V276 HydrophobicContact CB-CG2 3.56Å; L272-V276 PolarHBondContact O-N 3.33Å; V273-V276 PolarHBondContact O-N 2.9Å; V276-T278 VanDerWaalsContact C-N 3.32Å; V276-T278 PolarHBondContact O-N 3.05Å; V276-L279 PolarHBondContact O-N 3.07Å; V276-M280 HydrophobicContact CG1-CG 3.98Å; V276-M280 VanDerWaalsContact O-CB 3.3Å; V276-M280 WeakPolarHBondContact O-CB 3.35Å; V276-M280 VanDerWaalsContact O-CG 3.23Å; V276-M280 WeakPolarHBondContact O-CG 3.43Å; V276-M280 PolarHBondContact O-N 2.98Å; V276-F365 HydrophobicContact CG1-CD2 3.87Å; V276-F365 HydrophobicContact CG1-CE2 3.72Å; V276-L368 HydrophobicContact CG1-CB 4.08Å; V276-L368 HydrophobicContact CG1-CD1 4.49Å; V276-L368 HydrophobicContact CG2-CB 4.23Å; V276-L369 HydrophobicContact CB-CD2 4.15Å; V276-L369 HydrophobicContact CG1-CD2 3.96Å; V276-L369 HydrophobicContact CG1-CG 4.11Å; V276-L369 HydrophobicContact CG2-CD2 3.98Å; V276-W460 HydrophobicContact CG1-CH2 4.41Å
277	K	94	Very high	92.1	Very high	2 Å²	2	40 Å²	40	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-55.9	-46.5	173.5	-79.4	177.6	-175.1	-168.9	0	111.8	V273 E275 M280 Y281 W460 F461 E463 P465 P467	V273-K277 WeakPolarHBondContact O-CG 3.27Å; V273-K277 PolarHBondContact O-N 3.23Å; E275-K277 VanDerWaalsContact C-N 3.28Å; E275-K277 PolarHBondContact O-N 3.43Å; K277-M280 PolarHBondContact O-N 3.33Å; K277-Y281 WeakPolarHBondContact O-CB 3.48Å; K277-Y281 PolarHBondContact O-N 2.85Å; K277-W460 HydrophobicContact CB-CH2 4.21Å; K277-W460 HydrophobicContact CB-CZ3 4.18Å; K277-W460 HydrophobicContact CD-CH2 4.3Å; K277-W460 HydrophobicContact CD-CZ2 4.42Å; K277-W460 HydrophobicContact CD-CZ3 4.4Å; K277-W460 WeakPolarHBondContact CE-O 3.36Å; K277-W460 HydrophobicContact CG-CD2 4.36Å; K277-W460 HydrophobicContact CG-CE3 3.89Å; K277-W460 HydrophobicContact CG-CH2 3.22Å; K277-W460 HydrophobicContact CG-CZ2 3.75Å; K277-W460 HydrophobicContact CG-CZ3 3.33Å; K277-W460 PolarHBondContact NZ-O 2.94Å; K277-F461 HydrophobicContact CB-CD1 4.37Å; K277-F461 WeakPolarHBondContact O-CE1 3.46Å; K277-E463 PolarHBondContact NZ-O 2.72Å; K277-P465 WeakPolarHBondContact CD-O 3.48Å; K277-P465 VanDerWaalsContact CE-O 3.31Å; K277-P465 WeakPolarHBondContact CE-O 3.42Å; K277-P465 PolarHBondContact NZ-O 3.08Å; K277-P467 HydrophobicContact CB-CB 4.02Å; K277-P467 HydrophobicContact CB-CG 4.02Å; K277-P467 HydrophobicContact CD-CG 4.41Å
278	T	95.3	Very high	92.6	Very high	10 Å²	10	41.1 Å²	41.1	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-43.2	179.1	-63	0	0	0	0	112.5	G274 E275 V276 Y281 Q282 P467 V468 P470 F473	G274-T278 PolarHBondContact O-N 3.45Å; G274-T278 PolarHBondContact O-OG1 3.37Å; E275-T278 WeakPolarHBondContact O-CB 3.18Å; E275-T278 PolarHBondContact O-N 2.89Å; E275-T278 VanDerWaalsContact O-N 3.07Å; V276-T278 VanDerWaalsContact C-N 3.32Å; V276-T278 PolarHBondContact O-N 3.05Å; T278-Y281 PolarHBondContact O-N 3.27Å; T278-Q282 WeakPolarHBondContact O-CB 3.45Å; T278-Q282 WeakPolarHBondContact O-CG 3.21Å; T278-Q282 PolarHBondContact O-N 3.48Å; T278-Q282 VanDerWaalsContact O-N 3.08Å; T278-P467 WeakPolarHBondContact OG1-CB 3.28Å; T278-V468 WeakPolarHBondContact CB-O 3.39Å; T278-V468 WeakPolarHBondContact CG2-O 3.31Å; T278-V468 PolarHBondContact OG1-N 3.09Å; T278-V468 PolarHBondContact OG1-O 2.58Å; T278-P470 HydrophobicContact CG2-CG 4.07Å; T278-F473 HydrophobicContact CG2-CE2 3.72Å; T278-F473 HydrophobicContact CG2-CZ 3.95Å
279	L	96	Very high	93.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-44.1	176	-65.1	177.4	0	0	0	111.6	F271 E275 V276 Q282 L283 L307 L313 L368 F473	F271-L279 HydrophobicContact CD1-CD1 4.39Å; F271-L279 HydrophobicContact CD2-CD1 4.15Å; F271-L279 HydrophobicContact CE1-CD1 4.27Å; F271-L279 HydrophobicContact CE2-CD1 4.01Å; F271-L279 HydrophobicContact CG-CD1 4.33Å; F271-L279 HydrophobicContact CZ-CD1 4.08Å; E275-L279 WeakPolarHBondContact O-CG 3.19Å; E275-L279 PolarHBondContact O-N 3.17Å; V276-L279 PolarHBondContact O-N 3.07Å; L279-Q282 PolarHBondContact O-N 3.46Å; L279-L283 WeakPolarHBondContact O-CB 3.3Å; L279-L283 PolarHBondContact O-N 2.77Å; L279-L307 HydrophobicContact CD2-CD1 3.63Å; L279-L313 HydrophobicContact CB-CD1 4.13Å; L279-L313 HydrophobicContact CD2-CB 4.14Å; L279-L313 HydrophobicContact CD2-CD1 4.04Å; L279-L368 HydrophobicContact CB-CD1 4.43Å; L279-L368 HydrophobicContact CD1-CD2 4.25Å; L279-F473 HydrophobicContact CD1-CE1 4.27Å; L279-F473 HydrophobicContact CD2-CE1 3.8Å; L279-F473 HydrophobicContact CD2-CZ 4.14Å; L279-F473 HydrophobicContact CG-CE1 3.91Å; L279-F473 HydrophobicContact CG-CZ 4.07Å
280	M	96.5	Very high	94.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-66.1	-39.5	178.4	-73.1	-54.8	-54.2	0	0	112.2	V276 K277 L283 L284 V361 F365 L368 F461	V276-M280 HydrophobicContact CG1-CG 3.98Å; V276-M280 VanDerWaalsContact O-CB 3.3Å; V276-M280 WeakPolarHBondContact O-CB 3.35Å; V276-M280 VanDerWaalsContact O-CG 3.23Å; V276-M280 WeakPolarHBondContact O-CG 3.43Å; V276-M280 PolarHBondContact O-N 2.98Å; K277-M280 PolarHBondContact O-N 3.33Å; M280-L283 HydrophobicContact CE-CD2 4.36Å; M280-L283 PolarHBondContact O-N 3.23Å; M280-L283 HydrophobicContact SD-CD2 4.31Å; M280-L284 WeakPolarHBondContact O-CB 3.35Å; M280-L284 WeakPolarHBondContact O-CG 3.18Å; M280-L284 PolarHBondContact O-N 2.85Å; M280-V361 HydrophobicContact CE-CG1 3.58Å; M280-F365 HydrophobicContact CE-CB 3.61Å; M280-F365 HydrophobicContact CE-CD1 3.87Å; M280-F365 HydrophobicContact CE-CD2 4.34Å; M280-F365 HydrophobicContact CE-CG 3.7Å; M280-F365 HydrophobicContact CG-CB 4.49Å; M280-F365 HydrophobicContact CG-CD1 4.47Å; M280-F365 HydrophobicContact CG-CD2 3.59Å; M280-F365 HydrophobicContact CG-CE2 3.9Å; M280-F365 HydrophobicContact CG-CG 3.95Å; M280-F365 HydrophobicContact CG-CZ 4.47Å; M280-F365 HydrophobicContact SD-CB 3.57Å; M280-F365 VanDerWaalsContact SD-CB 3.57Å; M280-F365 HydrophobicContact SD-CD1 4.39Å; M280-F365 HydrophobicContact SD-CD2 3.8Å; M280-F365 HydrophobicContact SD-CG 3.67Å; M280-L368 HydrophobicContact SD-CD1 4.01Å; M280-F461 HydrophobicContact CB-CE1 3.9Å; M280-F461 HydrophobicContact CB-CZ 4Å
281	Y	95.8	Very high	94.6	Very high	125 Å²	125	23.2 Å²	23.2	49%	0.49	12%	0.116	S	C	.	.	H	α-helix	trans	-62.1	-46.1	176	-173.8	-91.8	0	0	0	111.3	K277 T278 L284 S285 F461	K277-Y281 WeakPolarHBondContact O-CB 3.48Å; K277-Y281 PolarHBondContact O-N 2.85Å; T278-Y281 PolarHBondContact O-N 3.27Å; Y281-L284 PolarHBondContact O-N 3.19Å; Y281-S285 WeakPolarHBondContact O-CB 3.18Å; Y281-S285 PolarHBondContact O-N 3.41Å; Y281-F461 HydrophobicContact CD2-CD1 4.4Å
282	Q	97.3	Very high	94.9	Very high	16 Å²	16	27.3 Å²	27.3	8%	0.075	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-43.5	176.3	-76.4	-173.3	72.3	0	0	112.7	N233 T278 L279 S285 G286 G311 I312 L313	N233-Q282 VanDerWaalsContact CB-O 3.27Å; N233-Q282 WeakPolarHBondContact CB-O 3.46Å; N233-Q282 VanDerWaalsContact CG-O 3.28Å; N233-Q282 WeakPolarHBondContact ND2-CB 3.44Å; N233-Q282 WeakPolarHBondContact ND2-CG 3.32Å; N233-Q282 PolarHBondContact ND2-OE1 3.39Å; N233-Q282 PolarHBondContact OD1-O 2.93Å; T278-Q282 WeakPolarHBondContact O-CB 3.45Å; T278-Q282 WeakPolarHBondContact O-CG 3.21Å; T278-Q282 PolarHBondContact O-N 3.48Å; T278-Q282 VanDerWaalsContact O-N 3.08Å; L279-Q282 PolarHBondContact O-N 3.46Å; Q282-S285 WeakPolarHBondContact O-CB 3.48Å; Q282-S285 PolarHBondContact O-N 3.19Å; Q282-G286 PolarHBondContact O-N 3.13Å; Q282-G311 PolarHBondContact NE2-O 2.98Å; Q282-I312 VanDerWaalsContact OE1-CA 3.29Å; Q282-L313 HydrophobicContact CB-CB 4.11Å
283	L	98	Very high	95	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-48.2	174.9	177.5	58.4	0	0	0	111	L279 M280 S285 G286 I287 L305 L313 I315 V361 V364	L279-L283 WeakPolarHBondContact O-CB 3.3Å; L279-L283 PolarHBondContact O-N 2.77Å; M280-L283 HydrophobicContact CE-CD2 4.36Å; M280-L283 PolarHBondContact O-N 3.23Å; M280-L283 HydrophobicContact SD-CD2 4.31Å; L283-S285 VanDerWaalsContact C-N 3.32Å; L283-S285 PolarHBondContact O-N 3.48Å; L283-G286 PolarHBondContact O-N 3.4Å; L283-I287 HydrophobicContact CD1-CG1 4.08Å; L283-I287 HydrophobicContact CG-CG1 4.47Å; L283-I287 VanDerWaalsContact O-CG1 3.31Å; L283-I287 WeakPolarHBondContact O-CG1 3.39Å; L283-I287 PolarHBondContact O-N 3.14Å; L283-L305 HydrophobicContact CD1-CD1 4.24Å; L283-L305 HydrophobicContact CD1-CD2 3.74Å; L283-L305 HydrophobicContact CD2-CD1 4.13Å; L283-L313 HydrophobicContact CB-CD2 4.07Å; L283-L313 HydrophobicContact CD1-CD2 4.32Å; L283-I315 HydrophobicContact CD1-CD1 3.96Å; L283-I315 HydrophobicContact CD1-CG1 3.88Å; L283-V361 HydrophobicContact CD2-CG1 4.1Å; L283-V361 HydrophobicContact CD2-CG2 4.23Å; L283-V361 HydrophobicContact CG-CG2 4.37Å; L283-V364 HydrophobicContact CD2-CG1 4.08Å
284	L	97.9	Very high	95.1	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-36.8	178.4	-70.6	169.7	0	0	0	112.4	M280 Y281 I287 H288 V361 F441 A452 A455 F461	M280-L284 WeakPolarHBondContact O-CB 3.35Å; M280-L284 WeakPolarHBondContact O-CG 3.18Å; M280-L284 PolarHBondContact O-N 2.85Å; Y281-L284 PolarHBondContact O-N 3.19Å; L284-I287 PolarHBondContact O-N 3.09Å; L284-H288 VanDerWaalsContact O-CB 3.23Å; L284-H288 WeakPolarHBondContact O-CB 3.12Å; L284-H288 PolarHBondContact O-N 3.43Å; L284-V361 HydrophobicContact CD2-CG1 4.05Å; L284-F441 HydrophobicContact CD1-CZ 4.19Å; L284-F441 HydrophobicContact CD2-CE1 3.82Å; L284-F441 HydrophobicContact CD2-CZ 3.74Å; L284-A452 HydrophobicContact CD2-CB 4.37Å; L284-A455 HydrophobicContact CD1-CB 3.87Å; L284-A455 HydrophobicContact CD2-CB 4.03Å; L284-F461 HydrophobicContact CD1-CE2 3.99Å; L284-F461 HydrophobicContact CD1-CZ 3.66Å
285	S	97.2	Very high	95.1	Very high	40 Å²	40	27.9 Å²	27.9	28%	0.28	13%	0.13	S	C	.	.	H	α-helix	trans	-60.3	-48	173.6	-165.8	0	0	0	0	111.2	H231 Y281 Q282 L283 H289	H231-S285 PolarHBondContact CE1-OG 3.16Å; H231-S285 PolarHBondContact NE2-OG 3.49Å; Y281-S285 WeakPolarHBondContact O-CB 3.18Å; Y281-S285 PolarHBondContact O-N 3.41Å; Q282-S285 WeakPolarHBondContact O-CB 3.48Å; Q282-S285 PolarHBondContact O-N 3.19Å; L283-S285 VanDerWaalsContact C-N 3.32Å; L283-S285 PolarHBondContact O-N 3.48Å; S285-H289 WeakPolarHBondContact O-CB 3.47Å; S285-H289 PolarHBondContact O-N 3.32Å
286	G	96.7	Very high	95.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-43.4	177.2	0	0	0	0	0	113.1	Q282 L283 H289 L290	Q282-G286 PolarHBondContact O-N 3.13Å; L283-G286 PolarHBondContact O-N 3.4Å; G286-H289 PolarHBondContact O-N 3.07Å; G286-L290 WeakPolarHBondContact O-CG 3.36Å; G286-L290 PolarHBondContact O-N 3Å
287	I	97.3	Very high	95.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.9	-43.1	178.4	-65.3	-57.9	0	0	0	112.1	L283 L284 H289 L290 H291 L300 I315 L358 V361 A452	L283-I287 HydrophobicContact CD1-CG1 4.08Å; L283-I287 HydrophobicContact CG-CG1 4.47Å; L283-I287 VanDerWaalsContact O-CG1 3.31Å; L283-I287 WeakPolarHBondContact O-CG1 3.39Å; L283-I287 PolarHBondContact O-N 3.14Å; L284-I287 PolarHBondContact O-N 3.09Å; I287-H289 VanDerWaalsContact C-N 3.28Å; I287-H289 PolarHBondContact O-N 3.41Å; I287-L290 HydrophobicContact CD1-CD1 4.34Å; I287-L290 PolarHBondContact O-N 3.42Å; I287-H291 WeakPolarHBondContact CG2-CE1 3.16Å; I287-H291 VanDerWaalsContact O-CG 3.28Å; I287-H291 PolarHBondContact O-N 3.36Å; I287-L300 HydrophobicContact CD1-CD1 3.4Å; I287-L300 VanDerWaalsContact CD1-CD1 3.4Å; I287-L300 HydrophobicContact CD1-CD2 3.79Å; I287-L300 HydrophobicContact CD1-CG 4.19Å; I287-L300 HydrophobicContact CG1-CD1 4.23Å; I287-I315 HydrophobicContact CD1-CD1 3.74Å; I287-I315 HydrophobicContact CG1-CD1 4.03Å; I287-L358 HydrophobicContact CG2-CD1 4.19Å; I287-V361 HydrophobicContact CG1-CG2 4.1Å; I287-A452 HydrophobicContact CB-CB 4.45Å; I287-A452 HydrophobicContact CG2-CB 4.07Å
288	H	96.6	Very high	95.1	Very high	48 Å²	48	27.1 Å²	27.1	22%	0.222	13%	0.126	C	C	.	.	H	α-helix	trans	-57.8	-45.1	175.1	176.8	32.5	0	0	0	111	L284 L290 H291 D292 A452	L284-H288 VanDerWaalsContact O-CB 3.23Å; L284-H288 WeakPolarHBondContact O-CB 3.12Å; L284-H288 PolarHBondContact O-N 3.43Å; H288-L290 PolarHBondContact O-N 3.03Å; H288-H291 PolarHBondContact O-N 2.97Å; H288-D292 IonicContact CE1-OD1 2.8Å; H288-D292 PolarHBondContact CE1-OD1 3.24Å; H288-D292 IonicContact CE1-OD2 2.7Å; H288-D292 PolarHBondContact CE1-OD2 3.31Å; H288-D292 IonicContact ND1-OD1 2.67Å; H288-D292 PolarHBondContact ND1-OD1 3.25Å; H288-D292 VanDerWaalsContact ND1-OD1 3.14Å; H288-D292 IonicContact ND1-OD2 3.63Å; H288-D292 IonicContact NE2-OD2 3.04Å; H288-D292 WeakPolarHBondContact O-CB 3.34Å; H288-D292 PolarHBondContact O-N 3.42Å; H288-A452 HydrophobicContact CB-CB 3.8Å
289	H	95.7	Very high	95	Very high	41 Å²	41	26.7 Å²	26.7	19%	0.19	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-42.3	177	-178.6	86.4	0	0	0	112.6	S228 H231 S285 G286 I287 D292 N293	S228-H289 PolarHBondContact O-CD2 3.29Å; S228-H289 PolarHBondContact O-NE2 3Å; H231-H289 AromaticContact CD2-CG 3.5Å; H231-H289 AromaticContact CD2-ND1 3.59Å; H231-H289 AromaticContact CG-CD2 3.96Å; H231-H289 AromaticContact CG-CG 3.8Å; S285-H289 WeakPolarHBondContact O-CB 3.47Å; S285-H289 PolarHBondContact O-N 3.32Å; G286-H289 PolarHBondContact O-N 3.07Å; I287-H289 VanDerWaalsContact C-N 3.28Å; I287-H289 PolarHBondContact O-N 3.41Å; H289-D292 PolarHBondContact O-N 2.87Å; H289-N293 PolarHBondContact CE1-ND2 3.08Å; H289-N293 PolarHBondContact NE2-ND2 3.31Å; H289-N293 PolarHBondContact O-N 3.33Å; H289-N293 VanDerWaalsContact O-N 3.13Å; H289-N293 PolarHBondContact O-ND2 2.76Å
290	L	94.6	Very high	95	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.9	-45.8	174.4	-71	176.4	0	0	0	112	I234 G286 I287 H288 D292 N293 W294 I295 H297 F318	I234-L290 HydrophobicContact CD1-CD1 4.48Å; I234-L290 HydrophobicContact CD1-CD2 3.6Å; I234-L290 HydrophobicContact CD1-CG 3.75Å; G286-L290 WeakPolarHBondContact O-CG 3.36Å; G286-L290 PolarHBondContact O-N 3Å; I287-L290 HydrophobicContact CD1-CD1 4.34Å; I287-L290 PolarHBondContact O-N 3.42Å; H288-L290 PolarHBondContact O-N 3.03Å; L290-D292 PolarHBondContact O-N 2.74Å; L290-N293 CarbonylContact O-C 3.56Å; L290-N293 PolarHBondContact O-N 3.16Å; L290-W294 PolarHBondContact O-N 2.91Å; L290-I295 CarbonylContact C-O 3.58Å; L290-I295 HydrophobicContact CB-CB 4.41Å; L290-I295 HydrophobicContact CD2-CB 4.31Å; L290-I295 HydrophobicContact CD2-CD1 4.36Å; L290-I295 HydrophobicContact CD2-CG2 4.17Å; L290-I295 PolarHBondContact O-N 2.83Å; L290-H297 HydrophobicContact CD1-CB 4.42Å; L290-F318 HydrophobicContact CD1-CE1 3.7Å; L290-F318 HydrophobicContact CD1-CZ 3.98Å; L290-F318 HydrophobicContact CD2-CE1 3.57Å; L290-F318 HydrophobicContact CD2-CZ 4.05Å; L290-F318 HydrophobicContact CG-CE1 4.29Å
291	H	94.9	Very high	94.8	Very high	13 Å²	13	27.7 Å²	27.7	6%	0.06	13%	0.128	C	C	.	.	H	α-helix	trans	-65.2	-39.4	179.8	-66.4	174	0	0	0	111.7	I287 H288 N293 W294 I295 Y324 T354 D357 L358	I287-H291 WeakPolarHBondContact CG2-CE1 3.16Å; I287-H291 VanDerWaalsContact O-CG 3.28Å; I287-H291 PolarHBondContact O-N 3.36Å; H288-H291 PolarHBondContact O-N 2.97Å; H291-N293 PolarHBondContact O-N 2.9Å; H291-W294 PolarHBondContact O-N 3.28Å; H291-I295 PolarHBondContact CD2-O 3.32Å; H291-Y324 PolarHBondContact O-OH 3.25Å; H291-T354 HydrophobicContact CB-CG2 3.83Å; H291-T354 VanDerWaalsContact CE1-CB 3.5Å; H291-T354 WeakPolarHBondContact CE1-CB 3.31Å; H291-T354 VanDerWaalsContact CG-CG2 3.42Å; H291-T354 WeakPolarHBondContact ND1-CB 3Å; H291-D357 IonicContact CD2-OD2 3.25Å; H291-D357 IonicContact CE1-OD2 2.79Å; H291-D357 IonicContact NE2-OD2 2.79Å; H291-D357 PolarHBondContact NE2-OD2 2.98Å; H291-L358 VanDerWaalsContact CE1-CD2 3.45Å; H291-L358 WeakPolarHBondContact CE1-CD2 3.48Å
292	D	93.4	Very high	94.8	Very high	98 Å²	98	21.9 Å²	21.9	52%	0.524	11%	0.105	S	C	.	.	H	α-helix	trans	-65.2	-28.8	175.3	-79.6	14	0	0	0	112.7	H288 H289 L290 W294	H288-D292 IonicContact CE1-OD1 2.8Å; H288-D292 PolarHBondContact CE1-OD1 3.24Å; H288-D292 IonicContact CE1-OD2 2.7Å; H288-D292 PolarHBondContact CE1-OD2 3.31Å; H288-D292 IonicContact ND1-OD1 2.67Å; H288-D292 PolarHBondContact ND1-OD1 3.25Å; H288-D292 VanDerWaalsContact ND1-OD1 3.14Å; H288-D292 IonicContact ND1-OD2 3.63Å; H288-D292 IonicContact NE2-OD2 3.04Å; H288-D292 WeakPolarHBondContact O-CB 3.34Å; H288-D292 PolarHBondContact O-N 3.42Å; H289-D292 PolarHBondContact O-N 2.87Å; L290-D292 PolarHBondContact O-N 2.74Å; D292-W294 VanDerWaalsContact C-N 3.28Å
293	N	91.1	Very high	94.5	Very high	40 Å²	40	22.4 Å²	22.4	21%	0.214	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	16.3	172.5	-67.5	-73.4	0	0	0	113.1	H289 L290 H291 I295	H289-N293 PolarHBondContact CE1-ND2 3.08Å; H289-N293 PolarHBondContact NE2-ND2 3.31Å; H289-N293 PolarHBondContact O-N 3.33Å; H289-N293 VanDerWaalsContact O-N 3.13Å; H289-N293 PolarHBondContact O-ND2 2.76Å; L290-N293 CarbonylContact O-C 3.56Å; L290-N293 PolarHBondContact O-N 3.16Å; H291-N293 PolarHBondContact O-N 2.9Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 HydrophobicContact CB-CD1 4.33Å; N293-I295 PolarHBondContact O-N 3.32Å
294	W	91.4	Very high	94.4	Very high	135 Å²	135	22.8 Å²	22.8	51%	0.511	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	27.9	175.6	-56.3	86.2	0	0	0	114.9	L290 H291 D292 E323 Y324	L290-W294 PolarHBondContact O-N 2.91Å; H291-W294 PolarHBondContact O-N 3.28Å; D292-W294 VanDerWaalsContact C-N 3.28Å; W294-E323 CarbonylContact O-C 3.56Å; W294-E323 VanDerWaalsContact O-CA 3.26Å; W294-E323 WeakPolarHBondContact O-CA 3.45Å; W294-Y324 VanDerWaalsContact CA-CE1 3.43Å; W294-Y324 HydrophobicContact CB-CE1 4.4Å; W294-Y324 AromaticContact CE3-CD2 3.95Å; W294-Y324 HydrophobicContact CE3-CD2 3.95Å; W294-Y324 AromaticContact CE3-CE2 3.57Å; W294-Y324 HydrophobicContact CE3-CE2 3.57Å; W294-Y324 AromaticContact CE3-CZ 3.98Å; W294-Y324 HydrophobicContact CZ3-CD2 4.36Å; W294-Y324 AromaticContact CZ3-CE2 3.88Å; W294-Y324 HydrophobicContact CZ3-CE2 3.88Å; W294-Y324 WeakPolarHBondContact O-CD1 3.19Å; W294-Y324 PolarHBondContact O-N 3.05Å
295	I	91.5	Very high	94.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.3	-178.7	-62.7	164.3	0	0	0	110.1	M224 K227 L290 H291 N293 A321	M224-I295 HydrophobicContact SD-CG1 4.47Å; K227-I295 HydrophobicContact CB-CD1 4.18Å; L290-I295 CarbonylContact C-O 3.58Å; L290-I295 HydrophobicContact CB-CB 4.41Å; L290-I295 HydrophobicContact CD2-CB 4.31Å; L290-I295 HydrophobicContact CD2-CD1 4.36Å; L290-I295 HydrophobicContact CD2-CG2 4.17Å; L290-I295 PolarHBondContact O-N 2.83Å; H291-I295 PolarHBondContact CD2-O 3.32Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 HydrophobicContact CB-CD1 4.33Å; N293-I295 PolarHBondContact O-N 3.32Å; I295-A321 HydrophobicContact CG2-CB 4.16Å
296	L	93.1	Very high	94.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134.9	165	-57	-178.7	0	0	0	109.4	R298 A321 R322 Y324 Y352 T354	L296-R298 HydrophobicContact CB-CG 3.76Å; L296-A321 CarbonylContact O-C 3.42Å; L296-A321 WeakPolarHBondContact O-CA 3.49Å; L296-A321 WeakPolarHBondContact O-CB 3.5Å; L296-R322 PolarHBondContact N-O 3.13Å; L296-R322 PolarHBondContact O-N 3.17Å; L296-Y324 HydrophobicContact CD1-CD1 4.48Å; L296-Y324 HydrophobicContact CD1-CG 4.46Å; L296-Y324 HydrophobicContact CD2-CD1 3.49Å; L296-Y324 VanDerWaalsContact CD2-CD1 3.49Å; L296-Y324 HydrophobicContact CD2-CE1 3.88Å; L296-Y324 HydrophobicContact CD2-CG 4.03Å; L296-Y324 HydrophobicContact CG-CD1 3.6Å; L296-Y324 HydrophobicContact CG-CE1 4.42Å; L296-Y324 HydrophobicContact CG-CG 4.05Å; L296-Y352 HydrophobicContact CD1-CD2 4.03Å; L296-Y352 HydrophobicContact CD1-CE2 3.92Å; L296-T354 VanDerWaalsContact CD2-CA 3.5Å; L296-T354 HydrophobicContact CD2-CG2 3.9Å; L296-T354 VanDerWaalsContact CD2-N 3.35Å
297	H	92.8	Very high	94.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.11	C	C	.	.			trans	-78.9	-45.1	178.6	-172.4	-80.1	0	0	0	112.3	L290 D299 L300 I315 G316 D317 F318 L320 D357	L290-H297 HydrophobicContact CD1-CB 4.42Å; H297-D299 PolarHBondContact CE1-O 2.88Å; H297-D299 VanDerWaalsContact ND1-C 3.33Å; H297-D299 PolarHBondContact ND1-N 3.49Å; H297-D299 PolarHBondContact O-N 2.92Å; H297-L300 HydrophobicContact CB-CD1 4.35Å; H297-L300 HydrophobicContact CB-CD2 4.11Å; H297-L300 HydrophobicContact CB-CG 3.94Å; H297-L300 PolarHBondContact ND1-N 3.49Å; H297-I315 WeakPolarHBondContact NE2-CG2 3.43Å; H297-G316 PolarHBondContact NE2-O 3.36Å; H297-G316 VanDerWaalsContact NE2-O 3.12Å; H297-D317 PolarHBondContact CE1-O 2.95Å; H297-D317 PolarHBondContact NE2-O 3.32Å; H297-F318 AromaticContact CD2-CE1 3.91Å; H297-L320 CarbonylContact O-C 3.24Å; H297-D357 PolarHBondContact N-OD2 3.19Å
298	R	93.2	Very high	93.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.116	C	C	.	.			trans	61.3	2.3	175.6	-47.2	-165.2	-63	161.7	0.6	117.7	D97 L296 L320 R322 V335 V336 Y352 I356 D357	D97-R298 IonicContact OD2-NH2 3.71Å; L296-R298 HydrophobicContact CB-CG 3.76Å; R298-L320 HydrophobicContact CB-CB 4.38Å; R298-L320 PolarHBondContact NE-O 3.37Å; R298-L320 PolarHBondContact NH2-O 2.88Å; R298-R322 VanDerWaalsContact NH2-CG 3.34Å; R298-V335 HydrophobicContact CB-CB 4.43Å; R298-V335 HydrophobicContact CB-CG2 4.4Å; R298-V336 WeakPolarHBondContact O-CA 3.4Å; R298-V336 WeakPolarHBondContact O-CG2 3.17Å; R298-V336 PolarHBondContact O-N 3.04Å; R298-Y352 WeakPolarHBondContact CD-OH 3.48Å; R298-Y352 PolarHBondContact NH1-OH 2.9Å; R298-I356 HydrophobicContact CG-CD1 3.99Å; R298-D357 PolarHBondContact N-OD1 3.44Å
299	D	93.5	Very high	93.4	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.011	12%	0.117	C	C	.	.			trans	-143.6	49.6	166	-159.8	33	0	0	0	113.3	Q92 H297 K301 N304 L320 T337	Q92-D299 PolarHBondContact NE2-OD1 2.73Å; Q92-D299 PolarHBondContact NE2-OD2 3.15Å; H297-D299 PolarHBondContact CE1-O 2.88Å; H297-D299 VanDerWaalsContact ND1-C 3.33Å; H297-D299 PolarHBondContact ND1-N 3.49Å; H297-D299 PolarHBondContact O-N 2.92Å; D299-K301 PolarHBondContact O-N 2.9Å; D299-K301 WeakPolarHBondContact OD2-CE 3.22Å; D299-K301 IonicContact OD2-NZ 2.57Å; D299-K301 PolarHBondContact OD2-NZ 2.88Å; D299-N304 PolarHBondContact O-ND2 2.85Å; D299-N304 PolarHBondContact OD2-ND2 3.39Å; D299-L320 HydrophobicContact CB-CB 4.29Å; D299-L320 HydrophobicContact CB-CD1 3.76Å; D299-L320 HydrophobicContact CB-CG 4.48Å; D299-T337 PolarHBondContact OD1-N 3.49Å; D299-T337 PolarHBondContact OD1-OG1 3.44Å
300	L	95.6	Very high	93	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	14%	0.143	C	C	.	.			trans	-73.6	123.3	175.1	-69.2	170.3	0	0	0	110.7	I287 H297 I315 Y340 D357 V361	I287-L300 HydrophobicContact CD1-CD1 3.4Å; I287-L300 VanDerWaalsContact CD1-CD1 3.4Å; I287-L300 HydrophobicContact CD1-CD2 3.79Å; I287-L300 HydrophobicContact CD1-CG 4.19Å; I287-L300 HydrophobicContact CG1-CD1 4.23Å; H297-L300 HydrophobicContact CB-CD1 4.35Å; H297-L300 HydrophobicContact CB-CD2 4.11Å; H297-L300 HydrophobicContact CB-CG 3.94Å; H297-L300 PolarHBondContact ND1-N 3.49Å; L300-I315 HydrophobicContact CD2-CG2 3.97Å; L300-Y340 WeakPolarHBondContact O-CB 3.43Å; L300-D357 HydrophobicContact CD1-CB 3.66Å; L300-V361 HydrophobicContact CD1-CG2 3.96Å
301	K	94.1	Very high	92.9	Very high	19 Å²	19	31.4 Å²	31.4	8%	0.083	14%	0.143	C	C	.	.			trans	-159.7	163.4	177.5	54.3	179.4	168.3	-177.2	0	109.3	Q92 D299 S303 N304 L305 T337 Y340	Q92-K301 VanDerWaalsContact CD-NZ 3.31Å; D299-K301 PolarHBondContact O-N 2.9Å; D299-K301 WeakPolarHBondContact OD2-CE 3.22Å; D299-K301 IonicContact OD2-NZ 2.57Å; D299-K301 PolarHBondContact OD2-NZ 2.88Å; K301-S303 WeakPolarHBondContact CD-OG 3.25Å; K301-S303 WeakPolarHBondContact CE-OG 3.37Å; K301-S303 WeakPolarHBondContact CG-OG 3.08Å; K301-S303 PolarHBondContact O-N 3.36Å; K301-S303 VanDerWaalsContact O-N 3.16Å; K301-N304 VanDerWaalsContact CE-CG 3.43Å; K301-N304 WeakPolarHBondContact CE-ND2 3.45Å; K301-N304 WeakPolarHBondContact CE-OD1 3.41Å; K301-N304 HydrophobicContact CG-CB 4.02Å; K301-N304 PolarHBondContact O-N 3.38Å; K301-L305 PolarHBondContact O-N 2.89Å; K301-T337 HydrophobicContact CD-CG2 4.44Å; K301-T337 WeakPolarHBondContact CD-OG1 3.31Å; K301-T337 PolarHBondContact NZ-OG1 2.99Å; K301-Y340 HydrophobicContact CB-CD1 4.43Å; K301-Y340 HydrophobicContact CB-CD2 3.63Å; K301-Y340 HydrophobicContact CB-CE1 4.35Å; K301-Y340 HydrophobicContact CB-CE2 3.51Å; K301-Y340 HydrophobicContact CB-CG 4.11Å
302	T	94.3	Very high	92.9	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.012	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-61.1	-25.1	-178.1	49	0	0	0	0	113.7	L260 K261 M264 N304 Y340 V364 E367	L260-T302 WeakPolarHBondContact CB-O 3.49Å; K261-T302 PolarHBondContact N-O 3.01Å; K261-T302 VanDerWaalsContact N-O 3.08Å; M264-T302 HydrophobicContact SD-CG2 3.96Å; T302-N304 VanDerWaalsContact C-N 3.33Å; T302-Y340 PolarHBondContact OG1-OH 3.12Å; T302-V364 HydrophobicContact CG2-CG1 4.26Å; T302-V364 HydrophobicContact CG2-CG2 4.37Å; T302-E367 HydrophobicContact CG2-CG 4.36Å; T302-E367 VanDerWaalsContact CG2-OE2 3.25Å; T302-E367 WeakPolarHBondContact CG2-OE2 3.16Å
303	S	92.5	Very high	93	Very high	27 Å²	27	28.6 Å²	28.6	19%	0.189	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-74.1	-23.2	175.2	67.8	0	0	0	0	113.6	K301 L305	K301-S303 WeakPolarHBondContact CD-OG 3.25Å; K301-S303 WeakPolarHBondContact CE-OG 3.37Å; K301-S303 WeakPolarHBondContact CG-OG 3.08Å; K301-S303 PolarHBondContact O-N 3.36Å; K301-S303 VanDerWaalsContact O-N 3.16Å; S303-L305 VanDerWaalsContact C-N 3.34Å
304	N	94.5	Very high	93.3	Very high	11 Å²	11	27.8 Å²	27.8	6%	0.059	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-96.2	6.9	-179.4	-67.7	7.8	0	0	0	111.8	D299 K301 T302 G316 D317	D299-N304 PolarHBondContact O-ND2 2.85Å; D299-N304 PolarHBondContact OD2-ND2 3.39Å; K301-N304 VanDerWaalsContact CE-CG 3.43Å; K301-N304 WeakPolarHBondContact CE-ND2 3.45Å; K301-N304 WeakPolarHBondContact CE-OD1 3.41Å; K301-N304 HydrophobicContact CG-CB 4.02Å; K301-N304 PolarHBondContact O-N 3.38Å; T302-N304 VanDerWaalsContact C-N 3.33Å; N304-G316 PolarHBondContact O-N 3.29Å; N304-D317 HydrophobicContact CB-CB 4.46Å
305	L	96	Very high	93.5	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	124.1	172.4	-59.1	-179.6	0	0	0	108.4	L260 L283 K301 S303 L313 I315 V364	L260-L305 HydrophobicContact CB-CB 4.08Å; L260-L305 VanDerWaalsContact CB-O 3.24Å; L260-L305 WeakPolarHBondContact CB-O 3.5Å; L260-L305 HydrophobicContact CD2-CB 3.88Å; L260-L305 HydrophobicContact CD2-CD1 3.97Å; L260-L305 PolarHBondContact N-O 3.01Å; L283-L305 HydrophobicContact CD1-CD1 4.24Å; L283-L305 HydrophobicContact CD1-CD2 3.74Å; L283-L305 HydrophobicContact CD2-CD1 4.13Å; K301-L305 PolarHBondContact O-N 2.89Å; S303-L305 VanDerWaalsContact C-N 3.34Å; L305-L313 HydrophobicContact CD2-CD2 4.41Å; L305-I315 HydrophobicContact CD2-CB 4.39Å; L305-I315 HydrophobicContact CD2-CG1 3.93Å; L305-I315 HydrophobicContact CD2-CG2 4.44Å; L305-V364 HydrophobicContact CD1-CG1 3.72Å; L305-V364 HydrophobicContact CD1-CG2 4.42Å
306	L	95.2	Very high	93.4	Very high	38 Å²	38	21.7 Å²	21.7	20%	0.199	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	149	178.3	-50.7	-179.5	0	0	0	109.9	V235 V256 H258 D259 L313 K314	V235-L306 HydrophobicContact CG2-CD1 3.7Å; V256-L306 HydrophobicContact CB-CB 3.72Å; V256-L306 HydrophobicContact CB-CD1 3.89Å; V256-L306 HydrophobicContact CB-CG 4.43Å; V256-L306 HydrophobicContact CG1-CB 3.53Å; V256-L306 HydrophobicContact CG2-CB 4.21Å; V256-L306 HydrophobicContact CG2-CD1 4.06Å; H258-L306 CarbonylContact O-C 3.52Å; H258-L306 VanDerWaalsContact O-CA 3.22Å; H258-L306 WeakPolarHBondContact O-CA 3.39Å; D259-L306 HydrophobicContact CB-CD2 4.04Å; L306-L313 CarbonylContact O-C 3.27Å; L306-L313 WeakPolarHBondContact O-CA 3.45Å; L306-K314 PolarHBondContact N-O 2.75Å; L306-K314 PolarHBondContact O-N 2.67Å
307	L	94.8	Very high	93	Very high	1 Å²	1	24 Å²	24	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.5	179.2	-175.3	65.2	0	0	0	110.4	H258 L260 L263 F271 L279 L313 W476	H258-L307 HydrophobicContact CB-CB 4.49Å; H258-L307 WeakPolarHBondContact CB-O 3.43Å; H258-L307 PolarHBondContact CD2-O 2.79Å; H258-L307 PolarHBondContact N-O 3.28Å; H258-L307 PolarHBondContact O-N 2.93Å; L260-L307 HydrophobicContact CD1-CD2 4.42Å; L263-L307 HydrophobicContact CD2-CD2 3.55Å; F271-L307 HydrophobicContact CZ-CD2 4.46Å; L279-L307 HydrophobicContact CD2-CD1 3.63Å; L307-L313 HydrophobicContact CD1-CB 4.38Å; L307-W476 HydrophobicContact CD2-CZ3 4.37Å
308	S	92.1	Very high	92.6	Very high	19 Å²	19	24 Å²	24	13%	0.133	11%	0.114	C	C	.	.			trans	-82.4	160.9	175.6	77.6	0	0	0	0	112.7	E257 R310 G311 I312	E257-S308 WeakPolarHBondContact OE2-CA 3.27Å; E257-S308 WeakPolarHBondContact OE2-CB 3.49Å; S308-R310 PolarHBondContact O-N 3.2Å; S308-R310 PolarHBondContact OG-N 2.9Å; S308-G311 PolarHBondContact O-N 3.05Å; S308-I312 PolarHBondContact N-O 2.88Å; S308-I312 WeakPolarHBondContact OG-CB 3.35Å; S308-I312 PolarHBondContact OG-N 3.45Å; S308-I312 VanDerWaalsContact OG-N 3.16Å
309	H	87	Confident	91.8	Very high	50 Å²	50	24.2 Å²	24.2	23%	0.231	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-16	171.8	-69.3	110.5	0	0	0	113.8	E257 H258 G311 T475 W476	E257-H309 WeakPolarHBondContact CB-CE1 3.5Å; E257-H309 WeakPolarHBondContact CG-CE1 3.45Å; E257-H309 WeakPolarHBondContact CG-ND1 3.25Å; E257-H309 IonicContact OE1-CE1 2.81Å; E257-H309 IonicContact OE1-CG 2.77Å; E257-H309 IonicContact OE1-ND1 2.82Å; E257-H309 PolarHBondContact OE1-ND1 2.78Å; E257-H309 PolarHBondContact OE2-N 3.22Å; E257-H309 IonicContact OE2-ND1 3.54Å; H258-H309 AromaticContact NE2-CD2 3.55Å; H258-H309 AromaticContact NE2-CE1 3.8Å; H258-H309 AromaticContact NE2-NE2 3.14Å; H258-H309 PolarHBondContact NE2-NE2 3.08Å; H258-H309 VanDerWaalsContact NE2-NE2 3.14Å; H309-G311 VanDerWaalsContact C-N 3.33Å; H309-T475 HydrophobicContact CB-CG2 4.34Å; H309-W476 PolarHBondContact CD2-O 3.13Å; H309-W476 PolarHBondContact NE2-O 3.08Å
310	R	88.3	Confident	91.2	Very high	200 Å²	200	24.9 Å²	24.9	76%	0.755	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	12.3	177.5	-59.9	-177.5	-179.9	179.8	0.3	113	S308 I312 P470	S308-R310 PolarHBondContact O-N 3.2Å; S308-R310 PolarHBondContact OG-N 2.9Å; R310-I312 VanDerWaalsContact C-N 3.27Å; R310-I312 HydrophobicContact CB-CG1 4.31Å; R310-I312 PolarHBondContact O-N 3.01Å; R310-P470 CarbonylContact C-O 3.46Å; R310-P470 CarbonylContact O-C 3.55Å; R310-P470 VanDerWaalsContact O-C 3.24Å; R310-P470 WeakPolarHBondContact O-CB 3.31Å
311	G	91.1	Very high	90.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	70.7	20.3	-178.8	0	0	0	0	0	114	Q282 S308 H309	Q282-G311 PolarHBondContact NE2-O 2.98Å; S308-G311 PolarHBondContact O-N 3.05Å; H309-G311 VanDerWaalsContact C-N 3.33Å
312	I	95.3	Very high	90.2	Very high	51 Å²	51	23.9 Å²	23.9	26%	0.262	12%	0.115	S	C	.	.			trans	-92.7	117.1	178.4	-52.6	-59.7	0	0	0	109.4	Q282 S308 R310 K314 P470	Q282-I312 VanDerWaalsContact OE1-CA 3.29Å; S308-I312 PolarHBondContact N-O 2.88Å; S308-I312 WeakPolarHBondContact OG-CB 3.35Å; S308-I312 PolarHBondContact OG-N 3.45Å; S308-I312 VanDerWaalsContact OG-N 3.16Å; R310-I312 VanDerWaalsContact C-N 3.27Å; R310-I312 HydrophobicContact CB-CG1 4.31Å; R310-I312 PolarHBondContact O-N 3.01Å; I312-K314 HydrophobicContact CG2-CG 4.45Å; I312-P470 HydrophobicContact CD1-CB 3.9Å; I312-P470 HydrophobicContact CD1-CG 4.23Å
313	L	96.7	Very high	89.8	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.2	176.1	-179.5	150.8	0	0	0	109.8	N233 L260 L279 Q282 L283 L305 L306 L307 I315	N233-L313 VanDerWaalsContact CA-O 3.26Å; N233-L313 WeakPolarHBondContact CA-O 3.49Å; N233-L313 WeakPolarHBondContact CB-O 3.34Å; N233-L313 PolarHBondContact ND2-O 3.36Å; L260-L313 HydrophobicContact CD2-CD1 4.24Å; L279-L313 HydrophobicContact CB-CD1 4.13Å; L279-L313 HydrophobicContact CD2-CB 4.14Å; L279-L313 HydrophobicContact CD2-CD1 4.04Å; Q282-L313 HydrophobicContact CB-CB 4.11Å; L283-L313 HydrophobicContact CB-CD2 4.07Å; L283-L313 HydrophobicContact CD1-CD2 4.32Å; L305-L313 HydrophobicContact CD2-CD2 4.41Å; L306-L313 CarbonylContact O-C 3.27Å; L306-L313 WeakPolarHBondContact O-CA 3.45Å; L307-L313 HydrophobicContact CD1-CB 4.38Å; L313-I315 HydrophobicContact CD2-CG1 4.48Å
314	K	95.9	Very high	89.6	Confident	23 Å²	23	26.6 Å²	26.6	10%	0.1	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.6	177.7	-73.7	171.4	173.3	-77	0	111	P232 N233 V235 E254 V256 L306 I312	P232-K314 WeakPolarHBondContact O-CE 3.26Å; P232-K314 WeakPolarHBondContact O-CG 3.47Å; P232-K314 PolarHBondContact O-NZ 3.35Å; N233-K314 WeakPolarHBondContact O-CA 3.35Å; V235-K314 HydrophobicContact CG2-CB 3.93Å; E254-K314 VanDerWaalsContact CD-CE 3.45Å; E254-K314 WeakPolarHBondContact OE1-CE 3.42Å; E254-K314 IonicContact OE1-NZ 3.21Å; E254-K314 PolarHBondContact OE1-NZ 2.98Å; E254-K314 WeakPolarHBondContact OE2-CE 3.37Å; E254-K314 IonicContact OE2-NZ 3.28Å; E254-K314 PolarHBondContact OE2-NZ 3.46Å; V256-K314 HydrophobicContact CG2-CD 3.68Å; L306-K314 PolarHBondContact N-O 2.75Å; L306-K314 PolarHBondContact O-N 2.67Å; I312-K314 HydrophobicContact CG2-CG 4.45Å
315	I	95.7	Very high	89	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	127.3	174.5	-56.6	163.3	0	0	0	108.3	N233 V235 L283 I287 H297 L300 L305 L313 F318	N233-I315 WeakPolarHBondContact O-CG1 3.29Å; N233-I315 PolarHBondContact O-N 3.05Å; V235-I315 WeakPolarHBondContact CG2-O 3.18Å; V235-I315 PolarHBondContact N-O 3.37Å; L283-I315 HydrophobicContact CD1-CD1 3.96Å; L283-I315 HydrophobicContact CD1-CG1 3.88Å; I287-I315 HydrophobicContact CD1-CD1 3.74Å; I287-I315 HydrophobicContact CG1-CD1 4.03Å; H297-I315 WeakPolarHBondContact NE2-CG2 3.43Å; L300-I315 HydrophobicContact CD2-CG2 3.97Å; L305-I315 HydrophobicContact CD2-CB 4.39Å; L305-I315 HydrophobicContact CD2-CG1 3.93Å; L305-I315 HydrophobicContact CD2-CG2 4.44Å; L313-I315 HydrophobicContact CD2-CG1 4.48Å; I315-F318 HydrophobicContact CG2-CZ 4.28Å
316	G	90.3	Very high	88.4	Confident	7 Å²	7	32.5 Å²	32.5	7%	0.072	17%	0.17	C	C	.	.			trans	-125.1	177.2	177.5	0	0	0	0	0	112.9	H297 N304	H297-G316 PolarHBondContact NE2-O 3.36Å; H297-G316 VanDerWaalsContact NE2-O 3.12Å; N304-G316 PolarHBondContact O-N 3.29Å
317	D	84.9	Confident	87.7	Confident	47 Å²	47	35.9 Å²	35.9	25%	0.251	19%	0.193	S	C	.	.			trans	59.9	81.2	179.6	-159.1	23	0	0	0	115.6	K203 H297 N304 G319	K203-D317 IonicContact NZ-OD1 2.95Å; K203-D317 PolarHBondContact NZ-OD1 3.23Å; H297-D317 PolarHBondContact CE1-O 2.95Å; H297-D317 PolarHBondContact NE2-O 3.32Å; N304-D317 HydrophobicContact CB-CB 4.46Å; D317-G319 VanDerWaalsContact C-N 3.3Å; D317-G319 PolarHBondContact O-N 3.28Å
318	F	84	Confident	87	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.009	21%	0.212	C	C	.	.			trans	-90.8	15.8	179	-71.9	-100.1	0	0	0	113	E221 L225 I234 L290 H297 I315 L320 A321	E221-F318 HydrophobicContact CG-CB 4.42Å; L225-F318 HydrophobicContact CD2-CB 4.39Å; L225-F318 HydrophobicContact CD2-CD2 3.41Å; L225-F318 VanDerWaalsContact CD2-CD2 3.41Å; L225-F318 HydrophobicContact CD2-CE2 3.75Å; L225-F318 HydrophobicContact CD2-CG 3.88Å; L225-F318 HydrophobicContact CD2-CZ 4.47Å; L225-F318 HydrophobicContact CG-CB 4.27Å; L225-F318 HydrophobicContact CG-CD2 4.2Å; L225-F318 HydrophobicContact CG-CG 4.25Å; I234-F318 HydrophobicContact CG2-CE2 3.86Å; I234-F318 HydrophobicContact CG2-CZ 3.65Å; L290-F318 HydrophobicContact CD1-CE1 3.7Å; L290-F318 HydrophobicContact CD1-CZ 3.98Å; L290-F318 HydrophobicContact CD2-CE1 3.57Å; L290-F318 HydrophobicContact CD2-CZ 4.05Å; L290-F318 HydrophobicContact CG-CE1 4.29Å; H297-F318 AromaticContact CD2-CE1 3.91Å; I315-F318 HydrophobicContact CG2-CZ 4.28Å; F318-L320 PolarHBondContact O-N 2.86Å; F318-L320 VanDerWaalsContact O-N 3.15Å; F318-A321 HydrophobicContact CB-CB 3.93Å; F318-A321 HydrophobicContact CD1-CB 3.74Å; F318-A321 HydrophobicContact CG-CB 4.32Å; F318-A321 VanDerWaalsContact O-CB 3.31Å; F318-A321 WeakPolarHBondContact O-CB 3.44Å; F318-A321 PolarHBondContact O-N 3.21Å
319	G	76.7	Confident	86.5	Confident	3 Å²	3	43 Å²	43	3%	0.031	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.7	-177.2	0	0	0	0	0	114.1	D317	D317-G319 VanDerWaalsContact C-N 3.3Å; D317-G319 PolarHBondContact O-N 3.28Å
320	L	80.5	Confident	86.2	Confident	17 Å²	17	44.2 Å²	44.2	9%	0.089	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	3.9	171.5	-69.4	177.3	0	0	0	113.4	Y185 H297 R298 D299 F318	Y185-L320 WeakPolarHBondContact OH-CD2 3.49Å; Y185-L320 WeakPolarHBondContact OH-CG 3.23Å; H297-L320 CarbonylContact O-C 3.24Å; R298-L320 HydrophobicContact CB-CB 4.38Å; R298-L320 PolarHBondContact NE-O 3.37Å; R298-L320 PolarHBondContact NH2-O 2.88Å; D299-L320 HydrophobicContact CB-CB 4.29Å; D299-L320 HydrophobicContact CB-CD1 3.76Å; D299-L320 HydrophobicContact CB-CG 4.48Å; F318-L320 PolarHBondContact O-N 2.86Å; F318-L320 VanDerWaalsContact O-N 3.15Å
321	A	84.7	Confident	85.8	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.203	C	C	.	.			trans	-67.5	148.4	-177.6	0	0	0	0	0	111.9	M224 I295 L296 F318	M224-A321 HydrophobicContact CB-CB 4.31Å; M224-A321 HydrophobicContact CG-CB 3.94Å; I295-A321 HydrophobicContact CG2-CB 4.16Å; L296-A321 CarbonylContact O-C 3.42Å; L296-A321 WeakPolarHBondContact O-CA 3.49Å; L296-A321 WeakPolarHBondContact O-CB 3.5Å; F318-A321 HydrophobicContact CB-CB 3.93Å; F318-A321 HydrophobicContact CD1-CB 3.74Å; F318-A321 HydrophobicContact CG-CB 4.32Å; F318-A321 VanDerWaalsContact O-CB 3.31Å; F318-A321 WeakPolarHBondContact O-CB 3.44Å; F318-A321 PolarHBondContact O-N 3.21Å
322	R	84.8	Confident	85.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	147.4	177.8	-100.6	-166.9	171	112	16.5	112.2	D97 D99 D103 L296 R298	D97-R322 IonicContact OD1-CZ 2.82Å; D97-R322 IonicContact OD1-NH1 3.95Å; D97-R322 PolarHBondContact OD1-NH1 2.83Å; D97-R322 IonicContact OD1-NH2 2.63Å; D97-R322 IonicContact OD2-CZ 3.25Å; D97-R322 IonicContact OD2-NH1 3.19Å; D97-R322 PolarHBondContact OD2-NH1 3.19Å; D97-R322 IonicContact OD2-NH2 3.18Å; D99-R322 VanDerWaalsContact CB-CZ 3.46Å; D99-R322 PolarHBondContact O-NH2 2.75Å; D99-R322 IonicContact OD2-CZ 2.88Å; D99-R322 VanDerWaalsContact OD2-CZ 3.29Å; D99-R322 IonicContact OD2-NE 2.85Å; D99-R322 IonicContact OD2-NH1 3.85Å; D99-R322 PolarHBondContact OD2-NH1 2.77Å; D99-R322 IonicContact OD2-NH2 3.8Å; D103-R322 IonicContact OD2-CZ 3.95Å; D103-R322 IonicContact OD2-NE 3.77Å; D103-R322 PolarHBondContact OD2-NE 3.49Å; D103-R322 IonicContact OD2-NH2 2.7Å; L296-R322 PolarHBondContact N-O 3.13Å; L296-R322 PolarHBondContact O-N 3.17Å; R298-R322 VanDerWaalsContact NH2-CG 3.34Å
323	E	85.7	Confident	84.2	Confident	47 Å²	47	34.7 Å²	34.7	22%	0.22	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	136.2	167.6	-78.5	168.3	-118.8	0	0	110.7	M224 K227 W294 Y331	M224-E323 HydrophobicContact CE-CG 3.99Å; M224-E323 WeakPolarHBondContact CE-OE1 3.28Å; M224-E323 HydrophobicContact SD-CG 4.07Å; K227-E323 WeakPolarHBondContact CD-OE1 3.33Å; K227-E323 WeakPolarHBondContact CE-OE1 3.19Å; K227-E323 IonicContact NZ-OE1 2.66Å; K227-E323 PolarHBondContact NZ-OE1 3.48Å; K227-E323 IonicContact NZ-OE2 3.41Å; K227-E323 PolarHBondContact NZ-OE2 2.77Å; W294-E323 CarbonylContact O-C 3.56Å; W294-E323 VanDerWaalsContact O-CA 3.26Å; W294-E323 WeakPolarHBondContact O-CA 3.45Å; E323-Y331 PolarHBondContact O-OH 2.81Å
324	Y	87.9	Confident	83.5	Confident	40 Å²	40	37.8 Å²	37.8	16%	0.157	22%	0.222	C	C	.	.			trans	-112.6	160.5	168.5	77.7	-82.4	0	0	0	111.7	H291 W294 L296 Y331 T354	H291-Y324 PolarHBondContact O-OH 3.25Å; W294-Y324 VanDerWaalsContact CA-CE1 3.43Å; W294-Y324 HydrophobicContact CB-CE1 4.4Å; W294-Y324 AromaticContact CE3-CD2 3.95Å; W294-Y324 HydrophobicContact CE3-CD2 3.95Å; W294-Y324 AromaticContact CE3-CE2 3.57Å; W294-Y324 HydrophobicContact CE3-CE2 3.57Å; W294-Y324 AromaticContact CE3-CZ 3.98Å; W294-Y324 HydrophobicContact CZ3-CD2 4.36Å; W294-Y324 AromaticContact CZ3-CE2 3.88Å; W294-Y324 HydrophobicContact CZ3-CE2 3.88Å; W294-Y324 WeakPolarHBondContact O-CD1 3.19Å; W294-Y324 PolarHBondContact O-N 3.05Å; L296-Y324 HydrophobicContact CD1-CD1 4.48Å; L296-Y324 HydrophobicContact CD1-CG 4.46Å; L296-Y324 HydrophobicContact CD2-CD1 3.49Å; L296-Y324 VanDerWaalsContact CD2-CD1 3.49Å; L296-Y324 HydrophobicContact CD2-CE1 3.88Å; L296-Y324 HydrophobicContact CD2-CG 4.03Å; L296-Y324 HydrophobicContact CG-CD1 3.6Å; L296-Y324 HydrophobicContact CG-CE1 4.42Å; L296-Y324 HydrophobicContact CG-CG 4.05Å; Y324-Y331 VanDerWaalsContact CA-OH 3.27Å; Y324-Y331 WeakPolarHBondContact CA-OH 3Å; Y324-T354 HydrophobicContact CE1-CG2 3.69Å; Y324-T354 HydrophobicContact CE2-CG2 4.07Å; Y324-T354 VanDerWaalsContact CZ-CG2 3.43Å; Y324-T354 VanDerWaalsContact OH-CG2 3.29Å; Y324-T354 WeakPolarHBondContact OH-CG2 3.4Å
325	G	82.2	Confident	82.6	Confident	25 Å²	25	36.8 Å²	36.8	26%	0.258	22%	0.218	S	C	.	.			trans	-153.9	178.6	-175.3	0	0	0	0	0	113.2	P327 L328	G325-P327 CarbonylContact C-O 3.32Å; G325-P327 CarbonylContact O-C 3.56Å; G325-P327 VanDerWaalsContact O-C 3.27Å; G325-L328 WeakPolarHBondContact O-CA 3.16Å; G325-L328 PolarHBondContact O-N 3.47Å
326	S	82.1	Confident	81.7	Confident	112 Å²	112	37 Å²	37	78%	0.783	22%	0.22	S	C	*	.	S	Bend	trans	-117.2	121.1	171.2	-172.8	0	0	0	0	108.7
327	P	80.5	Confident	81.5	Confident	108 Å²	108	37.4 Å²	37.4	70%	0.701	22%	0.221	S	C	*	.	S	Bend	cis	-69.1	155.4	0.1	31.1	-35.7	0	0	0	112.5	G325 K329	G325-P327 CarbonylContact C-O 3.32Å; G325-P327 CarbonylContact O-C 3.56Å; G325-P327 VanDerWaalsContact O-C 3.27Å; P327-K329 PolarHBondContact O-N 3.33Å
328	L	81.1	Confident	81.7	Confident	76 Å²	76	36 Å²	36	40%	0.398	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-61.8	135.4	173	-70.4	170.9	0	0	0	109.1	G325	G325-L328 WeakPolarHBondContact O-CA 3.16Å; G325-L328 PolarHBondContact O-N 3.47Å
329	K	81	Confident	82.1	Confident	94 Å²	94	38.5 Å²	38.5	41%	0.409	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-95.3	153.4	173.1	-62.6	176.3	-173	169	0	108.6	P327 Y331	P327-K329 PolarHBondContact O-N 3.33Å; K329-Y331 VanDerWaalsContact O-CD2 3.27Å; K329-Y331 WeakPolarHBondContact O-CD2 3.23Å; K329-Y331 VanDerWaalsContact O-CE2 3.29Å; K329-Y331 WeakPolarHBondContact O-CE2 3.39Å
330	P	80.8	Confident	82.9	Confident	75 Å²	75	38.7 Å²	38.7	49%	0.487	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-66.2	140.6	166.4	29.2	-33.6	0	0	0	109.6	K350	P330-K350 CarbonylContact C-O 3.39Å; P330-K350 WeakPolarHBondContact CA-O 3.35Å; P330-K350 HydrophobicContact CB-CB 3.93Å
331	Y	80.7	Confident	83.4	Confident	8 Å²	8	38.7 Å²	38.7	3%	0.031	22%	0.221	C	C	.	.			trans	-129.1	164.3	175.4	-60.9	-73.4	0	0	0	111.3	D99 E323 Y324 K329 P333 K350 Y352	D99-Y331 VanDerWaalsContact OD2-CA 3.25Å; D99-Y331 WeakPolarHBondContact OD2-CA 3.46Å; E323-Y331 PolarHBondContact O-OH 2.81Å; Y324-Y331 VanDerWaalsContact CA-OH 3.27Å; Y324-Y331 WeakPolarHBondContact CA-OH 3Å; K329-Y331 VanDerWaalsContact O-CD2 3.27Å; K329-Y331 WeakPolarHBondContact O-CD2 3.23Å; K329-Y331 VanDerWaalsContact O-CE2 3.29Å; K329-Y331 WeakPolarHBondContact O-CE2 3.39Å; Y331-P333 WeakPolarHBondContact O-CD 2.9Å; Y331-K350 PolarHBondContact N-O 3.24Å; Y331-Y352 WeakPolarHBondContact CB-OH 2.91Å; Y331-Y352 HydrophobicContact CD2-CD2 4.24Å; Y331-Y352 AromaticContact CD2-CE2 3.9Å; Y331-Y352 HydrophobicContact CD2-CE2 3.9Å; Y331-Y352 HydrophobicContact CG-CE1 4.47Å; Y331-Y352 HydrophobicContact CG-CE2 4.18Å; Y331-Y352 AromaticContact CG-CZ 3.96Å
332	T	79.9	Confident	83.6	Confident	16 Å²	16	38.8 Å²	38.8	10%	0.098	22%	0.222	C	C	.	.			trans	-58.5	118.5	172.9	-51.6	0	0	0	0	111.7	V95 D97 D99 V335 Y352	V95-T332 HydrophobicContact CG1-CG2 4.05Å; D97-T332 WeakPolarHBondContact OD1-CB 3.08Å; D97-T332 PolarHBondContact OD1-OG1 3.44Å; D99-T332 PolarHBondContact OD2-N 3.45Å; D99-T332 PolarHBondContact OD2-OG1 3.14Å; D99-T332 VanDerWaalsContact OD2-OG1 3.06Å; T332-V335 WeakPolarHBondContact O-CG1 3.24Å; T332-Y352 PolarHBondContact O-OH 3.07Å; T332-Y352 VanDerWaalsContact O-OH 3.08Å
333	P	72.9	Confident	83.8	Confident	27 Å²	27	39 Å²	39	18%	0.175	22%	0.223	C	C	.	.	S	Bend	trans	-78.2	-21.7	-178.1	29.7	-34.2	0	0	0	113.9	Y331 V335	Y331-P333 WeakPolarHBondContact O-CD 2.9Å; P333-V335 PolarHBondContact O-N 3.31Å
334	V	80.6	Confident	83.8	Confident	66 Å²	66	36.9 Å²	36.9	40%	0.4	21%	0.213	S	C	.	.	S	Bend	trans	-82.5	56.1	-178.2	-165.6	0	0	0	0	110.7	V95	V95-V334 HydrophobicContact CG2-CG1 4.34Å; V95-V334 VanDerWaalsContact CG2-O 3.3Å; V95-V334 WeakPolarHBondContact CG2-O 3.36Å
335	V	77.9	Confident	83.9	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.018	21%	0.207	C	C	.	.			trans	-118.5	170.8	177.1	-65.3	0	0	0	0	110.1	R298 T332 P333 R341 L345	R298-V335 HydrophobicContact CB-CB 4.43Å; R298-V335 HydrophobicContact CB-CG2 4.4Å; T332-V335 WeakPolarHBondContact O-CG1 3.24Å; P333-V335 PolarHBondContact O-N 3.31Å; V335-R341 PolarHBondContact O-NE 3.15Å; V335-R341 PolarHBondContact O-NH2 3.26Å; V335-L345 HydrophobicContact CG2-CD1 4.02Å; V335-L345 HydrophobicContact CG2-CD2 4.18Å
336	V	77.5	Confident	84.1	Confident	4 Å²	4	35 Å²	35	2%	0.024	20%	0.2	C	C	.	.	S	Bend	trans	66.5	136.2	-173.1	-167.9	0	0	0	0	112.4	R298 L338 R341 L345	R298-V336 WeakPolarHBondContact O-CA 3.4Å; R298-V336 WeakPolarHBondContact O-CG2 3.17Å; R298-V336 PolarHBondContact O-N 3.04Å; V336-L338 PolarHBondContact O-N 3.49Å; V336-R341 HydrophobicContact CB-CB 4.22Å; V336-R341 HydrophobicContact CB-CG 4.3Å; V336-R341 HydrophobicContact CG1-CB 4.33Å; V336-R341 PolarHBondContact O-NE 3.45Å; V336-R341 VanDerWaalsContact O-NE 3.11Å; V336-R341 PolarHBondContact O-NH2 3.19Å; V336-L345 HydrophobicContact CG2-CD1 3.83Å
337	T	84.8	Confident	84.2	Confident	15 Å²	15	31 Å²	31	9%	0.092	17%	0.169	C	C	.	.			trans	-54.6	132.3	168.6	-59.9	0	0	0	0	111.1	Q92 D299 K301 W339 Y340 R341	Q92-T337 PolarHBondContact NE2-OG1 3.38Å; D299-T337 PolarHBondContact OD1-N 3.49Å; D299-T337 PolarHBondContact OD1-OG1 3.44Å; K301-T337 HydrophobicContact CD-CG2 4.44Å; K301-T337 WeakPolarHBondContact CD-OG1 3.31Å; K301-T337 PolarHBondContact NZ-OG1 2.99Å; T337-W339 PolarHBondContact O-N 3.18Å; T337-Y340 HydrophobicContact CG2-CD2 4.37Å; T337-Y340 PolarHBondContact O-N 3.18Å; T337-R341 PolarHBondContact O-N 3Å
338	L	89.9	Confident	84.3	Confident	19 Å²	19	27.2 Å²	27.2	10%	0.099	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-46.2	-42.6	-168.3	-178.7	60.8	0	0	0	114.4	V336 Y340 R341 L346 G377 E380 Q383	V336-L338 PolarHBondContact O-N 3.49Å; L338-Y340 PolarHBondContact O-N 3.27Å; L338-R341 WeakPolarHBondContact O-CB 3.41Å; L338-R341 PolarHBondContact O-N 3.22Å; L338-L346 HydrophobicContact CD1-CD2 3.8Å; L338-G377 WeakPolarHBondContact CD2-O 3.22Å; L338-E380 HydrophobicContact CD1-CG 4.01Å; L338-Q383 HydrophobicContact CD1-CB 3.7Å; L338-Q383 HydrophobicContact CD1-CG 3.79Å; L338-Q383 HydrophobicContact CG-CB 4.09Å; L338-Q383 HydrophobicContact CG-CG 4.11Å; L338-Q383 WeakPolarHBondContact O-CG 3.46Å; L338-Q383 PolarHBondContact O-NE2 3.37Å
339	W	91.2	Very high	84.6	Confident	53 Å²	53	25.1 Å²	25.1	20%	0.201	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-65.1	-23.9	-176.6	-64	-5.4	0	0	0	114.9	E88 T337 P373 F375 P376 G377 Q383	E88-W339 HydrophobicContact CG-CH2 4.37Å; E88-W339 HydrophobicContact CG-CZ3 4.47Å; E88-W339 WeakPolarHBondContact OE1-CZ3 3.47Å; T337-W339 PolarHBondContact O-N 3.18Å; W339-P373 HydrophobicContact CD2-CB 4.38Å; W339-P373 HydrophobicContact CE3-CB 3.68Å; W339-P373 HydrophobicContact CE3-CG 3.95Å; W339-P373 HydrophobicContact CH2-CG 4.43Å; W339-P373 HydrophobicContact CZ3-CB 4.04Å; W339-P373 HydrophobicContact CZ3-CG 3.8Å; W339-F375 VanDerWaalsContact CA-O 3.28Å; W339-F375 WeakPolarHBondContact CA-O 3.26Å; W339-F375 WeakPolarHBondContact CB-O 3.36Å; W339-F375 VanDerWaalsContact CD1-O 3.3Å; W339-P376 HydrophobicContact CD2-CB 4.39Å; W339-P376 HydrophobicContact CZ2-CB 4.16Å; W339-G377 VanDerWaalsContact CD1-O 3.31Å; W339-G377 PolarHBondContact NE1-O 2.61Å; W339-Q383 PolarHBondContact O-NE2 3.3Å
340	Y	93.1	Very high	84.8	Confident	7 Å²	7	26.8 Å²	26.8	3%	0.027	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-109.3	0.4	-179.5	-53.7	-93.7	0	0	0	111.6	L300 K301 T302 T337 L338 W359 S360 C363 V364 E367	L300-Y340 WeakPolarHBondContact O-CB 3.43Å; K301-Y340 HydrophobicContact CB-CD1 4.43Å; K301-Y340 HydrophobicContact CB-CD2 3.63Å; K301-Y340 HydrophobicContact CB-CE1 4.35Å; K301-Y340 HydrophobicContact CB-CE2 3.51Å; K301-Y340 HydrophobicContact CB-CG 4.11Å; T302-Y340 PolarHBondContact OG1-OH 3.12Å; T337-Y340 HydrophobicContact CG2-CD2 4.37Å; T337-Y340 PolarHBondContact O-N 3.18Å; L338-Y340 PolarHBondContact O-N 3.27Å; Y340-W359 VanDerWaalsContact O-CD1 3.25Å; Y340-S360 PolarHBondContact O-OG 2.81Å; Y340-S360 VanDerWaalsContact O-OG 3.07Å; Y340-C363 HydrophobicContact CD1-CB 3.63Å; Y340-C363 HydrophobicContact CE1-CB 4.24Å; Y340-C363 HydrophobicContact CG-CB 4.46Å; Y340-V364 HydrophobicContact CD1-CG2 3.97Å; Y340-V364 HydrophobicContact CE1-CG2 3.82Å; Y340-E367 WeakPolarHBondContact CE1-OE2 3.49Å; Y340-E367 VanDerWaalsContact CZ-OE2 3.29Å; Y340-E367 PolarHBondContact OH-OE1 3.05Å; Y340-E367 PolarHBondContact OH-OE2 2.96Å
341	R	91.4	Very high	85.1	Confident	18 Å²	18	29.3 Å²	29.3	7%	0.068	15%	0.153	C	C	.	.			trans	-71.4	133.3	-175.7	-169.2	179.1	-64.9	169.8	-2.6	111.4	V335 V336 T337 L338 L345 L346 W359 E380	V335-R341 PolarHBondContact O-NE 3.15Å; V335-R341 PolarHBondContact O-NH2 3.26Å; V336-R341 HydrophobicContact CB-CB 4.22Å; V336-R341 HydrophobicContact CB-CG 4.3Å; V336-R341 HydrophobicContact CG1-CB 4.33Å; V336-R341 PolarHBondContact O-NE 3.45Å; V336-R341 VanDerWaalsContact O-NE 3.11Å; V336-R341 PolarHBondContact O-NH2 3.19Å; T337-R341 PolarHBondContact O-N 3Å; L338-R341 WeakPolarHBondContact O-CB 3.41Å; L338-R341 PolarHBondContact O-N 3.22Å; R341-L345 HydrophobicContact CG-CB 3.73Å; R341-L345 HydrophobicContact CG-CD1 4Å; R341-L346 HydrophobicContact CB-CD2 4.45Å; R341-L346 HydrophobicContact CB-CG 4.49Å; R341-L346 HydrophobicContact CG-CD2 4.22Å; R341-L346 HydrophobicContact CG-CG 4.12Å; R341-W359 PolarHBondContact O-NE1 3.3Å; R341-E380 IonicContact CZ-OE1 3.91Å; R341-E380 IonicContact NH1-OE1 3.49Å; R341-E380 PolarHBondContact NH1-OE1 3.4Å
342	A	90.5	Very high	85.5	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.008	15%	0.153	C	C	.	.			trans	-71.2	150.2	179.9	0	0	0	0	0	112.4	E344 L345 L346 I356 W359	A342-E344 VanDerWaalsContact C-N 3.29Å; A342-E344 VanDerWaalsContact CB-CD 3.5Å; A342-E344 HydrophobicContact CB-CG 4.27Å; A342-E344 WeakPolarHBondContact CB-OE2 3.45Å; A342-E344 PolarHBondContact O-N 3.47Å; A342-L345 HydrophobicContact CB-CD1 4.45Å; A342-L345 PolarHBondContact O-N 3.06Å; A342-L345 VanDerWaalsContact O-N 3.13Å; A342-L346 PolarHBondContact O-N 3.05Å; A342-L346 VanDerWaalsContact O-N 3.17Å; A342-I356 HydrophobicContact CB-CB 4.31Å; A342-I356 HydrophobicContact CB-CG2 4.3Å; A342-W359 HydrophobicContact CB-CB 3.79Å; A342-W359 HydrophobicContact CB-CD2 4.35Å; A342-W359 HydrophobicContact CB-CG 3.76Å
343	P	87.9	Confident	86.1	Confident	4 Å²	4	30.3 Å²	30.3	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-57.2	-38.1	-179.6	17.4	-28.5	0	0	0	113.5	L345 L346 L347 W359 M389 Y444	P343-L345 VanDerWaalsContact C-N 3.3Å; P343-L345 PolarHBondContact O-N 3.47Å; P343-L346 PolarHBondContact O-N 3.41Å; P343-L347 VanDerWaalsContact O-CG 3.29Å; P343-L347 WeakPolarHBondContact O-CG 3.26Å; P343-L347 PolarHBondContact O-N 3.29Å; P343-W359 HydrophobicContact CG-CE3 4.11Å; P343-W359 HydrophobicContact CG-CH2 4.09Å; P343-W359 HydrophobicContact CG-CZ3 3.84Å; P343-M389 HydrophobicContact CB-CE 3.73Å; P343-M389 HydrophobicContact CG-CE 4.02Å; P343-Y444 HydrophobicContact CB-CD1 3.9Å; P343-Y444 HydrophobicContact CB-CE1 4.29Å; P343-Y444 HydrophobicContact CG-CD1 3.78Å; P343-Y444 HydrophobicContact CG-CE1 4.42Å
344	E	86.6	Confident	87.1	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.019	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-36	178.4	59.4	-90.8	-145.8	0	0	112.9	A342 L347 G348 V349 I356 L403 P446 R449	A342-E344 VanDerWaalsContact C-N 3.29Å; A342-E344 VanDerWaalsContact CB-CD 3.5Å; A342-E344 HydrophobicContact CB-CG 4.27Å; A342-E344 WeakPolarHBondContact CB-OE2 3.45Å; A342-E344 PolarHBondContact O-N 3.47Å; E344-L347 PolarHBondContact O-N 3.38Å; E344-G348 PolarHBondContact O-N 3.18Å; E344-V349 HydrophobicContact CB-CB 4.26Å; E344-V349 HydrophobicContact CB-CG2 4.15Å; E344-V349 VanDerWaalsContact O-CB 3.28Å; E344-V349 WeakPolarHBondContact O-CB 3.42Å; E344-V349 WeakPolarHBondContact O-CG2 3.49Å; E344-V349 PolarHBondContact O-N 3.02Å; E344-I356 HydrophobicContact CG-CG2 4.09Å; E344-L403 HydrophobicContact CB-CD2 3.94Å; E344-P446 HydrophobicContact CB-CG 4.14Å; E344-P446 HydrophobicContact CG-CG 4.04Å; E344-R449 IonicContact OE1-CZ 3.54Å; E344-R449 IonicContact OE1-NH1 3.4Å; E344-R449 PolarHBondContact OE1-NH1 3.42Å; E344-R449 IonicContact OE1-NH2 3.56Å; E344-R449 PolarHBondContact OE1-NH2 2.94Å; E344-R449 IonicContact OE2-CZ 3.88Å; E344-R449 IonicContact OE2-NH1 3.74Å; E344-R449 IonicContact OE2-NH2 2.7Å; E344-R449 PolarHBondContact OE2-NH2 3.39Å
345	L	89	Confident	87.7	Confident	6 Å²	6	28 Å²	28	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-71.1	-42.2	175.9	-67.5	175.9	0	0	0	110.7	V335 V336 R341 A342 P343 L347 G348 Y352 I356	V335-L345 HydrophobicContact CG2-CD1 4.02Å; V335-L345 HydrophobicContact CG2-CD2 4.18Å; V336-L345 HydrophobicContact CG2-CD1 3.83Å; R341-L345 HydrophobicContact CG-CB 3.73Å; R341-L345 HydrophobicContact CG-CD1 4Å; A342-L345 HydrophobicContact CB-CD1 4.45Å; A342-L345 PolarHBondContact O-N 3.06Å; A342-L345 VanDerWaalsContact O-N 3.13Å; P343-L345 VanDerWaalsContact C-N 3.3Å; P343-L345 PolarHBondContact O-N 3.47Å; L345-L347 PolarHBondContact O-N 2.98Å; L345-G348 PolarHBondContact O-N 3.5Å; L345-Y352 HydrophobicContact CD2-CD1 3.39Å; L345-Y352 HydrophobicContact CD2-CE1 3.49Å; L345-Y352 VanDerWaalsContact CD2-CE1 3.49Å; L345-Y352 HydrophobicContact CD2-CG 3.95Å; L345-I356 HydrophobicContact CD1-CB 4.07Å; L345-I356 HydrophobicContact CD1-CD1 4.16Å; L345-I356 HydrophobicContact CD1-CG2 4.04Å; L345-I356 HydrophobicContact CD2-CG2 4.31Å; L345-I356 HydrophobicContact CG-CG2 4Å
346	L	86.6	Confident	88.5	Confident	18 Å²	18	27.9 Å²	27.9	9%	0.094	15%	0.146	C	C	.	.	H	α-helix	trans	-62.5	-28.4	176.1	-66.7	167.8	0	0	0	112.9	L338 R341 A342 P343 G348 E380 Q383 C384	L338-L346 HydrophobicContact CD1-CD2 3.8Å; R341-L346 HydrophobicContact CB-CD2 4.45Å; R341-L346 HydrophobicContact CB-CG 4.49Å; R341-L346 HydrophobicContact CG-CD2 4.22Å; R341-L346 HydrophobicContact CG-CG 4.12Å; A342-L346 PolarHBondContact O-N 3.05Å; A342-L346 VanDerWaalsContact O-N 3.17Å; P343-L346 PolarHBondContact O-N 3.41Å; L346-G348 VanDerWaalsContact C-N 3.3Å; L346-E380 HydrophobicContact CD2-CB 4.02Å; L346-E380 HydrophobicContact CD2-CG 4.1Å; L346-Q383 HydrophobicContact CD1-CB 4.17Å; L346-Q383 HydrophobicContact CD1-CG 3.7Å; L346-Q383 HydrophobicContact CD2-CB 4.31Å; L346-Q383 HydrophobicContact CD2-CG 4.25Å; L346-C384 WeakPolarHBondContact CB-SG 3.13Å
347	L	84	Confident	89.5	Confident	28 Å²	28	27.7 Å²	27.7	15%	0.147	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-5.7	175.2	-65.3	165.7	0	0	0	113	P343 E344 L345 L403 V407	P343-L347 VanDerWaalsContact O-CG 3.29Å; P343-L347 WeakPolarHBondContact O-CG 3.26Å; P343-L347 PolarHBondContact O-N 3.29Å; E344-L347 PolarHBondContact O-N 3.38Å; L345-L347 PolarHBondContact O-N 2.98Å; L347-L403 HydrophobicContact CD1-CD2 3.43Å; L347-L403 VanDerWaalsContact CD1-CD2 3.43Å; L347-V407 HydrophobicContact CB-CG2 3.75Å; L347-V407 HydrophobicContact CD1-CG2 4.38Å; L347-V407 VanDerWaalsContact O-CG1 3.22Å; L347-V407 WeakPolarHBondContact O-CG1 3.44Å
348	G	83.7	Confident	90	Very high	30 Å²	30	27 Å²	27	31%	0.309	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	21.1	177.2	0	0	0	0	0	114.9	E344 L345 L346 K350	E344-G348 PolarHBondContact O-N 3.18Å; L345-G348 PolarHBondContact O-N 3.5Å; L346-G348 VanDerWaalsContact C-N 3.3Å; G348-K350 PolarHBondContact O-N 3.49Å
349	V	85.9	Confident	90.3	Very high	31 Å²	31	26.2 Å²	26.2	19%	0.188	14%	0.137	C	C	.	.			trans	-65.5	120.6	174.8	178.6	0	0	0	0	109.2	E344 E351 V407	E344-V349 HydrophobicContact CB-CB 4.26Å; E344-V349 HydrophobicContact CB-CG2 4.15Å; E344-V349 VanDerWaalsContact O-CB 3.28Å; E344-V349 WeakPolarHBondContact O-CB 3.42Å; E344-V349 WeakPolarHBondContact O-CG2 3.49Å; E344-V349 PolarHBondContact O-N 3.02Å; V349-E351 WeakPolarHBondContact CG1-O 3.27Å; V349-V407 HydrophobicContact CG2-CB 4.47Å; V349-V407 HydrophobicContact CG2-CG1 3.85Å; V349-V407 HydrophobicContact CG2-CG2 3.74Å
350	K	85.9	Confident	90.5	Very high	129 Å²	129	23.7 Å²	23.7	56%	0.561	13%	0.127	S	C	*	.			trans	-85.3	-29.9	179.9	-59.5	-170.7	177.8	-167.9	0	113.1	P330 Y331 G348 Y352	P330-K350 CarbonylContact C-O 3.39Å; P330-K350 WeakPolarHBondContact CA-O 3.35Å; P330-K350 HydrophobicContact CB-CB 3.93Å; Y331-K350 PolarHBondContact N-O 3.24Å; G348-K350 PolarHBondContact O-N 3.49Å; K350-Y352 PolarHBondContact O-N 2.87Å
351	E	87	Confident	90.7	Very high	128 Å²	128	23.4 Å²	23.4	60%	0.598	13%	0.126	S	C	*	.			trans	-93.1	96.4	178.6	-66.2	179.2	170.6	0	0	109.6	V349	V349-E351 WeakPolarHBondContact CG1-O 3.27Å
352	Y	89.6	Confident	90.8	Very high	9 Å²	9	22.6 Å²	22.6	4%	0.035	12%	0.123	C	C	.	.			trans	-130.8	165.7	179	60.2	-107.3	0	0	0	111.2	L296 R298 Y331 T332 L345 K350 I356	L296-Y352 HydrophobicContact CD1-CD2 4.03Å; L296-Y352 HydrophobicContact CD1-CE2 3.92Å; R298-Y352 WeakPolarHBondContact CD-OH 3.48Å; R298-Y352 PolarHBondContact NH1-OH 2.9Å; Y331-Y352 WeakPolarHBondContact CB-OH 2.91Å; Y331-Y352 HydrophobicContact CD2-CD2 4.24Å; Y331-Y352 AromaticContact CD2-CE2 3.9Å; Y331-Y352 HydrophobicContact CD2-CE2 3.9Å; Y331-Y352 HydrophobicContact CG-CE1 4.47Å; Y331-Y352 HydrophobicContact CG-CE2 4.18Å; Y331-Y352 AromaticContact CG-CZ 3.96Å; T332-Y352 PolarHBondContact O-OH 3.07Å; T332-Y352 VanDerWaalsContact O-OH 3.08Å; L345-Y352 HydrophobicContact CD2-CD1 3.39Å; L345-Y352 HydrophobicContact CD2-CE1 3.49Å; L345-Y352 VanDerWaalsContact CD2-CE1 3.49Å; L345-Y352 HydrophobicContact CD2-CG 3.95Å; K350-Y352 PolarHBondContact O-N 2.87Å; Y352-I356 HydrophobicContact CD2-CD1 3.49Å; Y352-I356 VanDerWaalsContact CD2-CD1 3.49Å; Y352-I356 HydrophobicContact CD2-CG1 4.36Å; Y352-I356 HydrophobicContact CD2-CG2 4.27Å; Y352-I356 HydrophobicContact CE2-CD1 3.49Å; Y352-I356 VanDerWaalsContact CE2-CD1 3.49Å; Y352-I356 HydrophobicContact CG-CD1 4.33Å; Y352-I356 HydrophobicContact CG-CG2 4.24Å
353	S	91.2	Very high	90.9	Very high	37 Å²	37	22.6 Å²	22.6	26%	0.259	12%	0.123	S	C	.	.			trans	-141.2	-156.2	-178.1	73.3	0	0	0	0	110.8	A355 I356	S353-A355 PolarHBondContact O-N 3.44Å; S353-I356 WeakPolarHBondContact O-CG1 3.44Å; S353-I356 PolarHBondContact O-N 3.49Å
354	T	94.7	Very high	91.2	Very high	34 Å²	34	22.5 Å²	22.5	21%	0.209	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-30.2	-177.5	55.8	0	0	0	0	115	H291 L296 Y324 I356 D357 L358	H291-T354 HydrophobicContact CB-CG2 3.83Å; H291-T354 VanDerWaalsContact CE1-CB 3.5Å; H291-T354 WeakPolarHBondContact CE1-CB 3.31Å; H291-T354 VanDerWaalsContact CG-CG2 3.42Å; H291-T354 WeakPolarHBondContact ND1-CB 3Å; L296-T354 VanDerWaalsContact CD2-CA 3.5Å; L296-T354 HydrophobicContact CD2-CG2 3.9Å; L296-T354 VanDerWaalsContact CD2-N 3.35Å; Y324-T354 HydrophobicContact CE1-CG2 3.69Å; Y324-T354 HydrophobicContact CE2-CG2 4.07Å; Y324-T354 VanDerWaalsContact CZ-CG2 3.43Å; Y324-T354 VanDerWaalsContact OH-CG2 3.29Å; Y324-T354 WeakPolarHBondContact OH-CG2 3.4Å; T354-I356 PolarHBondContact O-N 3.27Å; T354-I356 VanDerWaalsContact O-N 3.08Å; T354-D357 WeakPolarHBondContact O-CB 3.43Å; T354-D357 PolarHBondContact O-N 2.99Å; T354-L358 WeakPolarHBondContact O-CD2 3.36Å; T354-L358 PolarHBondContact O-N 2.79Å
355	A	94.3	Very high	91.5	Very high	9 Å²	9	22.3 Å²	22.3	7%	0.074	12%	0.122	C	C	.	.	H	α-helix	trans	-54.3	-33.2	-176.6	0	0	0	0	0	113.6	S353 D357 L358 W359 P446 R449	S353-A355 PolarHBondContact O-N 3.44Å; A355-D357 VanDerWaalsContact C-N 3.29Å; A355-D357 PolarHBondContact O-N 3.5Å; A355-L358 PolarHBondContact O-N 2.79Å; A355-L358 VanDerWaalsContact O-N 3.16Å; A355-W359 PolarHBondContact O-N 3.04Å; A355-W359 VanDerWaalsContact O-N 3.1Å; A355-P446 HydrophobicContact CB-CB 3.73Å; A355-R449 VanDerWaalsContact O-CD 3.32Å; A355-R449 WeakPolarHBondContact O-CD 3.37Å; A355-R449 PolarHBondContact O-NH1 3.2Å
356	I	94.7	Very high	91.4	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-63.2	-36.1	-179.1	68	173.5	0	0	0	112.1	R298 A342 E344 L345 Y352 S353 T354 L358 W359 S360	R298-I356 HydrophobicContact CG-CD1 3.99Å; A342-I356 HydrophobicContact CB-CB 4.31Å; A342-I356 HydrophobicContact CB-CG2 4.3Å; E344-I356 HydrophobicContact CG-CG2 4.09Å; L345-I356 HydrophobicContact CD1-CB 4.07Å; L345-I356 HydrophobicContact CD1-CD1 4.16Å; L345-I356 HydrophobicContact CD1-CG2 4.04Å; L345-I356 HydrophobicContact CD2-CG2 4.31Å; L345-I356 HydrophobicContact CG-CG2 4Å; Y352-I356 HydrophobicContact CD2-CD1 3.49Å; Y352-I356 VanDerWaalsContact CD2-CD1 3.49Å; Y352-I356 HydrophobicContact CD2-CG1 4.36Å; Y352-I356 HydrophobicContact CD2-CG2 4.27Å; Y352-I356 HydrophobicContact CE2-CD1 3.49Å; Y352-I356 VanDerWaalsContact CE2-CD1 3.49Å; Y352-I356 HydrophobicContact CG-CD1 4.33Å; Y352-I356 HydrophobicContact CG-CG2 4.24Å; S353-I356 WeakPolarHBondContact O-CG1 3.44Å; S353-I356 PolarHBondContact O-N 3.49Å; T354-I356 PolarHBondContact O-N 3.27Å; T354-I356 VanDerWaalsContact O-N 3.08Å; I356-L358 VanDerWaalsContact C-N 3.34Å; I356-W359 PolarHBondContact O-N 3.14Å; I356-S360 PolarHBondContact O-N 3Å; I356-S360 PolarHBondContact O-OG 2.84Å; I356-S360 VanDerWaalsContact O-OG 3.12Å
357	D	96.7	Very high	91.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.8	-39.2	177.5	-72.7	-25.1	0	0	0	109.4	H291 H297 R298 L300 T354 A355 W359 S360 V361	H291-D357 IonicContact CD2-OD2 3.25Å; H291-D357 IonicContact CE1-OD2 2.79Å; H291-D357 IonicContact NE2-OD2 2.79Å; H291-D357 PolarHBondContact NE2-OD2 2.98Å; H297-D357 PolarHBondContact N-OD2 3.19Å; R298-D357 PolarHBondContact N-OD1 3.44Å; L300-D357 HydrophobicContact CD1-CB 3.66Å; T354-D357 WeakPolarHBondContact O-CB 3.43Å; T354-D357 PolarHBondContact O-N 2.99Å; A355-D357 VanDerWaalsContact C-N 3.29Å; A355-D357 PolarHBondContact O-N 3.5Å; D357-W359 VanDerWaalsContact C-N 3.31Å; D357-W359 PolarHBondContact O-N 3.44Å; D357-S360 WeakPolarHBondContact O-CA 3.01Å; D357-S360 VanDerWaalsContact O-CB 3.31Å; D357-S360 WeakPolarHBondContact O-CB 3Å; D357-S360 PolarHBondContact O-N 3.12Å; D357-S360 VanDerWaalsContact O-N 3.1Å; D357-V361 WeakPolarHBondContact O-CG2 3.44Å; D357-V361 PolarHBondContact O-N 2.99Å
358	L	96.8	Very high	92	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-68	-29.7	179.6	-74.4	-43.4	0	0	0	112.9	I287 H291 T354 A355 I356 G362 F441 R449 I450 A452	I287-L358 HydrophobicContact CG2-CD1 4.19Å; H291-L358 VanDerWaalsContact CE1-CD2 3.45Å; H291-L358 WeakPolarHBondContact CE1-CD2 3.48Å; T354-L358 WeakPolarHBondContact O-CD2 3.36Å; T354-L358 PolarHBondContact O-N 2.79Å; A355-L358 PolarHBondContact O-N 2.79Å; A355-L358 VanDerWaalsContact O-N 3.16Å; I356-L358 VanDerWaalsContact C-N 3.34Å; L358-G362 PolarHBondContact O-N 3.45Å; L358-F441 HydrophobicContact CB-CD1 4.23Å; L358-F441 HydrophobicContact CD1-CD1 4.38Å; L358-F441 HydrophobicContact CD1-CE1 4.06Å; L358-F441 WeakPolarHBondContact O-CD1 3.5Å; L358-R449 HydrophobicContact CB-CG 4.4Å; L358-I450 WeakPolarHBondContact CG-O 3.38Å; L358-A452 HydrophobicContact CD1-CB 4.1Å
359	W	94.8	Very high	92.1	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.008	10%	0.096	C	C	.	.	H	α-helix	trans	-64.5	-46.1	169.7	177.9	-82	0	0	0	111.2	Y340 R341 A342 P343 A355 I356 D357 V361 G362 C363 F375 M389 L442	Y340-W359 VanDerWaalsContact O-CD1 3.25Å; R341-W359 PolarHBondContact O-NE1 3.3Å; A342-W359 HydrophobicContact CB-CB 3.79Å; A342-W359 HydrophobicContact CB-CD2 4.35Å; A342-W359 HydrophobicContact CB-CG 3.76Å; P343-W359 HydrophobicContact CG-CE3 4.11Å; P343-W359 HydrophobicContact CG-CH2 4.09Å; P343-W359 HydrophobicContact CG-CZ3 3.84Å; A355-W359 PolarHBondContact O-N 3.04Å; A355-W359 VanDerWaalsContact O-N 3.1Å; I356-W359 PolarHBondContact O-N 3.14Å; D357-W359 VanDerWaalsContact C-N 3.31Å; D357-W359 PolarHBondContact O-N 3.44Å; W359-V361 VanDerWaalsContact C-N 3.31Å; W359-V361 PolarHBondContact O-N 3.02Å; W359-G362 PolarHBondContact O-N 3.45Å; W359-G362 VanDerWaalsContact O-N 3.1Å; W359-C363 PolarHBondContact O-N 3.33Å; W359-C363 PolarHBondContact O-SG 3.38Å; W359-C363 VanDerWaalsContact O-SG 3.36Å; W359-F375 HydrophobicContact CZ2-CD2 4.38Å; W359-F375 AromaticContact CZ2-CE2 3.73Å; W359-F375 HydrophobicContact CZ2-CE2 3.73Å; W359-F375 HydrophobicContact CZ2-CZ 4.32Å; W359-M389 HydrophobicContact CH2-CE 3.5Å; W359-M389 HydrophobicContact CH2-CG 4.47Å; W359-M389 HydrophobicContact CZ2-CE 3.43Å; W359-M389 VanDerWaalsContact CZ2-CE 3.43Å; W359-L442 HydrophobicContact CD2-CD2 3.98Å; W359-L442 HydrophobicContact CE3-CD2 4.14Å; W359-L442 HydrophobicContact CG-CD2 4.5Å; W359-L442 HydrophobicContact CH2-CB 4.4Å; W359-L442 HydrophobicContact CH2-CD2 4.32Å; W359-L442 HydrophobicContact CZ2-CD2 4.15Å; W359-L442 HydrophobicContact CZ3-CB 4.15Å; W359-L442 HydrophobicContact CZ3-CD2 4.32Å; W359-L442 WeakPolarHBondContact CZ3-O 3.42Å
360	S	96.4	Very high	92	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.1	-42.3	177.1	-52.3	0	0	0	0	111	Y340 I356 D357 G362 C363 V364	Y340-S360 PolarHBondContact O-OG 2.81Å; Y340-S360 VanDerWaalsContact O-OG 3.07Å; I356-S360 PolarHBondContact O-N 3Å; I356-S360 PolarHBondContact O-OG 2.84Å; I356-S360 VanDerWaalsContact O-OG 3.12Å; D357-S360 WeakPolarHBondContact O-CA 3.01Å; D357-S360 VanDerWaalsContact O-CB 3.31Å; D357-S360 WeakPolarHBondContact O-CB 3Å; D357-S360 PolarHBondContact O-N 3.12Å; D357-S360 VanDerWaalsContact O-N 3.1Å; S360-G362 VanDerWaalsContact C-N 3.34Å; S360-G362 PolarHBondContact O-N 2.82Å; S360-C363 WeakPolarHBondContact O-CB 3.43Å; S360-C363 PolarHBondContact O-N 3.32Å; S360-C363 VanDerWaalsContact O-N 3.13Å; S360-V364 WeakPolarHBondContact O-CG2 3.45Å; S360-V364 PolarHBondContact O-N 3.27Å
361	V	97	Very high	92	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-58.4	-43.1	172.7	171.8	0	0	0	0	111.4	M280 L283 L284 I287 L300 D357 W359 C363 V364 F365 F441	M280-V361 HydrophobicContact CE-CG1 3.58Å; L283-V361 HydrophobicContact CD2-CG1 4.1Å; L283-V361 HydrophobicContact CD2-CG2 4.23Å; L283-V361 HydrophobicContact CG-CG2 4.37Å; L284-V361 HydrophobicContact CD2-CG1 4.05Å; I287-V361 HydrophobicContact CG1-CG2 4.1Å; L300-V361 HydrophobicContact CD1-CG2 3.96Å; D357-V361 WeakPolarHBondContact O-CG2 3.44Å; D357-V361 PolarHBondContact O-N 2.99Å; W359-V361 VanDerWaalsContact C-N 3.31Å; W359-V361 PolarHBondContact O-N 3.02Å; V361-C363 VanDerWaalsContact C-N 3.3Å; V361-C363 PolarHBondContact O-N 2.91Å; V361-V364 PolarHBondContact O-N 3.34Å; V361-F365 WeakPolarHBondContact O-CB 3.35Å; V361-F365 PolarHBondContact O-N 3.43Å; V361-F441 HydrophobicContact CG1-CD1 4.27Å; V361-F441 HydrophobicContact CG1-CE1 3.89Å; V361-F441 HydrophobicContact CG1-CZ 4.14Å
362	G	93.1	Very high	92	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-37.6	174.9	0	0	0	0	0	113.4	L358 W359 S360 A366	L358-G362 PolarHBondContact O-N 3.45Å; W359-G362 PolarHBondContact O-N 3.45Å; W359-G362 VanDerWaalsContact O-N 3.1Å; S360-G362 VanDerWaalsContact C-N 3.34Å; S360-G362 PolarHBondContact O-N 2.82Å; G362-A366 PolarHBondContact O-N 2.94Å; G362-A366 VanDerWaalsContact O-N 3.15Å
363	C	92.5	Very high	91.8	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.014	9%	0.092	C	C	.	.	H	α-helix	trans	-67.6	-46	175.2	-63.9	0	0	0	0	111.6	Y340 W359 S360 V361 F365 A366 E367	Y340-C363 HydrophobicContact CD1-CB 3.63Å; Y340-C363 HydrophobicContact CE1-CB 4.24Å; Y340-C363 HydrophobicContact CG-CB 4.46Å; W359-C363 PolarHBondContact O-N 3.33Å; W359-C363 PolarHBondContact O-SG 3.38Å; W359-C363 VanDerWaalsContact O-SG 3.36Å; S360-C363 WeakPolarHBondContact O-CB 3.43Å; S360-C363 PolarHBondContact O-N 3.32Å; S360-C363 VanDerWaalsContact O-N 3.13Å; V361-C363 VanDerWaalsContact C-N 3.3Å; V361-C363 PolarHBondContact O-N 2.91Å; C363-F365 VanDerWaalsContact C-N 3.32Å; C363-F365 PolarHBondContact O-N 2.88Å; C363-A366 PolarHBondContact O-N 2.85Å; C363-E367 WeakPolarHBondContact O-CB 3.33Å; C363-E367 PolarHBondContact O-N 3.16Å
364	V	94.6	Very high	91.4	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.006	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-43.5	174.3	169.3	0	0	0	0	110.9	L283 T302 L305 Y340 S360 V361 A366 E367 L368	L283-V364 HydrophobicContact CD2-CG1 4.08Å; T302-V364 HydrophobicContact CG2-CG1 4.26Å; T302-V364 HydrophobicContact CG2-CG2 4.37Å; L305-V364 HydrophobicContact CD1-CG1 3.72Å; L305-V364 HydrophobicContact CD1-CG2 4.42Å; Y340-V364 HydrophobicContact CD1-CG2 3.97Å; Y340-V364 HydrophobicContact CE1-CG2 3.82Å; S360-V364 WeakPolarHBondContact O-CG2 3.45Å; S360-V364 PolarHBondContact O-N 3.27Å; V361-V364 PolarHBondContact O-N 3.34Å; V364-A366 PolarHBondContact O-N 2.93Å; V364-E367 WeakPolarHBondContact O-CB 3.22Å; V364-E367 PolarHBondContact O-N 2.81Å; V364-L368 HydrophobicContact CG1-CD1 4.06Å; V364-L368 HydrophobicContact CG1-CG 4.34Å; V364-L368 WeakPolarHBondContact O-CG 3.47Å; V364-L368 PolarHBondContact O-N 3.49Å
365	F	92.5	Very high	91	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.9	-48.5	179.5	-171.6	-175.9	0	0	0	111.8	V276 M280 V361 C363 E367 L368 L369 V437 I438 F441 W460	V276-F365 HydrophobicContact CG1-CD2 3.87Å; V276-F365 HydrophobicContact CG1-CE2 3.72Å; M280-F365 HydrophobicContact CE-CB 3.61Å; M280-F365 HydrophobicContact CE-CD1 3.87Å; M280-F365 HydrophobicContact CE-CD2 4.34Å; M280-F365 HydrophobicContact CE-CG 3.7Å; M280-F365 HydrophobicContact CG-CB 4.49Å; M280-F365 HydrophobicContact CG-CD1 4.47Å; M280-F365 HydrophobicContact CG-CD2 3.59Å; M280-F365 HydrophobicContact CG-CE2 3.9Å; M280-F365 HydrophobicContact CG-CG 3.95Å; M280-F365 HydrophobicContact CG-CZ 4.47Å; M280-F365 HydrophobicContact SD-CB 3.57Å; M280-F365 VanDerWaalsContact SD-CB 3.57Å; M280-F365 HydrophobicContact SD-CD1 4.39Å; M280-F365 HydrophobicContact SD-CD2 3.8Å; M280-F365 HydrophobicContact SD-CG 3.67Å; V361-F365 WeakPolarHBondContact O-CB 3.35Å; V361-F365 PolarHBondContact O-N 3.43Å; C363-F365 VanDerWaalsContact C-N 3.32Å; C363-F365 PolarHBondContact O-N 2.88Å; F365-E367 VanDerWaalsContact C-N 3.28Å; F365-E367 PolarHBondContact O-N 3.49Å; F365-L368 PolarHBondContact O-N 2.79Å; F365-L369 HydrophobicContact CD2-CD1 3.94Å; F365-L369 HydrophobicContact CD2-CG 4.36Å; F365-L369 HydrophobicContact CE2-CD1 3.62Å; F365-L369 HydrophobicContact CE2-CG 4.23Å; F365-L369 HydrophobicContact CZ-CD1 4.42Å; F365-L369 PolarHBondContact O-N 2.78Å; F365-V437 HydrophobicContact CE1-CB 4.09Å; F365-V437 HydrophobicContact CE1-CG1 4.03Å; F365-I438 HydrophobicContact CD1-CD1 4.37Å; F365-I438 HydrophobicContact CD1-CG1 3.52Å; F365-I438 HydrophobicContact CE1-CD1 4.44Å; F365-I438 HydrophobicContact CE1-CG1 3.67Å; F365-I438 HydrophobicContact CG-CD1 4.43Å; F365-I438 HydrophobicContact CG-CG1 3.97Å; F365-I438 HydrophobicContact CZ-CG1 4.22Å; F365-F441 HydrophobicContact CD1-CD2 4.24Å; F365-F441 HydrophobicContact CD1-CE2 4.05Å; F365-F441 HydrophobicContact CE1-CE2 4.42Å; F365-W460 HydrophobicContact CE1-CH2 4.48Å; F365-W460 HydrophobicContact CE1-CZ3 4.25Å; F365-W460 AromaticContact CE2-CH2 3.42Å; F365-W460 HydrophobicContact CE2-CH2 3.42Å; F365-W460 VanDerWaalsContact CE2-CH2 3.42Å; F365-W460 AromaticContact CE2-CZ2 3.95Å; F365-W460 HydrophobicContact CE2-CZ2 3.95Å; F365-W460 AromaticContact CE2-CZ3 3.89Å; F365-W460 HydrophobicContact CE2-CZ3 3.89Å; F365-W460 HydrophobicContact CZ-CD2 4.27Å; F365-W460 AromaticContact CZ-CE3 3.91Å; F365-W460 HydrophobicContact CZ-CE3 3.91Å; F365-W460 AromaticContact CZ-CH2 3.28Å; F365-W460 HydrophobicContact CZ-CH2 3.28Å; F365-W460 AromaticContact CZ-CZ2 3.67Å; F365-W460 HydrophobicContact CZ-CZ2 3.67Å; F365-W460 AromaticContact CZ-CZ3 3.38Å; F365-W460 HydrophobicContact CZ-CZ3 3.38Å
366	A	88.3	Confident	90.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.6	-35.4	176.9	0	0	0	0	0	112.2	G362 C363 V364 L369 T370 L374 I438	G362-A366 PolarHBondContact O-N 2.94Å; G362-A366 VanDerWaalsContact O-N 3.15Å; C363-A366 PolarHBondContact O-N 2.85Å; V364-A366 PolarHBondContact O-N 2.93Å; A366-L369 PolarHBondContact O-N 3.48Å; A366-T370 WeakPolarHBondContact O-CB 3.42Å; A366-T370 WeakPolarHBondContact O-CG2 3.49Å; A366-T370 PolarHBondContact O-N 3.43Å; A366-T370 PolarHBondContact O-OG1 2.7Å; A366-L374 HydrophobicContact CB-CB 4.24Å; A366-L374 HydrophobicContact CB-CD1 3.97Å; A366-L374 HydrophobicContact CB-CD2 3.83Å; A366-L374 HydrophobicContact CB-CG 4.24Å; A366-I438 HydrophobicContact CB-CD1 4.49Å; A366-I438 HydrophobicContact CB-CG2 4.48Å
367	E	90.8	Very high	90	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-66.9	-40.6	176.6	-168.3	178.6	179.5	0	0	111.9	M264 T302 Y340 C363 V364 F365 L369 T370 L371	M264-E367 HydrophobicContact CE-CB 4.43Å; M264-E367 HydrophobicContact CE-CG 3.7Å; M264-E367 VanDerWaalsContact CE-O 3.32Å; M264-E367 WeakPolarHBondContact CE-O 3.16Å; T302-E367 HydrophobicContact CG2-CG 4.36Å; T302-E367 VanDerWaalsContact CG2-OE2 3.25Å; T302-E367 WeakPolarHBondContact CG2-OE2 3.16Å; Y340-E367 WeakPolarHBondContact CE1-OE2 3.49Å; Y340-E367 VanDerWaalsContact CZ-OE2 3.29Å; Y340-E367 PolarHBondContact OH-OE1 3.05Å; Y340-E367 PolarHBondContact OH-OE2 2.96Å; C363-E367 WeakPolarHBondContact O-CB 3.33Å; C363-E367 PolarHBondContact O-N 3.16Å; V364-E367 WeakPolarHBondContact O-CB 3.22Å; V364-E367 PolarHBondContact O-N 2.81Å; F365-E367 VanDerWaalsContact C-N 3.28Å; F365-E367 PolarHBondContact O-N 3.49Å; E367-L369 VanDerWaalsContact C-N 3.27Å; E367-L369 PolarHBondContact O-N 2.94Å; E367-T370 PolarHBondContact O-N 3.09Å; E367-L371 VanDerWaalsContact O-CA 3.23Å; E367-L371 WeakPolarHBondContact O-CA 3.41Å; E367-L371 PolarHBondContact O-N 3.1Å
368	L	91.1	Very high	89.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.9	-37	176.4	-74.4	170.3	0	0	0	112.7	L260 M264 F271 V276 L279 M280 V364 F365	L260-L368 HydrophobicContact CD1-CD2 4.22Å; L260-L368 HydrophobicContact CD2-CD2 3.85Å; L260-L368 HydrophobicContact CG-CD2 4.16Å; M264-L368 HydrophobicContact CE-CD2 4.2Å; M264-L368 HydrophobicContact SD-CD2 3.68Å; F271-L368 HydrophobicContact CD2-CD2 3.88Å; F271-L368 HydrophobicContact CE2-CD2 3.79Å; V276-L368 HydrophobicContact CG1-CB 4.08Å; V276-L368 HydrophobicContact CG1-CD1 4.49Å; V276-L368 HydrophobicContact CG2-CB 4.23Å; L279-L368 HydrophobicContact CB-CD1 4.43Å; L279-L368 HydrophobicContact CD1-CD2 4.25Å; M280-L368 HydrophobicContact SD-CD1 4.01Å; V364-L368 HydrophobicContact CG1-CD1 4.06Å; V364-L368 HydrophobicContact CG1-CG 4.34Å; V364-L368 WeakPolarHBondContact O-CG 3.47Å; V364-L368 PolarHBondContact O-N 3.49Å; F365-L368 PolarHBondContact O-N 2.79Å
369	L	86.5	Confident	88.9	Confident	7 Å²	7	29 Å²	29	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-77.9	-25	179	-68.6	168.2	0	0	0	113.5	V276 F365 A366 E367 L431 I438	V276-L369 HydrophobicContact CB-CD2 4.15Å; V276-L369 HydrophobicContact CG1-CD2 3.96Å; V276-L369 HydrophobicContact CG1-CG 4.11Å; V276-L369 HydrophobicContact CG2-CD2 3.98Å; F365-L369 HydrophobicContact CD2-CD1 3.94Å; F365-L369 HydrophobicContact CD2-CG 4.36Å; F365-L369 HydrophobicContact CE2-CD1 3.62Å; F365-L369 HydrophobicContact CE2-CG 4.23Å; F365-L369 HydrophobicContact CZ-CD1 4.42Å; F365-L369 PolarHBondContact O-N 2.78Å; A366-L369 PolarHBondContact O-N 3.48Å; E367-L369 VanDerWaalsContact C-N 3.27Å; E367-L369 PolarHBondContact O-N 2.94Å; L369-L431 HydrophobicContact CB-CD2 3.44Å; L369-L431 VanDerWaalsContact CB-CD2 3.44Å; L369-L431 HydrophobicContact CD1-CD2 3.28Å; L369-L431 HydrophobicContact CG-CD2 3.98Å; L369-I438 HydrophobicContact CD1-CD1 3.85Å
370	T	83	Confident	88.2	Confident	43 Å²	43	33.2 Å²	33.2	26%	0.264	16%	0.163	S	C	.	.	H	α-helix	trans	-115.3	-9.8	-171.5	62.1	0	0	0	0	114.3	A366 E367 K372 L431	A366-T370 WeakPolarHBondContact O-CB 3.42Å; A366-T370 WeakPolarHBondContact O-CG2 3.49Å; A366-T370 PolarHBondContact O-N 3.43Å; A366-T370 PolarHBondContact O-OG1 2.7Å; E367-T370 PolarHBondContact O-N 3.09Å; T370-K372 PolarHBondContact O-N 2.57Å; T370-K372 VanDerWaalsContact O-N 3.11Å; T370-K372 PolarHBondContact OG1-N 3.11Å; T370-K372 PolarHBondContact OG1-O 2.8Å; T370-K372 VanDerWaalsContact OG1-O 3.07Å; T370-L431 HydrophobicContact CG2-CD1 4.4Å; T370-L431 HydrophobicContact CG2-CD2 4.08Å; T370-L431 HydrophobicContact CG2-CG 4.25Å
371	L	86.9	Confident	87.3	Confident	43 Å²	43	37.3 Å²	37.3	23%	0.225	19%	0.188	C	C	.	.	S	Bend	trans	52.4	18.5	-167.6	-58.4	-178.5	0	0	0	114.1	M264 M267 P270 E367	M264-L371 HydrophobicContact CB-CD2 4.09Å; M264-L371 HydrophobicContact CE-CD2 3.85Å; M264-L371 HydrophobicContact CG-CD2 4.05Å; M267-L371 HydrophobicContact CE-CD2 4Å; P270-L371 HydrophobicContact CB-CD1 4.06Å; P270-L371 HydrophobicContact CB-CD2 4.41Å; P270-L371 HydrophobicContact CB-CG 3.94Å; E367-L371 VanDerWaalsContact O-CA 3.23Å; E367-L371 WeakPolarHBondContact O-CA 3.41Å; E367-L371 PolarHBondContact O-N 3.1Å
372	K	85.6	Confident	86.4	Confident	146 Å²	146	41.6 Å²	41.6	64%	0.635	21%	0.207	S	C	*	.	S	Bend	trans	-134	135.4	-176.8	-68.5	-177	-178.3	-178.5	0	110	T370 L374	T370-K372 PolarHBondContact O-N 2.57Å; T370-K372 VanDerWaalsContact O-N 3.11Å; T370-K372 PolarHBondContact OG1-N 3.11Å; T370-K372 PolarHBondContact OG1-O 2.8Å; T370-K372 VanDerWaalsContact OG1-O 3.07Å; K372-L374 PolarHBondContact O-N 3.37Å
373	P	86.7	Confident	85.7	Confident	26 Å²	26	41.7 Å²	41.7	17%	0.169	21%	0.208	C	C	.	.			trans	-58	135.8	178	24.2	-34.5	0	0	0	110	W339 P376 R388	W339-P373 HydrophobicContact CD2-CB 4.38Å; W339-P373 HydrophobicContact CE3-CB 3.68Å; W339-P373 HydrophobicContact CE3-CG 3.95Å; W339-P373 HydrophobicContact CH2-CG 4.43Å; W339-P373 HydrophobicContact CZ3-CB 4.04Å; W339-P373 HydrophobicContact CZ3-CG 3.8Å; P373-P376 HydrophobicContact CB-CB 4.47Å; P373-P376 HydrophobicContact CG-CB 4.02Å; P373-R388 PolarHBondContact O-NH1 3.2Å
374	L	83	Confident	84.4	Confident	6 Å²	6	43 Å²	43	3%	0.031	22%	0.217	C	C	.	.	S	Bend	trans	-67.3	-45.8	-176.8	-169.9	65.7	0	0	0	110.3	A366 K372 P376 R388 L392 L442	A366-L374 HydrophobicContact CB-CB 4.24Å; A366-L374 HydrophobicContact CB-CD1 3.97Å; A366-L374 HydrophobicContact CB-CD2 3.83Å; A366-L374 HydrophobicContact CB-CG 4.24Å; K372-L374 PolarHBondContact O-N 3.37Å; L374-P376 WeakPolarHBondContact O-CD 3.39Å; L374-R388 VanDerWaalsContact CD1-CD 3.48Å; L374-R388 HydrophobicContact CD1-CG 4.33Å; L374-R388 WeakPolarHBondContact O-CD 3.49Å; L374-R388 PolarHBondContact O-NH1 3.27Å; L374-L392 HydrophobicContact CD1-CD1 4.49Å; L374-L392 HydrophobicContact CD2-CD1 4.25Å; L374-L442 HydrophobicContact CD2-CD1 3.39Å
375	F	85.5	Confident	82.4	Confident	2 Å²	2	47 Å²	47	1%	0.009	23%	0.232	C	C	.	.			trans	-124.5	82.3	-176.7	-53	-61.3	0	0	0	111.2	W339 W359 G377 Q383 A386 R388 M389 L392 L442	W339-F375 VanDerWaalsContact CA-O 3.28Å; W339-F375 WeakPolarHBondContact CA-O 3.26Å; W339-F375 WeakPolarHBondContact CB-O 3.36Å; W339-F375 VanDerWaalsContact CD1-O 3.3Å; W359-F375 HydrophobicContact CZ2-CD2 4.38Å; W359-F375 AromaticContact CZ2-CE2 3.73Å; W359-F375 HydrophobicContact CZ2-CE2 3.73Å; W359-F375 HydrophobicContact CZ2-CZ 4.32Å; F375-G377 PolarHBondContact O-N 3.44Å; F375-G377 VanDerWaalsContact O-N 3.09Å; F375-Q383 PolarHBondContact O-NE2 3.25Å; F375-Q383 VanDerWaalsContact O-NE2 3.14Å; F375-Q383 PolarHBondContact O-OE1 3.01Å; F375-A386 HydrophobicContact CD1-CB 4.42Å; F375-R388 HydrophobicContact CD1-CB 4.12Å; F375-R388 HydrophobicContact CE1-CB 4.08Å; F375-R388 HydrophobicContact CE1-CG 4.17Å; F375-M389 HydrophobicContact CD1-CB 4.31Å; F375-M389 HydrophobicContact CD1-CG 4.47Å; F375-M389 HydrophobicContact CE1-CB 3.98Å; F375-M389 HydrophobicContact CE1-CG 4.04Å; F375-M389 HydrophobicContact CZ-CG 4.21Å; F375-L392 HydrophobicContact CE1-CD1 4.17Å; F375-L392 HydrophobicContact CZ-CD1 4.04Å; F375-L442 HydrophobicContact CE2-CD1 4.37Å; F375-L442 HydrophobicContact CE2-CD2 4.27Å; F375-L442 HydrophobicContact CZ-CD1 4.27Å
376	P	85.8	Confident	80.7	Confident	65 Å²	65	47.3 Å²	47.3	42%	0.422	24%	0.235	S	C	.	.			trans	-86.3	54.2	-178.5	35.5	-35.9	0	0	0	112.3	W339 P373 L374	W339-P376 HydrophobicContact CD2-CB 4.39Å; W339-P376 HydrophobicContact CZ2-CB 4.16Å; P373-P376 HydrophobicContact CB-CB 4.47Å; P373-P376 HydrophobicContact CG-CB 4.02Å; L374-P376 WeakPolarHBondContact O-CD 3.39Å
377	G	83.1	Confident	78.7	Confident	5 Å²	5	51.4 Å²	51.4	5%	0.052	26%	0.261	C	S	.	.			trans	-69.4	148.1	175.9	0	0	0	0	0	111.8	L338 W339 F375	L338-G377 WeakPolarHBondContact CD2-O 3.22Å; W339-G377 VanDerWaalsContact CD1-O 3.31Å; W339-G377 PolarHBondContact NE1-O 2.61Å; F375-G377 PolarHBondContact O-N 3.44Å; F375-G377 VanDerWaalsContact O-N 3.09Å
378	R	84.5	Confident	76.9	Confident	199 Å²	199	55.4 Å²	55.4	75%	0.751	28%	0.276	S	S	*	.	S	Bend	trans	-95.5	-22.4	176.8	-56.3	178.1	177.4	-174.2	-0.1	112.9	E382	R378-E382 VanDerWaalsContact CB-OE2 3.24Å; R378-E382 WeakPolarHBondContact CB-OE2 3.34Å; R378-E382 PolarHBondContact N-OE2 2.83Å
379	T	84.3	Confident	74.9	Confident	61 Å²	61	55.7 Å²	55.7	37%	0.374	28%	0.278	S	S	.	.	S	Bend	trans	-129.9	156.8	178.6	62.3	0	0	0	0	109.5	V381 E382 Q383	T379-V381 PolarHBondContact O-N 3.42Å; T379-E382 PolarHBondContact O-N 3.48Å; T379-E382 VanDerWaalsContact O-N 3.08Å; T379-E382 WeakPolarHBondContact OG1-CB 3.37Å; T379-E382 VanDerWaalsContact OG1-CG 3.29Å; T379-E382 WeakPolarHBondContact OG1-CG 3.18Å; T379-E382 PolarHBondContact OG1-N 2.81Å; T379-Q383 WeakPolarHBondContact O-CB 3.38Å; T379-Q383 PolarHBondContact O-N 3.28Å
380	E	81.7	Confident	73	Confident	89 Å²	89	61 Å²	61	42%	0.416	30%	0.297	S	S	.	.	H	α-helix	trans	-56.1	-36.4	174.6	-64.9	-177.2	166.1	0	0	111.7	L338 R341 L346 Q383 C384	L338-E380 HydrophobicContact CD1-CG 4.01Å; R341-E380 IonicContact CZ-OE1 3.91Å; R341-E380 IonicContact NH1-OE1 3.49Å; R341-E380 PolarHBondContact NH1-OE1 3.4Å; L346-E380 HydrophobicContact CD2-CB 4.02Å; L346-E380 HydrophobicContact CD2-CG 4.1Å; E380-Q383 PolarHBondContact O-N 3.27Å; E380-C384 WeakPolarHBondContact O-CB 3.47Å; E380-C384 PolarHBondContact O-N 3.44Å
381	V	76.6	Confident	71.4	Confident	87 Å²	87	64.5 Å²	64.5	53%	0.527	31%	0.306	S	S	.	.	H	α-helix	trans	-56.2	-62.1	170.5	167	0	0	0	0	110	T379 Q383 C384 W385	T379-V381 PolarHBondContact O-N 3.42Å; V381-Q383 PolarHBondContact O-N 2.71Å; V381-C384 WeakPolarHBondContact O-CB 3Å; V381-C384 PolarHBondContact O-N 3.18Å; V381-W385 VanDerWaalsContact CA-CE3 3.46Å; V381-W385 HydrophobicContact CB-CE3 3.82Å; V381-W385 HydrophobicContact CB-CZ3 3.51Å; V381-W385 HydrophobicContact CG1-CE3 3.32Å; V381-W385 HydrophobicContact CG1-CZ3 3.29Å; V381-W385 HydrophobicContact CG2-CZ3 3.81Å; V381-W385 PolarHBondContact O-N 3.19Å
382	E	77.9	Confident	69.7	Low	90 Å²	90	64.3 Å²	64.3	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-58.6	-32.2	179.3	-76.9	176.1	-165.3	0	0	113.4	R378 T379 W385 A386	R378-E382 VanDerWaalsContact CB-OE2 3.24Å; R378-E382 WeakPolarHBondContact CB-OE2 3.34Å; R378-E382 PolarHBondContact N-OE2 2.83Å; T379-E382 PolarHBondContact O-N 3.48Å; T379-E382 VanDerWaalsContact O-N 3.08Å; T379-E382 WeakPolarHBondContact OG1-CB 3.37Å; T379-E382 VanDerWaalsContact OG1-CG 3.29Å; T379-E382 WeakPolarHBondContact OG1-CG 3.18Å; T379-E382 PolarHBondContact OG1-N 2.81Å; E382-W385 CarbonylContact O-C 3.47Å; E382-W385 PolarHBondContact O-N 2.87Å; E382-A386 WeakPolarHBondContact O-CA 3.47Å; E382-A386 WeakPolarHBondContact O-CB 3.38Å; E382-A386 PolarHBondContact O-N 3.45Å
383	Q	78.3	Confident	67.9	Low	3 Å²	3	58.1 Å²	58.1	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-51	177.9	-169.6	69.3	8.4	0	0	111.1	L338 W339 L346 F375 T379 E380 V381 W385 A386	L338-Q383 HydrophobicContact CD1-CB 3.7Å; L338-Q383 HydrophobicContact CD1-CG 3.79Å; L338-Q383 HydrophobicContact CG-CB 4.09Å; L338-Q383 HydrophobicContact CG-CG 4.11Å; L338-Q383 WeakPolarHBondContact O-CG 3.46Å; L338-Q383 PolarHBondContact O-NE2 3.37Å; W339-Q383 PolarHBondContact O-NE2 3.3Å; L346-Q383 HydrophobicContact CD1-CB 4.17Å; L346-Q383 HydrophobicContact CD1-CG 3.7Å; L346-Q383 HydrophobicContact CD2-CB 4.31Å; L346-Q383 HydrophobicContact CD2-CG 4.25Å; F375-Q383 PolarHBondContact O-NE2 3.25Å; F375-Q383 VanDerWaalsContact O-NE2 3.14Å; F375-Q383 PolarHBondContact O-OE1 3.01Å; T379-Q383 WeakPolarHBondContact O-CB 3.38Å; T379-Q383 PolarHBondContact O-N 3.28Å; E380-Q383 PolarHBondContact O-N 3.27Å; V381-Q383 PolarHBondContact O-N 2.71Å; Q383-W385 PolarHBondContact O-N 3.38Å; Q383-A386 WeakPolarHBondContact O-CB 3.45Å; Q383-A386 PolarHBondContact O-N 2.64Å
384	C	66.1	Low	65.8	Low	30 Å²	30	61.9 Å²	61.9	20%	0.203	30%	0.298	C	S	.	.	H	α-helix	trans	-55	-36.7	173	-85.9	0	0	0	0	112.4	L346 E380 V381	L346-C384 WeakPolarHBondContact CB-SG 3.13Å; E380-C384 WeakPolarHBondContact O-CB 3.47Å; E380-C384 PolarHBondContact O-N 3.44Å; V381-C384 WeakPolarHBondContact O-CB 3Å; V381-C384 PolarHBondContact O-N 3.18Å
385	W	53.2	Low	64.1	Low	83 Å²	83	67.9 Å²	67.9	31%	0.314	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	10.4	-175	-69.3	-56.7	0	0	0	114	V381 E382 Q383 P387 R390 Y414	V381-W385 VanDerWaalsContact CA-CE3 3.46Å; V381-W385 HydrophobicContact CB-CE3 3.82Å; V381-W385 HydrophobicContact CB-CZ3 3.51Å; V381-W385 HydrophobicContact CG1-CE3 3.32Å; V381-W385 HydrophobicContact CG1-CZ3 3.29Å; V381-W385 HydrophobicContact CG2-CZ3 3.81Å; V381-W385 PolarHBondContact O-N 3.19Å; E382-W385 CarbonylContact O-C 3.47Å; E382-W385 PolarHBondContact O-N 2.87Å; Q383-W385 PolarHBondContact O-N 3.38Å; W385-P387 VanDerWaalsContact O-N 3.15Å; W385-R390 VanDerWaalsContact CD1-NH2 3.34Å; W385-R390 PolarHBondContact O-NE 3.4Å; W385-Y414 HydrophobicContact CZ2-CD2 4.25Å; W385-Y414 HydrophobicContact CZ2-CE2 4.41Å; W385-Y414 AromaticContact NE1-CD2 3.89Å
386	A	55.5	Low	62.3	Low	7 Å²	7	68.3 Å²	68.3	6%	0.058	33%	0.333	C	S	.	.			trans	-52.8	127.8	-175.1	0	0	0	0	0	107.2	F375 E382 Q383 R388 M389 R390	F375-A386 HydrophobicContact CD1-CB 4.42Å; E382-A386 WeakPolarHBondContact O-CA 3.47Å; E382-A386 WeakPolarHBondContact O-CB 3.38Å; E382-A386 PolarHBondContact O-N 3.45Å; Q383-A386 WeakPolarHBondContact O-CB 3.45Å; Q383-A386 PolarHBondContact O-N 2.64Å; A386-R388 PolarHBondContact O-N 3.19Å; A386-M389 HydrophobicContact CB-CB 4.38Å; A386-M389 WeakPolarHBondContact O-CB 3.24Å; A386-M389 PolarHBondContact O-N 3.07Å; A386-R390 PolarHBondContact O-N 3.42Å
387	P	45.6	Very low	60.2	Low	86 Å²	86	68.4 Å²	68.4	56%	0.558	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.1	-175	-28.8	33.6	0	0	0	112.9	W385 R391	W385-P387 VanDerWaalsContact O-N 3.15Å; P387-R391 VanDerWaalsContact O-CD 3.23Å; P387-R391 WeakPolarHBondContact O-CD 3.36Å; P387-R391 WeakPolarHBondContact O-CG 3.35Å; P387-R391 PolarHBondContact O-NE 3.46Å; P387-R391 VanDerWaalsContact O-NE 3.09Å
388	R	53.7	Low	58.1	Low	85 Å²	85	72.4 Å²	72.4	32%	0.321	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-35.5	176.8	-160.4	170.7	-73.1	152.6	-20.5	113.7	P373 L374 F375 A386 R390 R391 L392 F428	P373-R388 PolarHBondContact O-NH1 3.2Å; L374-R388 VanDerWaalsContact CD1-CD 3.48Å; L374-R388 HydrophobicContact CD1-CG 4.33Å; L374-R388 WeakPolarHBondContact O-CD 3.49Å; L374-R388 PolarHBondContact O-NH1 3.27Å; F375-R388 HydrophobicContact CD1-CB 4.12Å; F375-R388 HydrophobicContact CE1-CB 4.08Å; F375-R388 HydrophobicContact CE1-CG 4.17Å; A386-R388 PolarHBondContact O-N 3.19Å; R388-R390 VanDerWaalsContact C-N 3.28Å; R388-R390 PolarHBondContact O-N 2.82Å; R388-R391 PolarHBondContact O-N 2.63Å; R388-R391 VanDerWaalsContact O-N 3.11Å; R388-L392 HydrophobicContact CG-CD1 4.22Å; R388-F428 HydrophobicContact CG-CZ 3.97Å
389	M	49.2	Very low	56	Low	7 Å²	7	64.7 Å²	64.7	3%	0.034	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-64.2	-37.2	176.9	-140.6	-164.5	-175.2	0	0	110.9	P343 W359 F375 A386 R391 Y444	P343-M389 HydrophobicContact CB-CE 3.73Å; P343-M389 HydrophobicContact CG-CE 4.02Å; W359-M389 HydrophobicContact CH2-CE 3.5Å; W359-M389 HydrophobicContact CH2-CG 4.47Å; W359-M389 HydrophobicContact CZ2-CE 3.43Å; W359-M389 VanDerWaalsContact CZ2-CE 3.43Å; F375-M389 HydrophobicContact CD1-CB 4.31Å; F375-M389 HydrophobicContact CD1-CG 4.47Å; F375-M389 HydrophobicContact CE1-CB 3.98Å; F375-M389 HydrophobicContact CE1-CG 4.04Å; F375-M389 HydrophobicContact CZ-CG 4.21Å; A386-M389 HydrophobicContact CB-CB 4.38Å; A386-M389 WeakPolarHBondContact O-CB 3.24Å; A386-M389 PolarHBondContact O-N 3.07Å; M389-R391 PolarHBondContact O-N 2.74Å; M389-Y444 VanDerWaalsContact C-OH 3.3Å; M389-Y444 HydrophobicContact CE-CD1 4.46Å; M389-Y444 HydrophobicContact CE-CE1 3.72Å; M389-Y444 HydrophobicContact CG-CE1 4.34Å; M389-Y444 VanDerWaalsContact CG-OH 3.23Å; M389-Y444 WeakPolarHBondContact CG-OH 3.4Å; M389-Y444 PolarHBondContact O-OH 3.22Å; M389-Y444 HydrophobicContact SD-CE1 4.03Å
390	R	46.8	Very low	54.2	Low	118 Å²	118	62.8 Å²	62.8	45%	0.445	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-65.9	-13.8	175.5	-61.1	-175.2	-171.6	-179.7	-0.9	114.1	W385 A386 R388	W385-R390 VanDerWaalsContact CD1-NH2 3.34Å; W385-R390 PolarHBondContact O-NE 3.4Å; A386-R390 PolarHBondContact O-N 3.42Å; R388-R390 VanDerWaalsContact C-N 3.28Å; R388-R390 PolarHBondContact O-N 2.82Å
391	R	50.3	Low	52.2	Low	116 Å²	116	60.6 Å²	60.6	44%	0.438	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-106.8	-2.3	-169.3	-68.9	173.4	-165.1	-167.9	3.5	114.5	P387 R388 M389	P387-R391 VanDerWaalsContact O-CD 3.23Å; P387-R391 WeakPolarHBondContact O-CD 3.36Å; P387-R391 WeakPolarHBondContact O-CG 3.35Å; P387-R391 PolarHBondContact O-NE 3.46Å; P387-R391 VanDerWaalsContact O-NE 3.09Å; R388-R391 PolarHBondContact O-N 2.63Å; R388-R391 VanDerWaalsContact O-N 3.11Å; M389-R391 PolarHBondContact O-N 2.74Å
392	L	49.2	Very low	50.5	Low	39 Å²	39	61.1 Å²	61.1	20%	0.204	32%	0.319	C	S	.	.	S	Bend	trans	-107.2	0.5	-162.8	-110.8	143.5	0	0	0	116	L374 F375 R388 L442	L374-L392 HydrophobicContact CD1-CD1 4.49Å; L374-L392 HydrophobicContact CD2-CD1 4.25Å; F375-L392 HydrophobicContact CE1-CD1 4.17Å; F375-L392 HydrophobicContact CZ-CD1 4.04Å; R388-L392 HydrophobicContact CG-CD1 4.22Å; L392-L442 HydrophobicContact CD1-CD1 4.36Å; L392-L442 HydrophobicContact CD2-CD1 4.01Å
393	G	48	Very low	48.9	Very low	17 Å²	17	57.2 Å²	57.2	18%	0.175	30%	0.301	C	S	.	.			trans	-140.2	132.9	-175.5	0	0	0	0	0	114	T396 V418 F419	G393-T396 WeakPolarHBondContact CA-OG1 3.31Å; G393-T396 PolarHBondContact O-OG1 2.95Å; G393-V418 VanDerWaalsContact O-CG1 3.32Å; G393-V418 WeakPolarHBondContact O-CG1 3.28Å; G393-F419 PolarHBondContact O-N 3.26Å
394	Q	44	Very low	47.3	Very low	105 Å²	105	59.5 Å²	59.5	49%	0.491	31%	0.313	S	S	.	.	S	Bend	trans	-90.5	-5.8	176.4	-141.2	167.8	-16.8	0	0	112.6	V418 S420	Q394-V418 HydrophobicContact CB-CG1 4.34Å; Q394-V418 HydrophobicContact CG-CG1 4.16Å; Q394-V418 WeakPolarHBondContact O-CG1 3.46Å; Q394-S420 VanDerWaalsContact CD-CA 3.46Å; Q394-S420 PolarHBondContact NE2-OG 3.4Å
395	D	46.2	Very low	46.3	Very low	132 Å²	132	63.8 Å²	63.8	71%	0.706	33%	0.334	S	S	*	.	S	Bend	trans	-126.1	15.5	-168.7	-46.6	-21.4	0	0	0	112.6	C399	D395-C399 PolarHBondContact O-SG 3.48Å
396	T	48.5	Very low	45.6	Very low	10 Å²	10	64.7 Å²	64.7	6%	0.061	35%	0.352	C	S	.	.	H	α-helix	trans	-86.8	-25.7	-158.8	-49.4	0	0	0	0	114.7	G393 L400 I416 Y444	G393-T396 WeakPolarHBondContact CA-OG1 3.31Å; G393-T396 PolarHBondContact O-OG1 2.95Å; T396-L400 HydrophobicContact CG2-CB 4.19Å; T396-L400 WeakPolarHBondContact O-CB 3.48Å; T396-L400 PolarHBondContact O-N 3.35Å; T396-I416 HydrophobicContact CG2-CG2 4.07Å; T396-Y444 HydrophobicContact CG2-CD1 4.31Å; T396-Y444 HydrophobicContact CG2-CD2 3.29Å; T396-Y444 HydrophobicContact CG2-CE1 4.35Å; T396-Y444 HydrophobicContact CG2-CE2 3.37Å; T396-Y444 HydrophobicContact CG2-CG 3.75Å
397	V	40.7	Very low	44.9	Very low	68 Å²	68	65.2 Å²	65.2	41%	0.412	35%	0.354	S	S	.	.	H	α-helix	trans	-68.6	-48	-170	169.4	0	0	0	0	112.3	A401 I416 V418	V397-A401 WeakPolarHBondContact O-CB 3.41Å; V397-A401 PolarHBondContact O-N 3.06Å; V397-I416 HydrophobicContact CG2-CB 4.21Å; V397-I416 WeakPolarHBondContact CG2-O 3.27Å; V397-V418 HydrophobicContact CB-CG2 4.17Å; V397-V418 HydrophobicContact CG2-CG2 3.22Å
398	S	40.3	Very low	44.7	Very low	89 Å²	89	69.4 Å²	69.4	62%	0.622	37%	0.372	S	S	*	.	H	α-helix	trans	-68.5	-40.9	178.3	-54.8	0	0	0	0	111.4	A401 L402	S398-A401 PolarHBondContact O-N 3.05Å; S398-L402 WeakPolarHBondContact O-CB 3.35Å; S398-L402 VanDerWaalsContact O-CG 3.26Å; S398-L402 WeakPolarHBondContact O-CG 3.41Å; S398-L402 PolarHBondContact O-N 2.83Å
399	C	40.5	Very low	44.2	Very low	36 Å²	36	68.3 Å²	68.3	24%	0.243	37%	0.374	C	S	.	.	H	α-helix	trans	-68.5	-42.9	-178.6	-69.4	0	0	0	0	112.9	D395 L402 L403	D395-C399 PolarHBondContact O-SG 3.48Å; C399-L402 WeakPolarHBondContact O-CB 3.33Å; C399-L402 PolarHBondContact O-N 3.16Å; C399-L403 WeakPolarHBondContact O-CB 3.42Å; C399-L403 PolarHBondContact O-N 2.89Å
400	L	46.6	Very low	43.9	Very low	22 Å²	22	74 Å²	74	12%	0.115	42%	0.415	C	S	.	.	H	α-helix	trans	-73	-35.3	176.6	-157.8	86	0	0	0	111.2	T396 L402 L403 I404 I416 Y444	T396-L400 HydrophobicContact CG2-CB 4.19Å; T396-L400 WeakPolarHBondContact O-CB 3.48Å; T396-L400 PolarHBondContact O-N 3.35Å; L400-L402 VanDerWaalsContact C-N 3.31Å; L400-L402 PolarHBondContact O-N 3.49Å; L400-L403 PolarHBondContact O-N 3.03Å; L400-I404 HydrophobicContact CD2-CD1 3.93Å; L400-I404 HydrophobicContact CG-CD1 4.04Å; L400-I404 HydrophobicContact CG-CG1 4.37Å; L400-I404 WeakPolarHBondContact O-CB 3.41Å; L400-I404 VanDerWaalsContact O-CG1 3.23Å; L400-I404 WeakPolarHBondContact O-CG1 3.46Å; L400-I404 PolarHBondContact O-N 3.43Å; L400-I416 HydrophobicContact CB-CD1 4.1Å; L400-I416 HydrophobicContact CD2-CD1 3.23Å; L400-I416 HydrophobicContact CD2-CG1 3.55Å; L400-I416 HydrophobicContact CG-CD1 4.19Å; L400-Y444 HydrophobicContact CD1-CD1 3.17Å; L400-Y444 HydrophobicContact CD1-CE1 3.59Å; L400-Y444 HydrophobicContact CD1-CG 3.92Å
401	A	39.5	Very low	43.8	Very low	42 Å²	42	70 Å²	70	35%	0.347	41%	0.407	S	S	.	.	H	α-helix	trans	-61.4	-41.3	171.7	0	0	0	0	0	111.4	V397 S398 L403 N405	V397-A401 WeakPolarHBondContact O-CB 3.41Å; V397-A401 PolarHBondContact O-N 3.06Å; S398-A401 PolarHBondContact O-N 3.05Å; A401-L403 VanDerWaalsContact C-N 3.35Å; A401-N405 VanDerWaalsContact O-CB 3.31Å; A401-N405 WeakPolarHBondContact O-CB 3.39Å; A401-N405 PolarHBondContact O-N 2.73Å; A401-N405 PolarHBondContact O-ND2 2.79Å
402	L	41.1	Very low	43.2	Very low	98 Å²	98	67.7 Å²	67.7	51%	0.513	41%	0.407	S	S	.	.	H	α-helix	trans	-61.4	-43.4	171.6	-74.9	167.8	0	0	0	111.5	S398 C399 L400 N405 C406	S398-L402 WeakPolarHBondContact O-CB 3.35Å; S398-L402 VanDerWaalsContact O-CG 3.26Å; S398-L402 WeakPolarHBondContact O-CG 3.41Å; S398-L402 PolarHBondContact O-N 2.83Å; C399-L402 WeakPolarHBondContact O-CB 3.33Å; C399-L402 PolarHBondContact O-N 3.16Å; L400-L402 VanDerWaalsContact C-N 3.31Å; L400-L402 PolarHBondContact O-N 3.49Å; L402-N405 PolarHBondContact O-N 3.3Å; L402-C406 PolarHBondContact O-N 3.3Å; L402-C406 PolarHBondContact O-SG 3.43Å
403	L	42.8	Very low	42.7	Very low	9 Å²	9	77.4 Å²	77.4	5%	0.047	44%	0.441	C	S	.	.	H	α-helix	trans	-65.6	-44.8	-179.9	-133.2	142.5	0	0	0	112.1	E344 L347 C399 L400 A401 N405 C406 V407 Y444 P446	E344-L403 HydrophobicContact CB-CD2 3.94Å; L347-L403 HydrophobicContact CD1-CD2 3.43Å; L347-L403 VanDerWaalsContact CD1-CD2 3.43Å; C399-L403 WeakPolarHBondContact O-CB 3.42Å; C399-L403 PolarHBondContact O-N 2.89Å; L400-L403 PolarHBondContact O-N 3.03Å; A401-L403 VanDerWaalsContact C-N 3.35Å; L403-N405 VanDerWaalsContact C-N 3.3Å; L403-N405 PolarHBondContact O-N 2.95Å; L403-C406 WeakPolarHBondContact O-CB 2.94Å; L403-C406 PolarHBondContact O-N 3.14Å; L403-C406 VanDerWaalsContact O-N 3.16Å; L403-V407 WeakPolarHBondContact O-CG2 3.28Å; L403-V407 PolarHBondContact O-N 3.47Å; L403-Y444 WeakPolarHBondContact CD1-O 3.43Å; L403-P446 HydrophobicContact CD1-CG 4.37Å
404	I	46.5	Very low	42.2	Very low	50 Å²	50	83.2 Å²	83.2	26%	0.256	46%	0.459	S	S	.	.	H	α-helix	trans	-62.1	-38.5	173.5	-67.9	165	0	0	0	110.3	L400 C406 V407	L400-I404 HydrophobicContact CD2-CD1 3.93Å; L400-I404 HydrophobicContact CG-CD1 4.04Å; L400-I404 HydrophobicContact CG-CG1 4.37Å; L400-I404 WeakPolarHBondContact O-CB 3.41Å; L400-I404 VanDerWaalsContact O-CG1 3.23Å; L400-I404 WeakPolarHBondContact O-CG1 3.46Å; L400-I404 PolarHBondContact O-N 3.43Å; I404-C406 VanDerWaalsContact C-N 3.31Å; I404-C406 PolarHBondContact O-N 3.06Å; I404-V407 PolarHBondContact O-N 2.82Å
405	N	43.1	Very low	41.7	Very low	121 Å²	121	83.6 Å²	83.6	65%	0.647	47%	0.47	S	S	*	.	H	α-helix	trans	-69.4	-27.3	176.1	-74.1	-12.6	0	0	0	113	A401 L402 L403 V407	A401-N405 VanDerWaalsContact O-CB 3.31Å; A401-N405 WeakPolarHBondContact O-CB 3.39Å; A401-N405 PolarHBondContact O-N 2.73Å; A401-N405 PolarHBondContact O-ND2 2.79Å; L402-N405 PolarHBondContact O-N 3.3Å; L403-N405 VanDerWaalsContact C-N 3.3Å; L403-N405 PolarHBondContact O-N 2.95Å; N405-V407 VanDerWaalsContact C-N 3.32Å
406	C	39.8	Very low	41.3	Very low	102 Å²	102	79.3 Å²	79.3	69%	0.689	45%	0.447	S	S	*	.	H	α-helix	trans	-74.3	-22.2	176.8	-71.7	0	0	0	0	113.1	L402 L403 I404	L402-C406 PolarHBondContact O-N 3.3Å; L402-C406 PolarHBondContact O-SG 3.43Å; L403-C406 WeakPolarHBondContact O-CB 2.94Å; L403-C406 PolarHBondContact O-N 3.14Å; L403-C406 VanDerWaalsContact O-N 3.16Å; I404-C406 VanDerWaalsContact C-N 3.31Å; I404-C406 PolarHBondContact O-N 3.06Å
407	V	41.1	Very low	40.5	Very low	17 Å²	17	85.2 Å²	85.2	10%	0.103	47%	0.474	C	S	.	.	S	Bend	trans	-105.7	113.8	177.2	-124.5	0	0	0	0	106.9	L347 V349 L403 I404 N405 T409	L347-V407 HydrophobicContact CB-CG2 3.75Å; L347-V407 HydrophobicContact CD1-CG2 4.38Å; L347-V407 VanDerWaalsContact O-CG1 3.22Å; L347-V407 WeakPolarHBondContact O-CG1 3.44Å; V349-V407 HydrophobicContact CG2-CB 4.47Å; V349-V407 HydrophobicContact CG2-CG1 3.85Å; V349-V407 HydrophobicContact CG2-CG2 3.74Å; L403-V407 WeakPolarHBondContact O-CG2 3.28Å; L403-V407 PolarHBondContact O-N 3.47Å; I404-V407 PolarHBondContact O-N 2.82Å; N405-V407 VanDerWaalsContact C-N 3.32Å; V407-T409 HydrophobicContact CB-CG2 4.18Å; V407-T409 HydrophobicContact CG1-CG2 4.18Å; V407-T409 PolarHBondContact O-N 3.36Å
408	N	40.8	Very low	40.1	Very low	174 Å²	174	84.6 Å²	84.6	93%	0.93	47%	0.47	S	S	*	.			trans	-66.1	44.2	176	-79.2	-28.7	0	0	0	112
409	T	42.5	Very low	39.8	Very low	62 Å²	62	85 Å²	85	38%	0.38	46%	0.461	S	S	.	.			trans	-96.7	131.3	176.8	60.5	0	0	0	0	107.6	V407 A411	V407-T409 HydrophobicContact CB-CG2 4.18Å; V407-T409 HydrophobicContact CG1-CG2 4.18Å; V407-T409 PolarHBondContact O-N 3.36Å; T409-A411 PolarHBondContact O-N 2.92Å
410	S	43.7	Very low	39.5	Very low	128 Å²	128	85.4 Å²	85.4	90%	0.895	46%	0.464	S	S	*	.			trans	-69	39.5	168.7	40.5	0	0	0	0	111.6
411	A	43.6	Very low	38.9	Very low	33 Å²	33	88.4 Å²	88.4	27%	0.273	49%	0.486	S	S	.	.			trans	-62.4	130.2	178.7	0	0	0	0	0	108.7	T409 R413	T409-A411 PolarHBondContact O-N 2.92Å; A411-R413 PolarHBondContact O-N 3.46Å
412	P	39.2	Very low	38.9	Very low	67 Å²	67	90.4 Å²	90.4	44%	0.435	50%	0.497	S	S	.	.			trans	-58.1	125	-178.7	22.2	-33.8	0	0	0	110.8	Y414	P412-Y414 HydrophobicContact CB-CD2 3.99Å; P412-Y414 HydrophobicContact CB-CE1 4.35Å; P412-Y414 HydrophobicContact CB-CE2 3.38Å; P412-Y414 HydrophobicContact CG-CD2 3.95Å; P412-Y414 HydrophobicContact CG-CE2 3.24Å; P412-Y414 WeakPolarHBondContact O-CD2 3.31Å; P412-Y414 PolarHBondContact O-N 3.31Å
413	R	38.3	Very low	39	Very low	243 Å²	243	86.9 Å²	86.9	92%	0.917	48%	0.482	S	S	*	.			trans	-64.6	100.4	175.4	-69.6	178.9	-179.1	165.2	0.4	108.9	A411	A411-R413 PolarHBondContact O-N 3.46Å
414	Y	37.8	Very low	39.2	Very low	139 Å²	139	87.1 Å²	87.1	55%	0.545	49%	0.487	S	S	.	.			trans	-111.2	139.5	172.3	-64.2	-61.1	0	0	0	110.9	W385 P412 I416	W385-Y414 HydrophobicContact CZ2-CD2 4.25Å; W385-Y414 HydrophobicContact CZ2-CE2 4.41Å; W385-Y414 AromaticContact NE1-CD2 3.89Å; P412-Y414 HydrophobicContact CB-CD2 3.99Å; P412-Y414 HydrophobicContact CB-CE1 4.35Å; P412-Y414 HydrophobicContact CB-CE2 3.38Å; P412-Y414 HydrophobicContact CG-CD2 3.95Å; P412-Y414 HydrophobicContact CG-CE2 3.24Å; P412-Y414 WeakPolarHBondContact O-CD2 3.31Å; P412-Y414 PolarHBondContact O-N 3.31Å; Y414-I416 PolarHBondContact O-N 2.83Å
415	P	33.7	Very low	39.3	Very low	113 Å²	113	91.1 Å²	91.1	73%	0.734	50%	0.502	S	S	*	.			trans	-65.8	119.4	-179.7	25.7	-32.5	0	0	0	110.8
416	I	36.7	Very low	39.4	Very low	43 Å²	43	93.1 Å²	93.1	22%	0.221	51%	0.505	C	S	.	.			trans	-84.5	114.2	170.7	-56.1	118.1	0	0	0	107.3	T396 V397 L400 Y414	T396-I416 HydrophobicContact CG2-CG2 4.07Å; V397-I416 HydrophobicContact CG2-CB 4.21Å; V397-I416 WeakPolarHBondContact CG2-O 3.27Å; L400-I416 HydrophobicContact CB-CD1 4.1Å; L400-I416 HydrophobicContact CD2-CD1 3.23Å; L400-I416 HydrophobicContact CD2-CG1 3.55Å; L400-I416 HydrophobicContact CG-CD1 4.19Å; Y414-I416 PolarHBondContact O-N 2.83Å
417	Q	31.9	Very low	39.7	Very low	134 Å²	134	94 Å²	94	63%	0.626	50%	0.495	S	S	*	.			trans	-85.5	134.4	171.1	-73.8	-175.2	-17.6	0	0	109.9	F419	Q417-F419 HydrophobicContact CB-CD2 4.36Å; Q417-F419 HydrophobicContact CB-CE2 3.78Å
418	V	33.2	Very low	40.4	Very low	54 Å²	54	94.7 Å²	94.7	33%	0.327	50%	0.497	S	S	.	.			trans	-103.4	125	-173	174.2	0	0	0	0	107.4	G393 Q394 V397	G393-V418 VanDerWaalsContact O-CG1 3.32Å; G393-V418 WeakPolarHBondContact O-CG1 3.28Å; Q394-V418 HydrophobicContact CB-CG1 4.34Å; Q394-V418 HydrophobicContact CG-CG1 4.16Å; Q394-V418 WeakPolarHBondContact O-CG1 3.46Å; V397-V418 HydrophobicContact CB-CG2 4.17Å; V397-V418 HydrophobicContact CG2-CG2 3.22Å
419	F	32.6	Very low	41	Very low	98 Å²	98	90.8 Å²	90.8	43%	0.43	48%	0.481	S	S	.	.			trans	-123.5	142.6	-177.9	-78.4	-81.2	0	0	0	112.4	G393 Q417 A423	G393-F419 PolarHBondContact O-N 3.26Å; Q417-F419 HydrophobicContact CB-CD2 4.36Å; Q417-F419 HydrophobicContact CB-CE2 3.78Å; F419-A423 HydrophobicContact CB-CB 4.33Å
420	S	35	Very low	41.8	Very low	45 Å²	45	91.9 Å²	91.9	32%	0.315	49%	0.488	S	S	.	.			trans	-70.3	154.1	-177.2	178.5	0	0	0	0	113.5	Q394 S422 A423	Q394-S420 VanDerWaalsContact CD-CA 3.46Å; Q394-S420 PolarHBondContact NE2-OG 3.4Å; S420-S422 PolarHBondContact O-N 3.16Å; S420-S422 PolarHBondContact OG-OG 3.47Å; S420-A423 PolarHBondContact O-N 3.47Å
421	C	34.7	Very low	42.6	Very low	85 Å²	85	85.9 Å²	85.9	57%	0.574	45%	0.446	S	S	*	.	H	α-helix	trans	-41.8	-27.8	167.7	-72.9	0	0	0	0	114.1	A423 G424	C421-A423 VanDerWaalsContact C-N 3.28Å; C421-A423 PolarHBondContact O-N 3.09Å; C421-G424 PolarHBondContact O-N 3.24Å; C421-G424 VanDerWaalsContact O-N 3.14Å
422	S	38.9	Very low	43.4	Very low	84 Å²	84	86.9 Å²	86.9	59%	0.587	45%	0.448	S	S	*	.	H	α-helix	trans	-55.1	-36.5	173.2	-44.2	0	0	0	0	113.8	S420	S420-S422 PolarHBondContact O-N 3.16Å; S420-S422 PolarHBondContact OG-OG 3.47Å
423	A	43.4	Very low	44.8	Very low	24 Å²	24	87.8 Å²	87.8	20%	0.198	45%	0.454	C	S	.	.	H	α-helix	trans	-72.9	-33.8	178	0	0	0	0	0	111.7	F419 S420 C421 K425 K426 Y427	F419-A423 HydrophobicContact CB-CB 4.33Å; S420-A423 PolarHBondContact O-N 3.47Å; C421-A423 VanDerWaalsContact C-N 3.28Å; C421-A423 PolarHBondContact O-N 3.09Å; A423-K425 VanDerWaalsContact C-N 3.26Å; A423-K425 PolarHBondContact O-N 3.08Å; A423-K426 PolarHBondContact O-N 3.32Å; A423-K426 VanDerWaalsContact O-N 3.09Å; A423-Y427 WeakPolarHBondContact O-CD2 3.2Å; A423-Y427 PolarHBondContact O-N 3.08Å
424	G	47.8	Very low	46.5	Very low	14 Å²	14	76.2 Å²	76.2	14%	0.144	41%	0.411	C	S	.	.	H	α-helix	trans	-57.2	-39.1	176.4	0	0	0	0	0	112.5	C421 K426 Y427 F428	C421-G424 PolarHBondContact O-N 3.24Å; C421-G424 VanDerWaalsContact O-N 3.14Å; G424-K426 VanDerWaalsContact C-N 3.3Å; G424-K426 PolarHBondContact O-N 3.02Å; G424-Y427 PolarHBondContact O-N 3.14Å; G424-F428 CarbonylContact O-C 3.52Å; G424-F428 WeakPolarHBondContact O-CA 3.38Å; G424-F428 PolarHBondContact O-N 2.86Å
425	K	48.2	Very low	48.2	Very low	133 Å²	133	70.8 Å²	70.8	58%	0.578	39%	0.391	S	S	*	.	H	α-helix	trans	-60.8	-34.7	176.4	-64	-173.9	176.1	-179.7	0	113.5	A423 V432	A423-K425 VanDerWaalsContact C-N 3.26Å; A423-K425 PolarHBondContact O-N 3.08Å; K425-V432 HydrophobicContact CB-CG2 4.13Å; K425-V432 HydrophobicContact CD-CG1 4.46Å; K425-V432 HydrophobicContact CG-CG1 4.11Å; K425-V432 HydrophobicContact CG-CG2 3.75Å
426	K	44.6	Very low	50.2	Low	163 Å²	163	72.1 Å²	72.1	71%	0.709	38%	0.382	S	S	*	.	H	α-helix	trans	-75.1	-35.8	-178.4	-174.1	174.7	-178.7	175.2	0	112.6	A423 G424	A423-K426 PolarHBondContact O-N 3.32Å; A423-K426 VanDerWaalsContact O-N 3.09Å; G424-K426 VanDerWaalsContact C-N 3.3Å; G424-K426 PolarHBondContact O-N 3.02Å
427	Y	46.7	Very low	52.4	Low	120 Å²	120	70.1 Å²	70.1	47%	0.471	37%	0.372	S	S	.	.	H	α-helix	trans	-100.2	-24.1	-173.4	-64.5	-70.9	0	0	0	113.4	A423 G424	A423-Y427 WeakPolarHBondContact O-CD2 3.2Å; A423-Y427 PolarHBondContact O-N 3.08Å; G424-Y427 PolarHBondContact O-N 3.14Å
428	F	55.4	Low	54.9	Low	32 Å²	32	63.8 Å²	63.8	14%	0.14	34%	0.342	C	S	.	.			trans	-137.5	66.1	-177.5	-53	-76.3	0	0	0	110.8	R388 G424 T430 L431	R388-F428 HydrophobicContact CG-CZ 3.97Å; G424-F428 CarbonylContact O-C 3.52Å; G424-F428 WeakPolarHBondContact O-CA 3.38Å; G424-F428 PolarHBondContact O-N 2.86Å; F428-T430 PolarHBondContact O-N 3.11Å; F428-L431 HydrophobicContact CB-CB 3.7Å; F428-L431 HydrophobicContact CB-CD1 3.51Å; F428-L431 HydrophobicContact CB-CG 3.62Å; F428-L431 HydrophobicContact CD1-CD1 3.73Å; F428-L431 HydrophobicContact CD1-CG 4.41Å; F428-L431 HydrophobicContact CD2-CD1 4.3Å; F428-L431 HydrophobicContact CG-CD1 3.59Å; F428-L431 HydrophobicContact CG-CG 4.22Å; F428-L431 PolarHBondContact O-N 3.33Å
429	P	53.8	Low	57.2	Low	92 Å²	92	63 Å²	63	60%	0.597	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-55.6	-36.3	178.8	22.8	-33	0	0	0	111.8	L431 V432	P429-L431 VanDerWaalsContact C-N 3.28Å; P429-L431 PolarHBondContact O-N 2.88Å; P429-V432 VanDerWaalsContact O-CG2 3.32Å; P429-V432 WeakPolarHBondContact O-CG2 3.33Å; P429-V432 PolarHBondContact O-N 2.81Å
430	T	57.8	Low	59.7	Low	85 Å²	85	62.4 Å²	62.4	52%	0.521	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-66.3	-27.1	177	-38.7	0	0	0	0	113.5	F428	F428-T430 PolarHBondContact O-N 3.11Å
431	L	61.6	Low	62.3	Low	3 Å²	3	60.3 Å²	60.3	2%	0.016	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-84.6	-13.2	-177	-63.5	-176.3	0	0	0	112.6	L369 T370 F428 P429 P433 S434 L435 I438	L369-L431 HydrophobicContact CB-CD2 3.44Å; L369-L431 VanDerWaalsContact CB-CD2 3.44Å; L369-L431 HydrophobicContact CD1-CD2 3.28Å; L369-L431 HydrophobicContact CG-CD2 3.98Å; T370-L431 HydrophobicContact CG2-CD1 4.4Å; T370-L431 HydrophobicContact CG2-CD2 4.08Å; T370-L431 HydrophobicContact CG2-CG 4.25Å; F428-L431 HydrophobicContact CB-CB 3.7Å; F428-L431 HydrophobicContact CB-CD1 3.51Å; F428-L431 HydrophobicContact CB-CG 3.62Å; F428-L431 HydrophobicContact CD1-CD1 3.73Å; F428-L431 HydrophobicContact CD1-CG 4.41Å; F428-L431 HydrophobicContact CD2-CD1 4.3Å; F428-L431 HydrophobicContact CG-CD1 3.59Å; F428-L431 HydrophobicContact CG-CG 4.22Å; F428-L431 PolarHBondContact O-N 3.33Å; P429-L431 VanDerWaalsContact C-N 3.28Å; P429-L431 PolarHBondContact O-N 2.88Å; L431-P433 VanDerWaalsContact C-CD 3.46Å; L431-P433 VanDerWaalsContact C-N 3.33Å; L431-P433 VanDerWaalsContact O-N 3.09Å; L431-S434 CarbonylContact O-C 3.38Å; L431-S434 WeakPolarHBondContact O-CA 3.46Å; L431-S434 PolarHBondContact O-N 3.39Å; L431-L435 HydrophobicContact CB-CD2 3.56Å; L431-L435 HydrophobicContact CB-CG 3.71Å; L431-L435 HydrophobicContact CD1-CD2 4.01Å; L431-L435 HydrophobicContact CG-CD2 4.44Å; L431-L435 WeakPolarHBondContact O-CG 3.48Å; L431-L435 PolarHBondContact O-N 2.87Å; L431-I438 HydrophobicContact CD1-CD1 4.48Å; L431-I438 HydrophobicContact CD2-CD1 3.92Å
432	V	60.7	Low	64.8	Low	53 Å²	53	56.7 Å²	56.7	32%	0.321	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-44.1	-164.9	176.6	0	0	0	0	114.4	K425 P429 S434 L435	K425-V432 HydrophobicContact CB-CG2 4.13Å; K425-V432 HydrophobicContact CD-CG1 4.46Å; K425-V432 HydrophobicContact CG-CG1 4.11Å; K425-V432 HydrophobicContact CG-CG2 3.75Å; P429-V432 VanDerWaalsContact O-CG2 3.32Å; P429-V432 WeakPolarHBondContact O-CG2 3.33Å; P429-V432 PolarHBondContact O-N 2.81Å; V432-S434 VanDerWaalsContact C-N 3.34Å; V432-S434 PolarHBondContact O-N 2.9Å; V432-L435 HydrophobicContact CG2-CD1 4.42Å
433	P	67.7	Low	67	Low	86 Å²	86	54.2 Å²	54.2	56%	0.558	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.5	175.9	-19.8	33.8	0	0	0	113.4	L431	L431-P433 VanDerWaalsContact C-CD 3.46Å; L431-P433 VanDerWaalsContact C-N 3.33Å; L431-P433 VanDerWaalsContact O-N 3.09Å
434	S	74.2	Confident	68.8	Low	1 Å²	1	54 Å²	54	1%	0.007	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-12.9	-174.3	-43.3	0	0	0	0	113.6	L431 V432 Y436 V437 I438 W460	L431-S434 CarbonylContact O-C 3.38Å; L431-S434 WeakPolarHBondContact O-CA 3.46Å; L431-S434 PolarHBondContact O-N 3.39Å; V432-S434 VanDerWaalsContact C-N 3.34Å; V432-S434 PolarHBondContact O-N 2.9Å; S434-Y436 PolarHBondContact O-N 3.09Å; S434-V437 PolarHBondContact O-N 3.4Å; S434-I438 WeakPolarHBondContact O-CG1 3.35Å; S434-I438 PolarHBondContact O-N 3.2Å; S434-W460 VanDerWaalsContact OG-CZ2 3.23Å; S434-W460 WeakPolarHBondContact OG-CZ2 3.47Å; S434-W460 PolarHBondContact OG-NE1 2.98Å; S434-W460 VanDerWaalsContact OG-NE1 3.1Å
435	L	73.1	Confident	70.5	Confident	24 Å²	24	56.9 Å²	56.9	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-56.3	-37.9	-173.3	-85.2	179.5	0	0	0	112.1	L431 V432 I438 S439	L431-L435 HydrophobicContact CB-CD2 3.56Å; L431-L435 HydrophobicContact CB-CG 3.71Å; L431-L435 HydrophobicContact CD1-CD2 4.01Å; L431-L435 HydrophobicContact CG-CD2 4.44Å; L431-L435 WeakPolarHBondContact O-CG 3.48Å; L431-L435 PolarHBondContact O-N 2.87Å; V432-L435 HydrophobicContact CG2-CD1 4.42Å; L435-I438 PolarHBondContact O-N 2.73Å; L435-S439 WeakPolarHBondContact O-CB 3.36Å; L435-S439 PolarHBondContact O-N 3.36Å; L435-S439 PolarHBondContact O-OG 2.96Å
436	Y	75.8	Confident	72.4	Confident	142 Å²	142	52.1 Å²	52.1	56%	0.557	26%	0.26	S	S	*	.	H	α-helix	trans	-64.6	-43.5	179	-177	-101.2	0	0	0	111.8	S434 S439 R440 H458	S434-Y436 PolarHBondContact O-N 3.09Å; Y436-S439 PolarHBondContact O-N 2.84Å; Y436-S439 PolarHBondContact O-OG 2.85Å; Y436-R440 WeakPolarHBondContact O-CG 3.2Å; Y436-R440 PolarHBondContact O-N 2.95Å; Y436-H458 AromaticContact CD1-CE1 3.72Å; Y436-H458 AromaticContact CD1-NE2 3.38Å; Y436-H458 WeakPolarHBondContact CD1-NE2 3.48Å; Y436-H458 AromaticContact CE1-NE2 3.31Å; Y436-H458 VanDerWaalsContact CE1-NE2 3.31Å; Y436-H458 WeakPolarHBondContact CE1-NE2 3.46Å
437	V	83.7	Confident	74.5	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-43.6	177.8	-167.3	0	0	0	0	110.8	F365 S434 S439 R440 F441 H458 W460	F365-V437 HydrophobicContact CE1-CB 4.09Å; F365-V437 HydrophobicContact CE1-CG1 4.03Å; S434-V437 PolarHBondContact O-N 3.4Å; V437-S439 VanDerWaalsContact C-N 3.29Å; V437-S439 PolarHBondContact O-N 2.83Å; V437-R440 WeakPolarHBondContact O-CB 3.41Å; V437-R440 PolarHBondContact O-N 3.49Å; V437-R440 VanDerWaalsContact O-N 3.14Å; V437-F441 HydrophobicContact CG1-CD2 4.31Å; V437-F441 HydrophobicContact CG1-CE2 3.79Å; V437-F441 VanDerWaalsContact O-CD2 3.28Å; V437-F441 WeakPolarHBondContact O-CD2 3.49Å; V437-F441 PolarHBondContact O-N 2.8Å; V437-H458 VanDerWaalsContact CG2-CE1 3.42Å; V437-H458 WeakPolarHBondContact CG2-CE1 3.38Å; V437-H458 VanDerWaalsContact CG2-ND1 3.3Å; V437-H458 WeakPolarHBondContact CG2-ND1 3.38Å; V437-W460 HydrophobicContact CG2-CB 3.44Å; V437-W460 VanDerWaalsContact CG2-CB 3.44Å; V437-W460 HydrophobicContact CG2-CD2 4.29Å; V437-W460 HydrophobicContact CG2-CG 3.72Å
438	I	84.5	Confident	76.5	Confident	1 Å²	1	49 Å²	49	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-40.1	179	-66.7	167.7	0	0	0	110.8	F365 A366 L369 L431 S434 L435 R440 F441 L442	F365-I438 HydrophobicContact CD1-CD1 4.37Å; F365-I438 HydrophobicContact CD1-CG1 3.52Å; F365-I438 HydrophobicContact CE1-CD1 4.44Å; F365-I438 HydrophobicContact CE1-CG1 3.67Å; F365-I438 HydrophobicContact CG-CD1 4.43Å; F365-I438 HydrophobicContact CG-CG1 3.97Å; F365-I438 HydrophobicContact CZ-CG1 4.22Å; A366-I438 HydrophobicContact CB-CD1 4.49Å; A366-I438 HydrophobicContact CB-CG2 4.48Å; L369-I438 HydrophobicContact CD1-CD1 3.85Å; L431-I438 HydrophobicContact CD1-CD1 4.48Å; L431-I438 HydrophobicContact CD2-CD1 3.92Å; S434-I438 WeakPolarHBondContact O-CG1 3.35Å; S434-I438 PolarHBondContact O-N 3.2Å; L435-I438 PolarHBondContact O-N 2.73Å; I438-R440 VanDerWaalsContact C-N 3.29Å; I438-R440 PolarHBondContact O-N 3.2Å; I438-F441 PolarHBondContact O-N 2.94Å; I438-L442 HydrophobicContact CG2-CD1 3.64Å; I438-L442 HydrophobicContact CG2-CG 4.21Å; I438-L442 WeakPolarHBondContact O-CG 3.26Å; I438-L442 PolarHBondContact O-N 2.87Å
439	S	80.8	Confident	78.3	Confident	38 Å²	38	48.2 Å²	48.2	27%	0.266	25%	0.252	S	S	.	.	H	α-helix	trans	-65.7	-30.7	178.7	72.9	0	0	0	0	113	L435 Y436 V437 L442 T443	L435-S439 WeakPolarHBondContact O-CB 3.36Å; L435-S439 PolarHBondContact O-N 3.36Å; L435-S439 PolarHBondContact O-OG 2.96Å; Y436-S439 PolarHBondContact O-N 2.84Å; Y436-S439 PolarHBondContact O-OG 2.85Å; V437-S439 VanDerWaalsContact C-N 3.29Å; V437-S439 PolarHBondContact O-N 2.83Å; S439-L442 CarbonylContact O-C 3.38Å; S439-L442 PolarHBondContact O-N 2.78Å; S439-T443 PolarHBondContact O-N 3.17Å; S439-T443 VanDerWaalsContact O-N 3.15Å; S439-T443 PolarHBondContact O-OG1 2.91Å
440	R	86.3	Confident	80.2	Confident	85 Å²	85	44.2 Å²	44.2	32%	0.321	23%	0.226	S	C	.	.	H	α-helix	trans	-66.9	-34.3	174.2	-62.3	-66.8	-64.6	147.3	4.5	112.4	Y436 V437 I438 T443 I450	Y436-R440 WeakPolarHBondContact O-CG 3.2Å; Y436-R440 PolarHBondContact O-N 2.95Å; V437-R440 WeakPolarHBondContact O-CB 3.41Å; V437-R440 PolarHBondContact O-N 3.49Å; V437-R440 VanDerWaalsContact O-N 3.14Å; I438-R440 VanDerWaalsContact C-N 3.29Å; I438-R440 PolarHBondContact O-N 3.2Å; R440-T443 PolarHBondContact O-OG1 3.18Å; R440-I450 HydrophobicContact CB-CB 4.01Å; R440-I450 HydrophobicContact CB-CD1 4.17Å; R440-I450 HydrophobicContact CB-CG2 3.95Å; R440-I450 PolarHBondContact O-N 3.27Å
441	F	89.3	Confident	82	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73.4	-40.8	170.4	-70	-71.6	0	0	0	112.3	L284 L358 V361 F365 V437 I438 T443 R449 I450 A455	L284-F441 HydrophobicContact CD1-CZ 4.19Å; L284-F441 HydrophobicContact CD2-CE1 3.82Å; L284-F441 HydrophobicContact CD2-CZ 3.74Å; L358-F441 HydrophobicContact CB-CD1 4.23Å; L358-F441 HydrophobicContact CD1-CD1 4.38Å; L358-F441 HydrophobicContact CD1-CE1 4.06Å; L358-F441 WeakPolarHBondContact O-CD1 3.5Å; V361-F441 HydrophobicContact CG1-CD1 4.27Å; V361-F441 HydrophobicContact CG1-CE1 3.89Å; V361-F441 HydrophobicContact CG1-CZ 4.14Å; F365-F441 HydrophobicContact CD1-CD2 4.24Å; F365-F441 HydrophobicContact CD1-CE2 4.05Å; F365-F441 HydrophobicContact CE1-CE2 4.42Å; V437-F441 HydrophobicContact CG1-CD2 4.31Å; V437-F441 HydrophobicContact CG1-CE2 3.79Å; V437-F441 VanDerWaalsContact O-CD2 3.28Å; V437-F441 WeakPolarHBondContact O-CD2 3.49Å; V437-F441 PolarHBondContact O-N 2.8Å; I438-F441 PolarHBondContact O-N 2.94Å; F441-T443 PolarHBondContact O-N 3.41Å; F441-R449 WeakPolarHBondContact O-CD 3.39Å; F441-R449 WeakPolarHBondContact O-CG 3.32Å; F441-R449 PolarHBondContact O-NE 3.11Å; F441-I450 HydrophobicContact CD1-CG2 3.59Å; F441-I450 HydrophobicContact CD2-CG2 4.47Å; F441-I450 HydrophobicContact CE1-CG2 3.78Å; F441-I450 HydrophobicContact CG-CG2 3.97Å; F441-I450 HydrophobicContact CZ-CG2 4.34Å; F441-A455 HydrophobicContact CE1-CB 3.77Å; F441-A455 HydrophobicContact CE2-CB 4.27Å; F441-A455 HydrophobicContact CZ-CB 3.38Å
442	L	87.1	Confident	83.6	Confident	9 Å²	9	42.3 Å²	42.3	5%	0.047	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	26.9	-178.1	-58	-179.9	0	0	0	112.9	W359 L374 F375 L392 I438 S439 Y444	W359-L442 HydrophobicContact CD2-CD2 3.98Å; W359-L442 HydrophobicContact CE3-CD2 4.14Å; W359-L442 HydrophobicContact CG-CD2 4.5Å; W359-L442 HydrophobicContact CH2-CB 4.4Å; W359-L442 HydrophobicContact CH2-CD2 4.32Å; W359-L442 HydrophobicContact CZ2-CD2 4.15Å; W359-L442 HydrophobicContact CZ3-CB 4.15Å; W359-L442 HydrophobicContact CZ3-CD2 4.32Å; W359-L442 WeakPolarHBondContact CZ3-O 3.42Å; L374-L442 HydrophobicContact CD2-CD1 3.39Å; F375-L442 HydrophobicContact CE2-CD1 4.37Å; F375-L442 HydrophobicContact CE2-CD2 4.27Å; F375-L442 HydrophobicContact CZ-CD1 4.27Å; L392-L442 HydrophobicContact CD1-CD1 4.36Å; L392-L442 HydrophobicContact CD2-CD1 4.01Å; I438-L442 HydrophobicContact CG2-CD1 3.64Å; I438-L442 HydrophobicContact CG2-CG 4.21Å; I438-L442 WeakPolarHBondContact O-CG 3.26Å; I438-L442 PolarHBondContact O-N 2.87Å; S439-L442 CarbonylContact O-C 3.38Å; S439-L442 PolarHBondContact O-N 2.78Å; L442-Y444 PolarHBondContact O-N 3.45Å
443	T	83.6	Confident	85.3	Confident	32 Å²	32	42.7 Å²	42.7	20%	0.196	22%	0.216	C	C	.	.			trans	-72.6	125.8	173.1	-64.2	0	0	0	0	109.3	S439 R440 F441 A448 R449	S439-T443 PolarHBondContact O-N 3.17Å; S439-T443 VanDerWaalsContact O-N 3.15Å; S439-T443 PolarHBondContact O-OG1 2.91Å; R440-T443 PolarHBondContact O-OG1 3.18Å; F441-T443 PolarHBondContact O-N 3.41Å; T443-A448 HydrophobicContact CG2-CB 3.96Å; T443-R449 PolarHBondContact O-NE 2.66Å; T443-R449 PolarHBondContact O-NH2 2.82Å
444	Y	82.1	Confident	86.6	Confident	20 Å²	20	43.9 Å²	43.9	8%	0.078	21%	0.214	C	C	.	.	S	Bend	trans	-64.7	-43	-175.9	-80.5	-94.3	0	0	0	112.6	P343 M389 T396 L400 L403 L442 P446 R449	P343-Y444 HydrophobicContact CB-CD1 3.9Å; P343-Y444 HydrophobicContact CB-CE1 4.29Å; P343-Y444 HydrophobicContact CG-CD1 3.78Å; P343-Y444 HydrophobicContact CG-CE1 4.42Å; M389-Y444 VanDerWaalsContact C-OH 3.3Å; M389-Y444 HydrophobicContact CE-CD1 4.46Å; M389-Y444 HydrophobicContact CE-CE1 3.72Å; M389-Y444 HydrophobicContact CG-CE1 4.34Å; M389-Y444 VanDerWaalsContact CG-OH 3.23Å; M389-Y444 WeakPolarHBondContact CG-OH 3.4Å; M389-Y444 PolarHBondContact O-OH 3.22Å; M389-Y444 HydrophobicContact SD-CE1 4.03Å; T396-Y444 HydrophobicContact CG2-CD1 4.31Å; T396-Y444 HydrophobicContact CG2-CD2 3.29Å; T396-Y444 HydrophobicContact CG2-CE1 4.35Å; T396-Y444 HydrophobicContact CG2-CE2 3.37Å; T396-Y444 HydrophobicContact CG2-CG 3.75Å; L400-Y444 HydrophobicContact CD1-CD1 3.17Å; L400-Y444 HydrophobicContact CD1-CE1 3.59Å; L400-Y444 HydrophobicContact CD1-CG 3.92Å; L403-Y444 WeakPolarHBondContact CD1-O 3.43Å; L442-Y444 PolarHBondContact O-N 3.45Å; Y444-P446 VanDerWaalsContact O-CD 3.3Å; Y444-P446 WeakPolarHBondContact O-CD 3.33Å; Y444-R449 PolarHBondContact O-NH2 3.36Å
445	Y	84	Confident	87.5	Confident	75 Å²	75	43.8 Å²	43.8	29%	0.294	21%	0.214	S	C	.	.	S	Bend	trans	-74.5	115.7	178.2	-173.6	-128.7	0	0	0	110.8	K447 A448 R449	Y445-K447 VanDerWaalsContact C-N 3.28Å; Y445-K447 HydrophobicContact CD1-CB 4.14Å; Y445-K447 HydrophobicContact CE1-CB 3.62Å; Y445-K447 HydrophobicContact CE1-CD 4.39Å; Y445-K447 HydrophobicContact CE1-CG 4.15Å; Y445-K447 HydrophobicContact CE2-CG 4.44Å; Y445-K447 PolarHBondContact O-N 3.37Å; Y445-K447 WeakPolarHBondContact OH-CD 3.18Å; Y445-A448 HydrophobicContact CD1-CB 3.82Å; Y445-A448 PolarHBondContact O-N 3.21Å; Y445-R449 PolarHBondContact O-N 2.91Å
446	P	88.3	Confident	88.5	Confident	33 Å²	33	43.9 Å²	43.9	21%	0.214	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-63.2	-33.6	-169.4	-24.7	35.7	0	0	0	112.7	E344 A355 L403 Y444 A448 R449	E344-P446 HydrophobicContact CB-CG 4.14Å; E344-P446 HydrophobicContact CG-CG 4.04Å; A355-P446 HydrophobicContact CB-CB 3.73Å; L403-P446 HydrophobicContact CD1-CG 4.37Å; Y444-P446 VanDerWaalsContact O-CD 3.3Å; Y444-P446 WeakPolarHBondContact O-CD 3.33Å; P446-A448 VanDerWaalsContact C-N 3.29Å; P446-A448 PolarHBondContact O-N 3.32Å; P446-R449 VanDerWaalsContact O-CB 3.3Å; P446-R449 WeakPolarHBondContact O-CB 3.42Å; P446-R449 PolarHBondContact O-N 2.87Å
447	K	88.9	Confident	89.3	Confident	176 Å²	176	46.3 Å²	46.3	77%	0.765	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-72.9	-19	178.9	-51.7	-168.9	-171.4	172.2	0	113.9	Y445	Y445-K447 VanDerWaalsContact C-N 3.28Å; Y445-K447 HydrophobicContact CD1-CB 4.14Å; Y445-K447 HydrophobicContact CE1-CB 3.62Å; Y445-K447 HydrophobicContact CE1-CD 4.39Å; Y445-K447 HydrophobicContact CE1-CG 4.15Å; Y445-K447 HydrophobicContact CE2-CG 4.44Å; Y445-K447 PolarHBondContact O-N 3.37Å; Y445-K447 WeakPolarHBondContact OH-CD 3.18Å
448	A	88.9	Confident	89.7	Confident	42 Å²	42	48.2 Å²	48.2	35%	0.347	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-96.9	-6.6	175.4	0	0	0	0	0	112.8	T443 Y445 P446	T443-A448 HydrophobicContact CG2-CB 3.96Å; Y445-A448 HydrophobicContact CD1-CB 3.82Å; Y445-A448 PolarHBondContact O-N 3.21Å; P446-A448 VanDerWaalsContact C-N 3.29Å; P446-A448 PolarHBondContact O-N 3.32Å
449	R	92.5	Very high	89.9	Confident	15 Å²	15	49.9 Å²	49.9	6%	0.057	25%	0.251	C	S	.	.	S	Bend	trans	-68.7	137	176.7	-164	175.7	-63.8	149.1	5.9	109.3	E344 A355 L358 F441 T443 Y444 Y445 P446	E344-R449 IonicContact OE1-CZ 3.54Å; E344-R449 IonicContact OE1-NH1 3.4Å; E344-R449 PolarHBondContact OE1-NH1 3.42Å; E344-R449 IonicContact OE1-NH2 3.56Å; E344-R449 PolarHBondContact OE1-NH2 2.94Å; E344-R449 IonicContact OE2-CZ 3.88Å; E344-R449 IonicContact OE2-NH1 3.74Å; E344-R449 IonicContact OE2-NH2 2.7Å; E344-R449 PolarHBondContact OE2-NH2 3.39Å; A355-R449 VanDerWaalsContact O-CD 3.32Å; A355-R449 WeakPolarHBondContact O-CD 3.37Å; A355-R449 PolarHBondContact O-NH1 3.2Å; L358-R449 HydrophobicContact CB-CG 4.4Å; F441-R449 WeakPolarHBondContact O-CD 3.39Å; F441-R449 WeakPolarHBondContact O-CG 3.32Å; F441-R449 PolarHBondContact O-NE 3.11Å; T443-R449 PolarHBondContact O-NE 2.66Å; T443-R449 PolarHBondContact O-NH2 2.82Å; Y444-R449 PolarHBondContact O-NH2 3.36Å; Y445-R449 PolarHBondContact O-N 2.91Å; P446-R449 VanDerWaalsContact O-CB 3.3Å; P446-R449 WeakPolarHBondContact O-CB 3.42Å; P446-R449 PolarHBondContact O-N 2.87Å
450	I	93.3	Very high	90.3	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.041	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-61.7	140.7	-177.7	-164.5	166.8	0	0	0	111.1	L358 R440 F441 E454 A455	L358-I450 WeakPolarHBondContact CG-O 3.38Å; R440-I450 HydrophobicContact CB-CB 4.01Å; R440-I450 HydrophobicContact CB-CD1 4.17Å; R440-I450 HydrophobicContact CB-CG2 3.95Å; R440-I450 PolarHBondContact O-N 3.27Å; F441-I450 HydrophobicContact CD1-CG2 3.59Å; F441-I450 HydrophobicContact CD2-CG2 4.47Å; F441-I450 HydrophobicContact CE1-CG2 3.78Å; F441-I450 HydrophobicContact CG-CG2 3.97Å; F441-I450 HydrophobicContact CZ-CG2 4.34Å; I450-E454 HydrophobicContact CD1-CB 4.12Å; I450-E454 HydrophobicContact CG1-CB 3.59Å; I450-A455 HydrophobicContact CD1-CB 3.85Å; I450-A455 HydrophobicContact CG1-CB 4.08Å; I450-A455 HydrophobicContact CG2-CB 4.24Å
451	S	95.9	Very high	90.5	Very high	45 Å²	45	44.8 Å²	44.8	32%	0.315	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-78.9	162.7	172	63.9	0	0	0	0	112	L453 E454 A455	S451-L453 VanDerWaalsContact C-N 3.29Å; S451-L453 PolarHBondContact O-N 3.37Å; S451-E454 PolarHBondContact N-OE2 2.9Å; S451-E454 PolarHBondContact O-N 3.28Å; S451-E454 WeakPolarHBondContact OG-CB 3.37Å; S451-E454 VanDerWaalsContact OG-CD 3.24Å; S451-E454 WeakPolarHBondContact OG-CG 3.44Å; S451-E454 PolarHBondContact OG-N 2.78Å; S451-E454 PolarHBondContact OG-OE2 2.75Å; S451-A455 WeakPolarHBondContact O-CB 3.27Å; S451-A455 PolarHBondContact O-N 2.91Å
452	A	96	Very high	90.4	Very high	3 Å²	3	50.1 Å²	50.1	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-40.6	177.9	0	0	0	0	0	112.4	L284 I287 H288 L358 A455 S456	L284-A452 HydrophobicContact CD2-CB 4.37Å; I287-A452 HydrophobicContact CB-CB 4.45Å; I287-A452 HydrophobicContact CG2-CB 4.07Å; H288-A452 HydrophobicContact CB-CB 3.8Å; L358-A452 HydrophobicContact CD1-CB 4.1Å; A452-A455 PolarHBondContact O-N 2.89Å; A452-S456 PolarHBondContact O-N 3.04Å; A452-S456 PolarHBondContact O-OG 3.02Å
453	L	95.1	Very high	90.5	Very high	60 Å²	60	54.6 Å²	54.6	31%	0.314	28%	0.279	S	S	.	.	H	α-helix	trans	-68.4	-40.8	178.5	179.8	61.1	0	0	0	113	S451 A455 S456 R457	S451-L453 VanDerWaalsContact C-N 3.29Å; S451-L453 PolarHBondContact O-N 3.37Å; L453-A455 VanDerWaalsContact C-N 3.34Å; L453-S456 PolarHBondContact O-OG 2.81Å; L453-R457 WeakPolarHBondContact O-CG 3.5Å
454	E	94.8	Very high	90.6	Very high	111 Å²	111	59.3 Å²	59.3	52%	0.519	30%	0.299	S	S	.	.	H	α-helix	trans	-68.2	-38.5	175.8	-72.7	167.8	144.3	0	0	111.2	I450 S451 R457 H458	I450-E454 HydrophobicContact CD1-CB 4.12Å; I450-E454 HydrophobicContact CG1-CB 3.59Å; S451-E454 PolarHBondContact N-OE2 2.9Å; S451-E454 PolarHBondContact O-N 3.28Å; S451-E454 WeakPolarHBondContact OG-CB 3.37Å; S451-E454 VanDerWaalsContact OG-CD 3.24Å; S451-E454 WeakPolarHBondContact OG-CG 3.44Å; S451-E454 PolarHBondContact OG-N 2.78Å; S451-E454 PolarHBondContact OG-OE2 2.75Å; E454-R457 PolarHBondContact O-N 2.83Å; E454-H458 PolarHBondContact O-N 2.68Å
455	A	94.5	Very high	90.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-42.6	178.8	0	0	0	0	0	112.1	L284 F441 I450 S451 A452 L453 R457 H458 F461	L284-A455 HydrophobicContact CD1-CB 3.87Å; L284-A455 HydrophobicContact CD2-CB 4.03Å; F441-A455 HydrophobicContact CE1-CB 3.77Å; F441-A455 HydrophobicContact CE2-CB 4.27Å; F441-A455 HydrophobicContact CZ-CB 3.38Å; I450-A455 HydrophobicContact CD1-CB 3.85Å; I450-A455 HydrophobicContact CG1-CB 4.08Å; I450-A455 HydrophobicContact CG2-CB 4.24Å; S451-A455 WeakPolarHBondContact O-CB 3.27Å; S451-A455 PolarHBondContact O-N 2.91Å; A452-A455 PolarHBondContact O-N 2.89Å; L453-A455 VanDerWaalsContact C-N 3.34Å; A455-R457 PolarHBondContact O-N 2.83Å; A455-H458 WeakPolarHBondContact O-CB 3.3Å; A455-H458 PolarHBondContact O-N 3.45Å; A455-F461 WeakPolarHBondContact O-CD2 3.23Å; A455-F461 WeakPolarHBondContact O-CE2 3.3Å
456	S	93.3	Very high	91.2	Very high	26 Å²	26	65.8 Å²	65.8	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-22.8	179.3	66.1	0	0	0	0	113.3	A452 L453	A452-S456 PolarHBondContact O-N 3.04Å; A452-S456 PolarHBondContact O-OG 3.02Å; L453-S456 PolarHBondContact O-OG 2.81Å
457	R	93.1	Very high	91.4	Very high	192 Å²	192	66.8 Å²	66.8	73%	0.725	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	1.9	176	-65.7	176.5	177.9	179.3	0.3	113.9	L453 E454 A455	L453-R457 WeakPolarHBondContact O-CG 3.5Å; E454-R457 PolarHBondContact O-N 2.83Å; A455-R457 PolarHBondContact O-N 2.83Å
458	H	91	Very high	91.5	Very high	41 Å²	41	60.2 Å²	60.2	19%	0.19	31%	0.312	C	S	.	.			trans	-67.8	139.7	-176.2	-167.6	-78.6	0	0	0	111.9	Y436 V437 E454 A455 W460 F461	Y436-H458 AromaticContact CD1-CE1 3.72Å; Y436-H458 AromaticContact CD1-NE2 3.38Å; Y436-H458 WeakPolarHBondContact CD1-NE2 3.48Å; Y436-H458 AromaticContact CE1-NE2 3.31Å; Y436-H458 VanDerWaalsContact CE1-NE2 3.31Å; Y436-H458 WeakPolarHBondContact CE1-NE2 3.46Å; V437-H458 VanDerWaalsContact CG2-CE1 3.42Å; V437-H458 WeakPolarHBondContact CG2-CE1 3.38Å; V437-H458 VanDerWaalsContact CG2-ND1 3.3Å; V437-H458 WeakPolarHBondContact CG2-ND1 3.38Å; E454-H458 PolarHBondContact O-N 2.68Å; A455-H458 WeakPolarHBondContact O-CB 3.3Å; A455-H458 PolarHBondContact O-N 3.45Å; H458-W460 WeakPolarHBondContact ND1-CB 3.47Å; H458-W460 PolarHBondContact ND1-N 3.37Å; H458-W460 PolarHBondContact O-N 3.03Å; H458-F461 HydrophobicContact CB-CD2 4.31Å; H458-F461 PolarHBondContact O-N 3.46Å
459	G	89.7	Confident	91.7	Very high	36 Å²	36	64 Å²	64	37%	0.371	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-54.7	-29.7	-175.5	0	0	0	0	0	115	F461 V462 E463	G459-F461 PolarHBondContact O-N 3.41Å; G459-F461 VanDerWaalsContact O-N 3.12Å; G459-V462 WeakPolarHBondContact O-CA 3.39Å; G459-V462 PolarHBondContact O-N 3.15Å; G459-E463 WeakPolarHBondContact O-CG 3.42Å; G459-E463 PolarHBondContact O-N 2.95Å
460	W	88.6	Confident	91.6	Very high	3 Å²	3	64.6 Å²	64.6	1%	0.011	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-51.5	-32.9	173.4	-174.1	78	0	0	0	114.3	V273 V276 K277 F365 S434 V437 H458 V462	V273-W460 HydrophobicContact CG1-CZ2 4.04Å; V276-W460 HydrophobicContact CG1-CH2 4.41Å; K277-W460 HydrophobicContact CB-CH2 4.21Å; K277-W460 HydrophobicContact CB-CZ3 4.18Å; K277-W460 HydrophobicContact CD-CH2 4.3Å; K277-W460 HydrophobicContact CD-CZ2 4.42Å; K277-W460 HydrophobicContact CD-CZ3 4.4Å; K277-W460 WeakPolarHBondContact CE-O 3.36Å; K277-W460 HydrophobicContact CG-CD2 4.36Å; K277-W460 HydrophobicContact CG-CE3 3.89Å; K277-W460 HydrophobicContact CG-CH2 3.22Å; K277-W460 HydrophobicContact CG-CZ2 3.75Å; K277-W460 HydrophobicContact CG-CZ3 3.33Å; K277-W460 PolarHBondContact NZ-O 2.94Å; F365-W460 HydrophobicContact CE1-CH2 4.48Å; F365-W460 HydrophobicContact CE1-CZ3 4.25Å; F365-W460 AromaticContact CE2-CH2 3.42Å; F365-W460 HydrophobicContact CE2-CH2 3.42Å; F365-W460 VanDerWaalsContact CE2-CH2 3.42Å; F365-W460 AromaticContact CE2-CZ2 3.95Å; F365-W460 HydrophobicContact CE2-CZ2 3.95Å; F365-W460 AromaticContact CE2-CZ3 3.89Å; F365-W460 HydrophobicContact CE2-CZ3 3.89Å; F365-W460 HydrophobicContact CZ-CD2 4.27Å; F365-W460 AromaticContact CZ-CE3 3.91Å; F365-W460 HydrophobicContact CZ-CE3 3.91Å; F365-W460 AromaticContact CZ-CH2 3.28Å; F365-W460 HydrophobicContact CZ-CH2 3.28Å; F365-W460 AromaticContact CZ-CZ2 3.67Å; F365-W460 HydrophobicContact CZ-CZ2 3.67Å; F365-W460 AromaticContact CZ-CZ3 3.38Å; F365-W460 HydrophobicContact CZ-CZ3 3.38Å; S434-W460 VanDerWaalsContact OG-CZ2 3.23Å; S434-W460 WeakPolarHBondContact OG-CZ2 3.47Å; S434-W460 PolarHBondContact OG-NE1 2.98Å; S434-W460 VanDerWaalsContact OG-NE1 3.1Å; V437-W460 HydrophobicContact CG2-CB 3.44Å; V437-W460 VanDerWaalsContact CG2-CB 3.44Å; V437-W460 HydrophobicContact CG2-CD2 4.29Å; V437-W460 HydrophobicContact CG2-CG 3.72Å; H458-W460 WeakPolarHBondContact ND1-CB 3.47Å; H458-W460 PolarHBondContact ND1-N 3.37Å; H458-W460 PolarHBondContact O-N 3.03Å; W460-V462 PolarHBondContact O-N 3.31Å
461	F	89.9	Confident	91.3	Very high	13 Å²	13	68.2 Å²	68.2	6%	0.057	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-73	-17	176.7	-71.4	-78.7	0	0	0	113.4	K277 M280 Y281 L284 A455 H458 G459 P467	K277-F461 HydrophobicContact CB-CD1 4.37Å; K277-F461 WeakPolarHBondContact O-CE1 3.46Å; M280-F461 HydrophobicContact CB-CE1 3.9Å; M280-F461 HydrophobicContact CB-CZ 4Å; Y281-F461 HydrophobicContact CD2-CD1 4.4Å; L284-F461 HydrophobicContact CD1-CE2 3.99Å; L284-F461 HydrophobicContact CD1-CZ 3.66Å; A455-F461 WeakPolarHBondContact O-CD2 3.23Å; A455-F461 WeakPolarHBondContact O-CE2 3.3Å; H458-F461 HydrophobicContact CB-CD2 4.31Å; H458-F461 PolarHBondContact O-N 3.46Å; G459-F461 PolarHBondContact O-N 3.41Å; G459-F461 VanDerWaalsContact O-N 3.12Å; F461-P467 WeakPolarHBondContact O-CD 3.31Å; F461-P467 VanDerWaalsContact O-CG 3.26Å; F461-P467 WeakPolarHBondContact O-CG 3.26Å
462	V	88.7	Confident	90.9	Very high	113 Å²	113	72 Å²	72	69%	0.685	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-28	179.8	-175.2	0	0	0	0	111.7	G459 W460	G459-V462 WeakPolarHBondContact O-CA 3.39Å; G459-V462 PolarHBondContact O-N 3.15Å; W460-V462 PolarHBondContact O-N 3.31Å
463	E	87.7	Confident	90.5	Very high	102 Å²	102	72.4 Å²	72.4	48%	0.477	37%	0.372	S	S	.	.	S	Bend	trans	-59.6	152.6	176.6	-73.8	167.1	-163	0	0	112.5	K277 G459 P465	K277-E463 PolarHBondContact NZ-O 2.72Å; G459-E463 WeakPolarHBondContact O-CG 3.42Å; G459-E463 PolarHBondContact O-N 2.95Å; E463-P465 CarbonylContact O-C 3.4Å; E463-P465 VanDerWaalsContact O-C 3.32Å; E463-P465 VanDerWaalsContact O-O 3.09Å
464	E	86	Confident	89.6	Confident	131 Å²	131	72.1 Å²	72.1	61%	0.612	37%	0.373	S	S	*	.	S	Bend	trans	-72.6	142.6	172.5	-68.5	-61.4	159.5	0	0	111.3	R466	E464-R466 WeakPolarHBondContact OE1-CD 3.46Å; E464-R466 WeakPolarHBondContact OE1-CG 3.46Å; E464-R466 IonicContact OE1-CZ 3.81Å; E464-R466 IonicContact OE1-NE 3.91Å; E464-R466 PolarHBondContact OE1-NE 3.48Å; E464-R466 IonicContact OE1-NH2 3.84Å; E464-R466 PolarHBondContact OE2-N 2.91Å
465	P	89.1	Confident	88.7	Confident	67 Å²	67	71.7 Å²	71.7	44%	0.435	38%	0.379	S	S	.	.	S	Bend	cis	-71.4	136.7	-3.6	29.6	-33.8	0	0	0	111.3	V273 K277 E463	V273-P465 HydrophobicContact CB-CG 3.76Å; V273-P465 HydrophobicContact CG1-CG 3.81Å; K277-P465 WeakPolarHBondContact CD-O 3.48Å; K277-P465 VanDerWaalsContact CE-O 3.31Å; K277-P465 WeakPolarHBondContact CE-O 3.42Å; K277-P465 PolarHBondContact NZ-O 3.08Å; E463-P465 CarbonylContact O-C 3.4Å; E463-P465 VanDerWaalsContact O-C 3.32Å; E463-P465 VanDerWaalsContact O-O 3.09Å
466	R	90.5	Very high	87.9	Confident	165 Å²	165	74.2 Å²	74.2	62%	0.623	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-61.8	158.8	176.7	-75.2	177.6	-162.9	-144.3	-0.3	112.9	G274 E464 V468	G274-R466 WeakPolarHBondContact CA-O 3.04Å; E464-R466 WeakPolarHBondContact OE1-CD 3.46Å; E464-R466 WeakPolarHBondContact OE1-CG 3.46Å; E464-R466 IonicContact OE1-CZ 3.81Å; E464-R466 IonicContact OE1-NE 3.91Å; E464-R466 PolarHBondContact OE1-NE 3.48Å; E464-R466 IonicContact OE1-NH2 3.84Å; E464-R466 PolarHBondContact OE2-N 2.91Å; R466-V468 PolarHBondContact O-N 3.43Å
467	P	92	Very high	87.1	Confident	53 Å²	53	77.2 Å²	77.2	34%	0.344	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-56.1	132.1	171.5	-19.5	30.1	0	0	0	111.2	G274 K277 T278 F461	G274-P467 WeakPolarHBondContact O-CA 3.45Å; K277-P467 HydrophobicContact CB-CB 4.02Å; K277-P467 HydrophobicContact CB-CG 4.02Å; K277-P467 HydrophobicContact CD-CG 4.41Å; T278-P467 WeakPolarHBondContact OG1-CB 3.28Å; F461-P467 WeakPolarHBondContact O-CD 3.31Å; F461-P467 VanDerWaalsContact O-CG 3.26Å; F461-P467 WeakPolarHBondContact O-CG 3.26Å
468	V	92.1	Very high	86.3	Confident	38 Å²	38	68.1 Å²	68.1	23%	0.23	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-76.4	134.3	178.2	173.3	0	0	0	0	109.5	G274 E275 T278 R466 L472 F473	G274-V468 PolarHBondContact O-N 2.88Å; E275-V468 HydrophobicContact CG-CB 4.36Å; E275-V468 HydrophobicContact CG-CG2 4.25Å; T278-V468 WeakPolarHBondContact CB-O 3.39Å; T278-V468 WeakPolarHBondContact CG2-O 3.31Å; T278-V468 PolarHBondContact OG1-N 3.09Å; T278-V468 PolarHBondContact OG1-O 2.58Å; R466-V468 PolarHBondContact O-N 3.43Å; V468-L472 HydrophobicContact CG1-CB 3.72Å; V468-L472 HydrophobicContact CG1-CD1 4.44Å; V468-F473 HydrophobicContact CB-CE2 4.35Å; V468-F473 HydrophobicContact CG1-CD2 4.31Å; V468-F473 HydrophobicContact CG1-CE2 4.29Å
469	H	91.9	Very high	85.6	Confident	121 Å²	121	70.9 Å²	70.9	56%	0.56	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-60.8	136.7	176.8	-171.8	-94.6	0	0	0	110.7	S471 L472	H469-S471 PolarHBondContact CE1-OG 2.79Å; H469-S471 PolarHBondContact ND1-N 3.19Å; H469-S471 PolarHBondContact ND1-OG 3.04Å; H469-S471 PolarHBondContact O-N 2.99Å; H469-L472 HydrophobicContact CB-CD1 4.19Å; H469-L472 HydrophobicContact CB-CG 4.35Å; H469-L472 WeakPolarHBondContact O-CB 3.16Å; H469-L472 PolarHBondContact O-N 3.5Å
470	P	90.7	Very high	84.9	Confident	29 Å²	29	70 Å²	70	19%	0.188	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-52.1	-34.4	-175.4	-29.8	35.7	0	0	0	114.9	T278 R310 I312 L472 F473	T278-P470 HydrophobicContact CG2-CG 4.07Å; R310-P470 CarbonylContact C-O 3.46Å; R310-P470 CarbonylContact O-C 3.55Å; R310-P470 VanDerWaalsContact O-C 3.24Å; R310-P470 WeakPolarHBondContact O-CB 3.31Å; I312-P470 HydrophobicContact CD1-CB 3.9Å; I312-P470 HydrophobicContact CD1-CG 4.23Å; P470-L472 PolarHBondContact O-N 2.96Å; P470-F473 WeakPolarHBondContact O-CB 3.14Å; P470-F473 WeakPolarHBondContact O-CD2 3.38Å; P470-F473 PolarHBondContact O-N 3.32Å
471	S	86.8	Confident	84.3	Confident	84 Å²	84	74.2 Å²	74.2	59%	0.587	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-67.8	-14.9	178.3	70.6	0	0	0	0	115	H469	H469-S471 PolarHBondContact CE1-OG 2.79Å; H469-S471 PolarHBondContact ND1-N 3.19Å; H469-S471 PolarHBondContact ND1-OG 3.04Å; H469-S471 PolarHBondContact O-N 2.99Å
472	L	88.3	Confident	83.3	Confident	124 Å²	124	78.9 Å²	78.9	65%	0.649	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-94.1	0.2	178.9	-61.4	176.2	0	0	0	112.2	V468 H469 P470	V468-L472 HydrophobicContact CG1-CB 3.72Å; V468-L472 HydrophobicContact CG1-CD1 4.44Å; H469-L472 HydrophobicContact CB-CD1 4.19Å; H469-L472 HydrophobicContact CB-CG 4.35Å; H469-L472 WeakPolarHBondContact O-CB 3.16Å; H469-L472 PolarHBondContact O-N 3.5Å; P470-L472 PolarHBondContact O-N 2.96Å
473	F	86	Confident	81.9	Confident	12 Å²	12	78.1 Å²	78.1	5%	0.053	41%	0.413	C	S	.	.	S	Bend	trans	-63.2	144.2	175.1	-87.8	-116.6	0	0	0	110.3	E275 T278 L279 V468 P470	E275-F473 HydrophobicContact CB-CE1 3.88Å; E275-F473 HydrophobicContact CB-CE2 4.43Å; E275-F473 HydrophobicContact CB-CZ 3.73Å; E275-F473 HydrophobicContact CG-CE1 4.26Å; E275-F473 HydrophobicContact CG-CE2 4.43Å; E275-F473 HydrophobicContact CG-CZ 4.15Å; T278-F473 HydrophobicContact CG2-CE2 3.72Å; T278-F473 HydrophobicContact CG2-CZ 3.95Å; L279-F473 HydrophobicContact CD1-CE1 4.27Å; L279-F473 HydrophobicContact CD2-CE1 3.8Å; L279-F473 HydrophobicContact CD2-CZ 4.14Å; L279-F473 HydrophobicContact CG-CE1 3.91Å; L279-F473 HydrophobicContact CG-CZ 4.07Å; V468-F473 HydrophobicContact CB-CE2 4.35Å; V468-F473 HydrophobicContact CG1-CD2 4.31Å; V468-F473 HydrophobicContact CG1-CE2 4.29Å; P470-F473 WeakPolarHBondContact O-CB 3.14Å; P470-F473 WeakPolarHBondContact O-CD2 3.38Å; P470-F473 PolarHBondContact O-N 3.32Å
474	P	77.8	Confident	79.9	Confident	53 Å²	53	81.9 Å²	81.9	34%	0.344	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-57.8	151.2	169	-11.7	21.6	0	0	0	110.1	E275 W476	E275-P474 WeakPolarHBondContact OE1-CD 3.35Å; P474-W476 HydrophobicContact CB-CD2 4.39Å; P474-W476 HydrophobicContact CB-CE3 4.4Å; P474-W476 HydrophobicContact CB-CH2 3.6Å; P474-W476 HydrophobicContact CB-CZ2 3.59Å; P474-W476 HydrophobicContact CB-CZ3 4.02Å; P474-W476 HydrophobicContact CG-CH2 3.44Å; P474-W476 VanDerWaalsContact CG-CH2 3.44Å; P474-W476 HydrophobicContact CG-CZ2 3.57Å; P474-W476 HydrophobicContact CG-CZ3 4.25Å; P474-W476 WeakPolarHBondContact O-CZ3 3.4Å
475	T	76.3	Confident	77.7	Confident	102 Å²	102	82 Å²	82	63%	0.626	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-98.5	138.7	167.2	53.7	0	0	0	0	109.3	H309	H309-T475 HydrophobicContact CB-CG2 4.34Å
476	W	77	Confident	75.3	Confident	53 Å²	53	82.8 Å²	82.8	20%	0.201	44%	0.444	C	S	.	.			trans	-118.5	146.4	176.1	-65.8	-91.2	0	0	0	109.3	H258 L263 M267 F271 L307 H309 P474 A478	H258-W476 PolarHBondContact CE1-O 3.06Å; H258-W476 PolarHBondContact NE2-O 2.99Å; L263-W476 HydrophobicContact CD1-CB 3.78Å; L263-W476 HydrophobicContact CD1-CD2 3.57Å; L263-W476 HydrophobicContact CD1-CE3 4.05Å; L263-W476 HydrophobicContact CD1-CG 3.43Å; L263-W476 VanDerWaalsContact CD1-CG 3.43Å; L263-W476 HydrophobicContact CD2-CD2 4.39Å; L263-W476 HydrophobicContact CD2-CE3 4.06Å; L263-W476 HydrophobicContact CD2-CZ3 4.26Å; M267-W476 HydrophobicContact SD-CH2 4.49Å; M267-W476 HydrophobicContact SD-CZ2 3.72Å; F271-W476 HydrophobicContact CD1-CH2 4.39Å; F271-W476 AromaticContact CE1-CH2 3.69Å; F271-W476 HydrophobicContact CE1-CH2 3.69Å; F271-W476 HydrophobicContact CE1-CZ2 4.2Å; F271-W476 HydrophobicContact CE1-CZ3 4.4Å; L307-W476 HydrophobicContact CD2-CZ3 4.37Å; H309-W476 PolarHBondContact CD2-O 3.13Å; H309-W476 PolarHBondContact NE2-O 3.08Å; P474-W476 HydrophobicContact CB-CD2 4.39Å; P474-W476 HydrophobicContact CB-CE3 4.4Å; P474-W476 HydrophobicContact CB-CH2 3.6Å; P474-W476 HydrophobicContact CB-CZ2 3.59Å; P474-W476 HydrophobicContact CB-CZ3 4.02Å; P474-W476 HydrophobicContact CG-CH2 3.44Å; P474-W476 VanDerWaalsContact CG-CH2 3.44Å; P474-W476 HydrophobicContact CG-CZ2 3.57Å; P474-W476 HydrophobicContact CG-CZ3 4.25Å; P474-W476 WeakPolarHBondContact O-CZ3 3.4Å; W476-A478 PolarHBondContact O-N 3.34Å
477	P	76.4	Confident	72.6	Confident	90 Å²	90	79.7 Å²	79.7	58%	0.584	45%	0.447	S	S	*	.			trans	-69.3	126.8	175.7	29.1	-33.9	0	0	0	110.1	K479 L482	P477-K479 PolarHBondContact O-N 3.17Å; P477-L482 HydrophobicContact CB-CD1 4.18Å; P477-L482 HydrophobicContact CG-CD1 4.48Å
478	A	75.4	Confident	70.1	Confident	1 Å²	1	80.7 Å²	80.7	1%	0.008	46%	0.456	C	S	.	.			trans	-69.2	128	-178	0	0	0	0	0	111.3	E257 H258 W476 S480 E481 L482	E257-A478 HydrophobicContact CB-CB 3.99Å; E257-A478 WeakPolarHBondContact O-CB 3.31Å; H258-A478 WeakPolarHBondContact CE1-CA 3.4Å; H258-A478 PolarHBondContact CE1-N 3.14Å; W476-A478 PolarHBondContact O-N 3.34Å; A478-S480 PolarHBondContact O-N 2.77Å; A478-E481 HydrophobicContact CB-CB 4.16Å; A478-E481 HydrophobicContact CB-CG 3.82Å; A478-E481 PolarHBondContact O-N 2.91Å; A478-L482 WeakPolarHBondContact O-CG 3.46Å; A478-L482 PolarHBondContact O-N 3.18Å
479	K	77	Confident	67.6	Low	99 Å²	99	85.5 Å²	85.5	43%	0.43	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-37.7	-179.9	-70.8	-175.2	-173.6	172	0	112.2	S262 P477 E481 L482	S262-K479 WeakPolarHBondContact O-CE 3.4Å; S262-K479 PolarHBondContact O-NZ 3.44Å; S262-K479 PolarHBondContact OG-NZ 3.27Å; P477-K479 PolarHBondContact O-N 3.17Å; K479-E481 PolarHBondContact O-N 3.43Å; K479-L482 PolarHBondContact O-N 2.86Å
480	S	74.6	Confident	65	Low	16 Å²	16	86.6 Å²	86.6	11%	0.112	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.9	176.1	44.5	0	0	0	0	113.5	N178 Y255 A478	N178-S480 PolarHBondContact ND2-O 2.86Å; Y255-S480 WeakPolarHBondContact OH-CB 3.37Å; Y255-S480 PolarHBondContact OH-OG 2.68Å; A478-S480 PolarHBondContact O-N 2.77Å
481	E	76.3	Confident	62.4	Low	92 Å²	92	93.9 Å²	93.9	43%	0.43	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-24.2	178	-66.1	174.7	-177.4	0	0	112.5	A478 K479 V483	A478-E481 HydrophobicContact CB-CB 4.16Å; A478-E481 HydrophobicContact CB-CG 3.82Å; A478-E481 PolarHBondContact O-N 2.91Å; K479-E481 PolarHBondContact O-N 3.43Å; E481-V483 VanDerWaalsContact C-N 3.28Å; E481-V483 PolarHBondContact O-N 2.94Å
482	L	68.7	Low	60.1	Low	112 Å²	112	100.8 Å²	100.8	59%	0.586	53%	0.532	S	S	*	.			trans	-77.7	-8.7	-178.1	-69.8	168.2	0	0	0	114	P477 A478 K479 K484	P477-L482 HydrophobicContact CB-CD1 4.18Å; P477-L482 HydrophobicContact CG-CD1 4.48Å; A478-L482 WeakPolarHBondContact O-CG 3.46Å; A478-L482 PolarHBondContact O-N 3.18Å; K479-L482 PolarHBondContact O-N 2.86Å; L482-K484 PolarHBondContact O-N 2.74Å
483	V	59.5	Low	57.7	Low	96 Å²	96	104.4 Å²	104.4	58%	0.582	54%	0.543	S	S	*	.			trans	-71.1	90.9	177.7	-174	0	0	0	0	109.2	E481 V485	E481-V483 VanDerWaalsContact C-N 3.28Å; E481-V483 PolarHBondContact O-N 2.94Å; V483-V485 PolarHBondContact O-N 2.71Å
484	K	44.8	Very low	55.3	Low	182 Å²	182	108.7 Å²	108.7	79%	0.791	57%	0.574	S	S	*	*			trans	-56.9	127.9	168.3	-72.4	-177.6	177.5	-179	0	108.7	L482 S486	L482-K484 PolarHBondContact O-N 2.74Å; K484-S486 PolarHBondContact O-N 2.77Å
485	V	41.4	Very low	53.3	Low	134 Å²	134	115.4 Å²	115.4	81%	0.812	60%	0.601	S	S	*	*			trans	-43.4	105.3	170.8	179.6	0	0	0	0	108.2	V483 S487	V483-V485 PolarHBondContact O-N 2.71Å; V485-S487 PolarHBondContact O-N 3.12Å
486	S	37.1	Very low	51.5	Low	83 Å²	83	116 Å²	116	58%	0.58	61%	0.609	S	S	*	*			trans	-58.5	126.4	173.8	55.1	0	0	0	0	106.7	K484 S488	K484-S486 PolarHBondContact O-N 2.77Å; S486-S488 PolarHBondContact O-N 2.96Å; S486-S488 PolarHBondContact O-OG 2.99Å; S486-S488 PolarHBondContact OG-OG 2.71Å; S486-S488 VanDerWaalsContact OG-OG 3.11Å
487	S	35.5	Very low	49.4	Very low	99 Å²	99	117.6 Å²	117.6	69%	0.692	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-65.5	29.1	-174.2	-34.8	0	0	0	0	114.2	V485 D489 N490	V485-S487 PolarHBondContact O-N 3.12Å; S487-D489 VanDerWaalsContact C-N 3.34Å; S487-D489 PolarHBondContact O-N 3.19Å; S487-N490 PolarHBondContact O-N 3.34Å
488	S	38.9	Very low	47.4	Very low	74 Å²	74	116.9 Å²	116.9	52%	0.517	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-70.6	-26.7	-173.6	-41.8	0	0	0	0	112.8	S486	S486-S488 PolarHBondContact O-N 2.96Å; S486-S488 PolarHBondContact O-OG 2.99Å; S486-S488 PolarHBondContact OG-OG 2.71Å; S486-S488 VanDerWaalsContact OG-OG 3.11Å
489	D	40.2	Very low	45.6	Very low	140 Å²	140	122.9 Å²	122.9	75%	0.749	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-84.7	-12.2	178.1	-75.4	-28.7	0	0	0	114	S487 K491	S487-D489 VanDerWaalsContact C-N 3.34Å; S487-D489 PolarHBondContact O-N 3.19Å; D489-K491 VanDerWaalsContact C-N 3.29Å; D489-K491 PolarHBondContact O-N 3.4Å
490	N	36	Very low	43.8	Very low	144 Å²	144	123 Å²	123	77%	0.77	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-84.4	0.8	173.7	-87.3	-6.1	0	0	0	113.8	S487	S487-N490 PolarHBondContact O-N 3.34Å
491	K	36.8	Very low	42.4	Very low	182 Å²	182	125.9 Å²	125.9	79%	0.791	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-99.5	8.6	-179	-144.1	173.9	-176.6	179	0	114.2	D489	D489-K491 VanDerWaalsContact C-N 3.29Å; D489-K491 PolarHBondContact O-N 3.4Å
492	R	38.9	Very low	41.1	Very low	228 Å²	228	129 Å²	129	86%	0.86	74%	0.735	S	S	*	*	S	Bend	trans	-123.1	13.3	-177.9	-71.8	-175.7	174.4	177.4	-1.7	115.1
493	K	37.7	Very low	39.9	Very low	201 Å²	201	128.3 Å²	128.3	87%	0.874	74%	0.737	S	S	*	*	S	Bend	trans	-134.7	20.9	-178.8	-94.5	-174.6	176.9	180	0	115.7
494	S	34.3	Very low	39.5	Very low	101 Å²	101	127 Å²	127	71%	0.706	74%	0.736	S	S	*	*			trans	-112.9	62.7	179.4	66.4	0	0	0	0	112.7
495	E	36.7	Very low	39.9	Very low	195 Å²	195	121.1 Å²	121.1	91%	0.911	72%	0.722	S	S	*	*			trans	-140.6	68.2	163.7	-75.5	-171	169.5	0	0	108.9
496	S	38.8	Very low	40.2	Very low	113 Å²	113	120.4 Å²	120.4	79%	0.79	71%	0.713	S	S	*	*	S	Bend	trans	-167.7	118.8	156.2	62.8	0	0	0	0	108.3
497	G	32.3	Very low	41	Very low	87 Å²	87	121.8 Å²	121.8	90%	0.897	71%	0.713	S	S	*	*			trans	-59.1	143.1	-176.5	0	0	0	0	0	113.5
498	G	34.5	Very low	41.8	Very low	75 Å²	75	123.8 Å²	123.8	77%	0.773	72%	0.716	S	S	*	*			trans	172.6	88.7	177.2	0	0	0	0	0	113.4
499	D	38.3	Very low	42.9	Very low	127 Å²	127	125.6 Å²	125.6	68%	0.679	72%	0.724	S	S	*	*			trans	56	97.4	148.6	-151.2	10.5	0	0	0	119.6	S501	D499-S501 PolarHBondContact O-N 3.2Å; D499-S501 VanDerWaalsContact O-N 3.08Å
500	A	38	Very low	43.3	Very low	103 Å²	103	124.2 Å²	124.2	85%	0.851	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	26.7	-177.3	0	0	0	0	0	115.2
501	S	46.1	Very low	44	Very low	75 Å²	75	128.3 Å²	128.3	52%	0.524	72%	0.721	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.4	-16.9	-172.6	179.7	0	0	0	0	114.8	D499	D499-S501 PolarHBondContact O-N 3.2Å; D499-S501 VanDerWaalsContact O-N 3.08Å
502	K	48.9	Very low	44.5	Very low	158 Å²	158	123.8 Å²	123.8	69%	0.687	70%	0.704	S	S	*	*	H	α-helix	trans	-85.7	-22.1	-164.2	-67	-179.6	179.7	177.2	0	118.7
503	P	42.6	Very low	44.8	Very low	97 Å²	97	121.2 Å²	121.2	63%	0.63	69%	0.694	S	S	*	*	H	α-helix	trans	-86	-12.2	179.2	31.3	-30	0	0	0	113.9
504	A	50.7	Low	45.4	Very low	70 Å²	70	117.6 Å²	117.6	58%	0.579	69%	0.692	S	S	*	*	H	α-helix	trans	-88	-25.4	177.6	0	0	0	0	0	113.1	N508	A504-N508 PolarHBondContact O-N 2.95Å
505	A	54.2	Low	46.4	Very low	58 Å²	58	118.8 Å²	118.8	48%	0.479	69%	0.686	S	S	.	*	H	α-helix	trans	-68.8	-42.1	178.5	0	0	0	0	0	112.4	L507 N508 T509	A505-L507 PolarHBondContact O-N 2.9Å; A505-N508 PolarHBondContact O-N 3.45Å; A505-T509 PolarHBondContact O-N 2.96Å; A505-T509 VanDerWaalsContact O-N 3.1Å; A505-T509 PolarHBondContact O-OG1 3.28Å
506	L	47.4	Very low	46.9	Very low	119 Å²	119	115.3 Å²	115.3	62%	0.623	67%	0.669	S	S	*	*	H	α-helix	trans	-66.7	-34.1	-179.9	-83.6	165.3	0	0	0	113.6	N508 L510	L506-N508 VanDerWaalsContact C-N 3.34Å; L506-L510 VanDerWaalsContact O-CG 3.32Å; L506-L510 WeakPolarHBondContact O-CG 3.23Å; L506-L510 PolarHBondContact O-N 3.43Å
507	L	53.5	Low	47.1	Very low	111 Å²	111	114.5 Å²	114.5	58%	0.581	66%	0.664	S	S	*	*	H	α-helix	trans	-73.5	-27.5	177.5	-76.7	166.3	0	0	0	112.6	A505	A505-L507 PolarHBondContact O-N 2.9Å
508	N	53.7	Low	47.4	Very low	142 Å²	142	121 Å²	121	76%	0.759	66%	0.662	S	S	*	*	H	α-helix	trans	-79.7	-33.2	176.3	-140.7	17.5	0	0	0	111.7	A504 A505 L506 L510	A504-N508 PolarHBondContact O-N 2.95Å; A505-N508 PolarHBondContact O-N 3.45Å; L506-N508 VanDerWaalsContact C-N 3.34Å; N508-L510 VanDerWaalsContact C-N 3.33Å
509	T	60.7	Low	47.5	Very low	112 Å²	112	123.8 Å²	123.8	69%	0.687	66%	0.663	S	S	*	*	H	α-helix	trans	-67.1	-32.3	173.4	-50.1	0	0	0	0	112.4	A505	A505-T509 PolarHBondContact O-N 2.96Å; A505-T509 VanDerWaalsContact O-N 3.1Å; A505-T509 PolarHBondContact O-OG1 3.28Å
510	L	49.5	Very low	47.5	Very low	111 Å²	111	121.5 Å²	121.5	58%	0.581	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	0.5	-176.7	-67.9	170	0	0	0	114.8	L506 N508 I512	L506-L510 VanDerWaalsContact O-CG 3.32Å; L506-L510 WeakPolarHBondContact O-CG 3.23Å; L506-L510 PolarHBondContact O-N 3.43Å; N508-L510 VanDerWaalsContact C-N 3.33Å; L510-I512 HydrophobicContact CB-CD1 3.96Å; L510-I512 HydrophobicContact CB-CG1 3.83Å; L510-I512 HydrophobicContact CD1-CD1 4.48Å; L510-I512 VanDerWaalsContact O-CG1 3.23Å; L510-I512 WeakPolarHBondContact O-CG1 3.39Å; L510-I512 PolarHBondContact O-N 3.1Å
511	R	50.6	Low	47.2	Very low	230 Å²	230	119.9 Å²	119.9	87%	0.868	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.1	29.2	-179.2	-74.5	-174.5	171.9	169.9	-0.4	114.5	R513	R511-R513 PolarHBondContact O-N 3.25Å
512	I	46.9	Very low	46.7	Very low	87 Å²	87	125.4 Å²	125.4	45%	0.446	67%	0.67	S	S	.	*			trans	-86.1	114.8	-178.4	-54.2	-175.8	0	0	0	108.3	L510 Q516	L510-I512 HydrophobicContact CB-CD1 3.96Å; L510-I512 HydrophobicContact CB-CG1 3.83Å; L510-I512 HydrophobicContact CD1-CD1 4.48Å; L510-I512 VanDerWaalsContact O-CG1 3.23Å; L510-I512 WeakPolarHBondContact O-CG1 3.39Å; L510-I512 PolarHBondContact O-N 3.1Å; I512-Q516 HydrophobicContact CG2-CB 3.94Å
513	R	46.2	Very low	45.9	Very low	173 Å²	173	124 Å²	124	65%	0.653	68%	0.675	S	S	*	*			trans	-72.4	147.1	179.2	-71.1	-178.9	173.9	178.9	0.1	110.1	R511 H515 Q516	R511-R513 PolarHBondContact O-N 3.25Å; R513-H515 WeakPolarHBondContact CB-CE1 3.32Å; R513-H515 WeakPolarHBondContact CB-ND1 3.44Å; R513-H515 PolarHBondContact O-N 2.89Å; R513-Q516 WeakPolarHBondContact O-CB 3.3Å; R513-Q516 PolarHBondContact O-N 2.96Å
514	P	49.7	Very low	45.4	Very low	126 Å²	126	126 Å²	126	82%	0.818	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-10.8	-174	-22.2	31.5	0	0	0	116.1
515	H	55.6	Low	44.5	Very low	125 Å²	125	132 Å²	132	58%	0.579	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-10	176	68.8	-85.7	0	0	0	113.6	R513	R513-H515 WeakPolarHBondContact CB-CE1 3.32Å; R513-H515 WeakPolarHBondContact CB-ND1 3.44Å; R513-H515 PolarHBondContact O-N 2.89Å
516	Q	46.6	Very low	43.6	Very low	122 Å²	122	138.1 Å²	138.1	57%	0.57	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-0.1	-179.6	-70.4	174.9	-37.4	0	0	113.3	I512 R513	I512-Q516 HydrophobicContact CG2-CB 3.94Å; R513-Q516 WeakPolarHBondContact O-CB 3.3Å; R513-Q516 PolarHBondContact O-N 2.96Å
517	S	42.4	Very low	43.2	Very low	97 Å²	97	140.1 Å²	140.1	68%	0.678	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	11.4	176.5	71.9	0	0	0	0	114.5	T519	S517-T519 PolarHBondContact O-N 3.2Å; S517-T519 VanDerWaalsContact O-N 3.14Å
518	R	38.8	Very low	42.3	Very low	224 Å²	224	139.4 Å²	139.4	85%	0.845	73%	0.73	S	S	*	*			trans	-77.9	102.7	176.3	-80.7	-172.8	164.5	-168.9	-3.4	111	A520	R518-A520 PolarHBondContact O-N 3.09Å; R518-A520 VanDerWaalsContact O-N 3.11Å
519	T	37.6	Very low	41.5	Very low	132 Å²	132	138.9 Å²	138.9	81%	0.81	73%	0.732	S	S	*	*			trans	-30.3	109.6	162.4	-49.5	0	0	0	0	111.7	S517 G521	S517-T519 PolarHBondContact O-N 3.2Å; S517-T519 VanDerWaalsContact O-N 3.14Å; T519-G521 PolarHBondContact O-N 2.84Å
520	A	37.2	Very low	40.2	Very low	79 Å²	79	142.6 Å²	142.6	65%	0.653	74%	0.739	S	S	*	*			trans	-70.8	96.6	-179.4	0	0	0	0	0	110.7	R518 F522	R518-A520 PolarHBondContact O-N 3.09Å; R518-A520 VanDerWaalsContact O-N 3.11Å; A520-F522 HydrophobicContact CB-CD2 4.22Å; A520-F522 HydrophobicContact CB-CE2 4.02Å; A520-F522 PolarHBondContact O-N 3.08Å
521	G	31.8	Very low	39.3	Very low	69 Å²	69	151.1 Å²	151.1	71%	0.711	77%	0.771	S	S	*	*			trans	-82.1	101.8	163.5	0	0	0	0	0	109.5	T519 T523	T519-G521 PolarHBondContact O-N 2.84Å; G521-T523 PolarHBondContact O-N 3.16Å
522	F	35.5	Very low	38.8	Very low	191 Å²	191	147.2 Å²	147.2	84%	0.838	77%	0.767	S	S	*	*			trans	-77.8	121.5	174.8	-87.8	-89.7	0	0	0	110.7	A520	A520-F522 HydrophobicContact CB-CD2 4.22Å; A520-F522 HydrophobicContact CB-CE2 4.02Å; A520-F522 PolarHBondContact O-N 3.08Å
523	T	32.2	Very low	38.3	Very low	128 Å²	128	150.3 Å²	150.3	79%	0.785	78%	0.783	S	S	*	*			trans	-118.3	109.7	167.4	-47.4	0	0	0	0	107.1	G521	G521-T523 PolarHBondContact O-N 3.16Å
524	L	33.6	Very low	37.9	Very low	139 Å²	139	149.1 Å²	149.1	73%	0.728	79%	0.791	S	S	*	*			trans	-86.3	111.1	172.2	-92.8	155.1	0	0	0	109.3	F526	L524-F526 HydrophobicContact CD2-CE2 4.01Å; L524-F526 HydrophobicContact CD2-CZ 4.31Å
525	K	31	Very low	37.2	Very low	197 Å²	197	150.4 Å²	150.4	86%	0.857	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-95.6	122.3	158.5	-92.3	-176.3	172.4	-177.8	0	107
526	F	35.3	Very low	36.1	Very low	187 Å²	187	152 Å²	152	82%	0.82	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-93.2	123.1	163.7	-83.4	-84.9	0	0	0	108.7	L524	L524-F526 HydrophobicContact CD2-CE2 4.01Å; L524-F526 HydrophobicContact CD2-CZ 4.31Å
527	D	38.2	Very low	35.4	Very low	160 Å²	160	154 Å²	154	86%	0.856	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-93	122.3	171	-127.8	-23.3	0	0	0	108.1	V529	D527-V529 PolarHBondContact O-N 3Å
528	A	34.5	Very low	34.8	Very low	96 Å²	96	158.1 Å²	158.1	79%	0.793	83%	0.828	S	S	*	*			trans	-93.3	69.5	-173	0	0	0	0	0	111.3
529	V	38.3	Very low	34.5	Very low	131 Å²	131	153 Å²	153	79%	0.794	83%	0.826	S	S	*	*			trans	-152.7	84.8	162.9	-170.6	0	0	0	0	109.9	D527	D527-V529 PolarHBondContact O-N 3Å
530	K	32.3	Very low	34.3	Very low	190 Å²	190	154.8 Å²	154.8	83%	0.826	83%	0.828	S	S	*	*			trans	165.2	130.1	152.3	-96.1	168.5	-177.6	-177.5	0	108
531	F	31.5	Very low	34	Very low	290 Å²	290	161.6 Å²	161.6	100%	1.272	84%	0.844	S	S	*	*			trans	91.1	0	-172.4	-61.5	-75.9	0	0	0	115.7

Retrieved 531 of 531 residues in 703.8 ms (Link to these results)

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